data_5nr5_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 5nr5 _Structure_validation_residue.Date_analyzed 2017-09-15 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 ' 1' ' ' MET . . . . . . . . . . . . . 64.6 ttp . . . . . 0 N--CA 1.471 0.606 0 CA-C-O 120.837 0.351 . . . . 0.0 111.247 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -141.24 159.17 62.25 Favored Pre-proline 0 CA--C 1.547 0.861 0 C-N-CA 126.181 1.792 . . . . 0.0 111.098 178.167 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -71.17 -13.07 30.91 Favored 'Trans proline' 0 C--N 1.35 0.658 0 C-N-CA 122.777 2.318 . . . . 0.0 114.624 176.556 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 97.8 mt -107.64 45.96 0.97 Allowed 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 126.186 1.795 . . . . 0.0 112.918 -173.414 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 37.3 m-20 -105.49 -0.57 25.8 Favored 'General case' 0 N--CA 1.48 1.036 0 N-CA-C 114.67 1.359 . . . . 0.0 114.67 173.421 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -126.92 -58.8 1.29 Allowed 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 124.165 0.986 . . . . 0.0 113.625 -164.99 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.6 pp -109.19 5.37 9.24 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.786 0 C-N-CA 125.767 1.627 . . . . 0.0 113.227 -175.947 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 14.1 tt -45.57 -45.62 4.39 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.085 0 N-CA-C 115.398 1.629 . . . . 0.0 115.398 -170.638 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -144.74 22.86 1.6 Allowed 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 124.874 1.27 . . . . 0.0 112.892 -168.407 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -83.05 12.72 4.68 Favored 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 115.526 1.676 . . . . 0.0 115.526 -161.441 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 12.9 tt -146.23 26.51 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.913 0 C-N-CA 125.538 1.535 . . . . 0.0 113.7 -178.715 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 87.6 tttt . . . . . 0 N--CA 1.476 0.871 0 N-CA-C 114.195 1.183 . . . . 0.0 114.195 177.936 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 65.0 mt . . . . . 0 CA--C 1.541 0.618 0 N-CA-C 112.17 0.433 . . . . 0.0 112.17 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 18.8 t -73.21 168.4 19.2 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 123.579 0.752 . . . . 0.0 110.642 170.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -57.76 -46.94 83.84 Favored 'General case' 0 N--CA 1.475 0.791 0 O-C-N 120.49 -1.381 . . . . 0.0 112.657 -175.465 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 10.4 tt0 -70.79 -42.42 70.36 Favored 'General case' 0 N--CA 1.47 0.529 0 O-C-N 121.5 -0.75 . . . . 0.0 111.105 177.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 31.1 mm-40 -57.37 -45.71 84.13 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.952 0.901 . . . . 0.0 111.095 176.297 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 41.3 ttmt -61.49 -40.59 95.12 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 124.514 1.126 . . . . 0.0 111.292 177.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 56.4 mt -66.85 -40.42 85.81 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 CA-C-O 118.103 -0.951 . . . . 0.0 111.327 175.261 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 42.7 mt -63.51 -45.29 98.18 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.98 0 CA-C-N 120.828 1.649 . . . . 0.0 110.468 177.343 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -58.75 -48.91 79.57 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.359 1.064 . . . . 0.0 110.917 176.328 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -67.21 -52.1 45.3 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.97 1.308 . . . . 0.0 112.978 -179.19 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.9 mm-40 -60.84 -27.65 68.24 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-N 119.104 0.866 . . . . 0.0 112.793 -179.247 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -68.04 -58.15 4.96 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 123.392 0.677 . . . . 0.0 110.967 175.061 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 79.7 mt -62.6 -34.11 63.36 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.453 0 C-N-CA 126.649 1.979 . . . . 0.0 111.447 178.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -70.39 -25.86 63.44 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.105 0.962 . . . . 0.0 112.791 176.808 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -89.75 -39.11 13.35 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.26 1.024 . . . . 0.0 112.214 175.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.3 m -111.12 -5.2 11.21 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.147 0 N-CA-C 114.541 1.312 . . . . 0.0 114.541 -172.02 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 86.98 26.13 32.4 Favored Glycine 0 N--CA 1.473 1.117 0 C-N-CA 124.641 1.115 . . . . 0.0 115.737 159.508 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 55.9 10.98 0.63 Allowed 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 127.42 2.288 . . . . 0.0 115.18 -175.013 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 5.2 pt20 -124.06 -3.99 8.02 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 125.338 1.455 . . . . 0.0 113.573 -170.453 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 61.9 m-80 -122.01 0.4 9.66 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.09 1.356 . . . . 0.0 113.034 174.377 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 18.8 pt -76.86 154.52 5.63 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 C-N-CA 123.219 0.608 . . . . 0.0 111.597 176.364 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -139.16 145.05 38.89 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 125.045 1.338 . . . . 0.0 109.59 179.417 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -62.01 -27.58 68.97 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 118.875 0.761 . . . . 0.0 112.049 179.35 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -65.26 -49.94 76.15 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.432 0 C-N-CA 125.241 1.416 . . . . 0.0 109.888 175.179 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 76.5 m -78.49 -43.0 28.1 Favored 'General case' 0 C--O 1.222 -0.394 0 C-N-CA 123.685 0.794 . . . . 0.0 109.967 -175.04 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 24.2 tp -61.13 -34.35 74.85 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 124.962 1.305 . . . . 0.0 112.045 174.085 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 47.0 t -56.05 -31.51 63.23 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.149 0.98 . . . . 0.0 113.179 168.368 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -101.93 -19.06 15.4 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 125.254 1.422 . . . . 0.0 114.441 -175.565 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 68.8 mmtt -66.89 -40.35 87.74 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 124.386 1.074 . . . . 0.0 110.5 171.551 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.7 mp -106.74 -2.4 21.6 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.254 1.422 . . . . 0.0 114.438 -175.159 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 50.6 m-80 54.79 49.05 18.77 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 125.521 1.528 . . . . 0.0 112.457 -172.947 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 15.3 pt -107.05 -162.01 0.15 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.662 0 C-N-CA 126.419 1.887 . . . . 0.0 110.994 -179.309 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 47.0 p -97.02 159.75 14.73 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 124.508 1.123 . . . . 0.0 111.316 167.125 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 93.5 t -62.06 -23.78 32.63 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.876 0 O-C-N 121.574 -0.704 . . . . 0.0 111.21 169.559 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 13.7 mp0 -81.43 -32.24 32.77 Favored 'General case' 0 CA--C 1.531 0.236 0 O-C-N 120.689 -1.257 . . . . 0.0 110.298 -176.654 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 41.0 mttm -66.79 -52.99 37.6 Favored 'General case' 0 C--N 1.346 0.43 0 CA-C-N 118.634 0.652 . . . . 0.0 110.256 165.044 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -57.8 -41.5 82.3 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 124.052 0.941 . . . . 0.0 112.362 -172.393 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt -73.36 -27.65 61.61 Favored 'General case' 0 N--CA 1.463 0.184 0 C-N-CA 125.489 1.516 . . . . 0.0 111.976 179.347 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -60.74 -45.37 94.57 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 118.067 0.394 . . . . 0.0 111.571 176.929 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 66.2 m-85 -59.96 -44.98 94.08 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 124.875 1.27 . . . . 0.0 111.046 179.153 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 95.3 mt -64.39 -29.58 47.75 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.709 0 C-N-CA 124.459 1.104 . . . . 0.0 111.308 -178.572 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 50.0 mmtt -83.21 -36.57 24.53 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 125.472 1.509 . . . . 0.0 113.509 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 5.7 p30 . . . . . 0 N--CA 1.466 0.341 0 CA-C-N 119.976 1.262 . . . . 0.0 112.004 -179.915 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 . . . . . 0 N--CA 1.475 0.783 0 N-CA-C 112.404 0.52 . . . . 0.0 112.404 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 55.79 48.13 18.88 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 125.951 1.701 . . . . 0.0 114.885 -179.128 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 20.8 t -131.52 135.89 58.36 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 C-N-CA 124.929 1.292 . . . . 0.0 111.434 178.221 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 50.1 m 52.72 31.96 11.24 Favored 'General case' 0 N--CA 1.483 1.184 0 N-CA-C 116.018 1.859 . . . . 0.0 116.018 170.053 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 32.3 t -149.54 -46.44 0.14 Allowed 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 124.354 1.062 . . . . 0.0 112.614 178.812 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 62.5 mtt -127.02 51.94 1.83 Allowed 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 125.414 1.486 . . . . 0.0 111.163 179.741 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -77.96 50.87 0.91 Allowed 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 125.9 1.68 . . . . 0.0 112.488 -178.485 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -135.87 166.11 24.06 Favored 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 125.989 1.716 . . . . 0.0 112.943 -172.852 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 65.2 pttt . . . . . 0 N--CA 1.476 0.855 0 C-N-CA 125.902 1.681 . . . . 0.0 112.589 176.297 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 58.6 ttm . . . . . 0 CA--C 1.538 0.495 0 N-CA-C 109.954 -0.387 . . . . 0.0 109.954 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 -136.68 153.58 75.93 Favored Pre-proline 0 CA--C 1.547 0.857 0 C-N-CA 125.049 1.34 . . . . 0.0 112.05 179.019 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 96.1 Cg_endo -79.56 -0.68 10.9 Favored 'Trans proline' 0 C--N 1.35 0.651 0 C-N-CA 123.581 2.854 . . . . 0.0 114.909 -178.718 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 89.1 mt -112.27 42.57 1.77 Allowed 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.899 1.68 . . . . 0.0 112.535 -174.584 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -112.6 0.8 15.54 Favored 'General case' 0 N--CA 1.478 0.969 0 N-CA-C 114.652 1.353 . . . . 0.0 114.652 175.761 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -117.4 -55.67 2.29 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 124.311 1.044 . . . . 0.0 113.175 -168.453 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -130.07 17.7 2.26 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.767 0 C-N-CA 126.138 1.775 . . . . 0.0 112.928 -175.301 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 9.9 tt -46.25 125.62 1.54 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 C-N-CA 124.461 1.105 . . . . 0.0 112.282 177.304 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -145.99 5.86 1.01 Allowed 'General case' 0 CA--C 1.545 0.759 0 N-CA-C 113.83 1.048 . . . . 0.0 113.83 -179.467 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -83.19 10.23 8.81 Favored 'General case' 0 CA--C 1.547 0.831 0 N-CA-C 114.553 1.316 . . . . 0.0 114.553 -172.55 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 7.1 tp -143.64 28.39 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.775 0 C-N-CA 126.607 1.963 . . . . 0.0 112.434 -177.416 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 88.8 tttt . . . . . 0 N--CA 1.472 0.668 0 N-CA-C 114.523 1.305 . . . . 0.0 114.523 -178.438 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 27.3 mt . . . . . 0 CA--C 1.541 0.627 0 CA-C-O 120.755 0.312 . . . . 0.0 111.032 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 19.2 t -72.0 170.52 13.66 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.29 0.636 . . . . 0.0 110.417 167.341 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -58.95 -47.37 85.32 Favored 'General case' 0 N--CA 1.473 0.678 0 O-C-N 120.479 -1.388 . . . . 0.0 112.404 -175.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 12.0 tt0 -70.06 -41.27 74.38 Favored 'General case' 0 N--CA 1.471 0.575 0 O-C-N 121.494 -0.754 . . . . 0.0 111.256 178.454 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 38.4 mm-40 -58.55 -44.23 89.57 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.831 1.252 . . . . 0.0 111.301 175.45 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 19.7 ttmm -63.14 -41.89 99.37 Favored 'General case' 0 N--CA 1.471 0.604 0 O-C-N 121.056 -1.028 . . . . 0.0 111.065 175.106 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 57.3 mt -67.61 -40.86 84.93 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 CA-C-O 117.713 -1.137 . . . . 0.0 111.879 178.583 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 34.8 mt -63.82 -43.89 98.02 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 CA-C-N 121.384 1.902 . . . . 0.0 109.954 176.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -59.39 -45.95 90.05 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.651 1.18 . . . . 0.0 110.91 177.214 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -66.45 -51.59 55.26 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.949 1.3 . . . . 0.0 112.984 176.55 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -58.18 -31.34 67.2 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 119.289 0.949 . . . . 0.0 112.752 179.716 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -66.5 -56.36 11.27 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 118.516 0.598 . . . . 0.0 110.748 177.492 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 84.1 mt -63.32 -33.26 60.12 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.417 0 C-N-CA 126.758 2.023 . . . . 0.0 111.478 177.72 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -71.54 -27.72 63.37 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 123.873 0.869 . . . . 0.0 112.552 176.825 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -87.54 -39.72 14.9 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.317 1.047 . . . . 0.0 112.206 176.47 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.4 m -108.27 -4.16 10.4 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.161 0 N-CA-C 114.221 1.193 . . . . 0.0 114.221 -173.854 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 84.47 23.03 52.41 Favored Glycine 0 N--CA 1.471 1.01 0 C-N-CA 125.134 1.35 . . . . 0.0 115.345 160.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 58.33 5.0 0.37 Allowed 'General case' 0 CA--C 1.554 1.126 0 C-N-CA 127.382 2.273 . . . . 0.0 115.104 -171.028 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 29.1 mt-30 -101.5 -16.22 16.87 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 125.66 1.584 . . . . 0.0 112.857 -172.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 42.3 m-80 -125.88 5.74 7.33 Favored 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 113.804 1.038 . . . . 0.0 113.804 -172.789 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 21.1 pt -77.61 154.09 5.36 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 O-C-N 121.776 -0.578 . . . . 0.0 111.781 174.678 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -140.02 142.74 36.21 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 124.777 1.231 . . . . 0.0 109.427 177.999 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -59.47 -26.3 65.12 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 119.252 0.933 . . . . 0.0 112.597 -179.121 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.9 mp -69.71 -42.31 80.25 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 C-N-CA 126.101 1.76 . . . . 0.0 110.864 175.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 95.9 m -80.9 -42.31 21.61 Favored 'General case' 0 C--O 1.224 -0.288 0 C-N-CA 123.472 0.709 . . . . 0.0 109.777 -179.133 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 14.5 tp -61.97 -37.96 86.73 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 125.978 1.711 . . . . 0.0 111.523 175.324 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.421 ' HA ' HG13 ' A' ' 66' ' ' ILE . 57.3 p -62.28 -23.81 66.93 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 113.363 0.875 . . . . 0.0 113.363 172.119 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 66.5 mttm -101.72 -28.48 12.45 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 125.221 1.409 . . . . 0.0 114.278 -176.432 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 10.7 mmtm -63.13 -33.23 75.02 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 125.396 1.479 . . . . 0.0 111.846 174.548 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.9 mt -118.75 0.81 11.52 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 126.531 1.932 . . . . 0.0 113.011 -169.497 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 42.5 m-80 53.69 59.07 4.56 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 126.222 1.809 . . . . 0.0 113.028 -178.288 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.421 HG13 ' HA ' ' A' ' 61' ' ' SER . 0.8 OUTLIER -131.47 175.39 11.35 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.717 0 C-N-CA 126.93 2.092 . . . . 0.0 111.693 -172.277 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -74.6 154.84 38.38 Favored 'General case' 0 N--CA 1.473 0.706 0 O-C-N 121.408 -0.807 . . . . 0.0 111.144 172.748 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 69.3 t -64.89 -27.65 42.94 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 C-N-CA 123.816 0.846 . . . . 0.0 111.565 171.406 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -79.69 -29.77 40.88 Favored 'General case' 0 N--CA 1.466 0.366 0 O-C-N 121.086 -1.008 . . . . 0.0 110.822 179.768 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 4.7 ttmm -72.82 -46.21 54.31 Favored 'General case' 0 C--N 1.341 0.201 0 C-N-CA 124.225 1.01 . . . . 0.0 110.717 171.619 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -60.49 -49.04 79.14 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 125.059 1.344 . . . . 0.0 112.621 178.355 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 18.3 ptmt -69.43 -27.03 64.91 Favored 'General case' 0 N--CA 1.469 0.475 0 O-C-N 121.165 -0.96 . . . . 0.0 111.471 -177.463 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -57.16 -36.3 70.59 Favored 'General case' 0 CA--C 1.549 0.909 0 CA-C-N 118.152 0.433 . . . . 0.0 112.135 177.539 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 29.5 m-85 -68.2 -45.17 74.1 Favored 'General case' 0 C--O 1.225 -0.19 0 C-N-CA 125.084 1.353 . . . . 0.0 110.744 175.659 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 56.1 mt -65.55 -33.6 64.73 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.562 0 C-N-CA 124.47 1.108 . . . . 0.0 111.145 -179.702 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 72.6 mmtt -75.49 -38.25 59.65 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 124.205 1.002 . . . . 0.0 112.609 -178.033 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 6.7 p30 . . . . . 0 C--N 1.344 0.341 0 CA-C-N 119.514 1.052 . . . . 0.0 110.703 176.471 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 . . . . . 0 CA--C 1.543 0.696 0 N-CA-C 112.528 0.566 . . . . 0.0 112.528 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -82.73 60.28 5.2 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 125.78 1.632 . . . . 0.0 112.72 -174.304 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 88.8 t -137.64 148.24 25.81 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 C-N-CA 125.838 1.655 . . . . 0.0 110.524 -178.792 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 10.7 t 65.44 -54.65 0.34 Allowed 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 128.061 2.544 . . . . 0.0 115.735 179.03 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 50.0 m -65.56 -33.08 75.07 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 124.159 0.984 . . . . 0.0 112.316 176.629 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 22.4 mmt -138.6 143.67 39.45 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 126.759 2.024 . . . . 0.0 109.419 165.003 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 15.1 tt0 -146.55 3.37 0.86 Allowed 'General case' 0 CA--C 1.551 1.001 0 N-CA-C 113.573 0.953 . . . . 0.0 113.573 -179.332 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -81.96 153.24 26.36 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 124.767 1.227 . . . . 0.0 113.044 -177.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 75.8 mmtt . . . . . 0 N--CA 1.483 1.183 0 C-N-CA 125.816 1.646 . . . . 0.0 113.99 179.551 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 52.0 ttm . . . . . 0 N--CA 1.469 0.523 0 N-CA-C 109.98 -0.378 . . . . 0.0 109.98 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -152.17 138.49 11.85 Favored Pre-proline 0 CA--C 1.551 1.002 0 C-N-CA 124.645 1.178 . . . . 0.0 111.749 -173.42 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 81.6 Cg_endo -82.8 -2.57 10.95 Favored 'Trans proline' 0 C--N 1.352 0.732 0 C-N-CA 123.287 2.658 . . . . 0.0 115.919 -176.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 67.3 mt -109.54 38.99 2.19 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 125.366 1.466 . . . . 0.0 113.227 -174.066 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -104.68 -0.49 27.44 Favored 'General case' 0 N--CA 1.48 1.035 0 N-CA-C 115.387 1.625 . . . . 0.0 115.387 175.454 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -115.68 -56.28 2.35 Favored 'General case' 0 N--CA 1.484 1.231 0 N-CA-C 113.598 0.962 . . . . 0.0 113.598 -167.534 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.9 pp -129.3 12.68 2.59 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.896 0 C-N-CA 126.005 1.722 . . . . 0.0 112.963 -171.599 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 12.9 tt -40.95 123.84 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.947 0 C-N-CA 125.646 1.579 . . . . 0.0 113.902 -177.419 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -153.67 120.85 5.76 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.452 1.501 . . . . 0.0 108.787 172.473 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 30.1 t0 -161.96 70.7 0.33 Allowed 'General case' 0 N--CA 1.469 0.51 0 CA-C-O 122.352 1.072 . . . . 0.0 109.148 -178.81 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 54.7 mt 53.41 63.01 0.21 Allowed 'Isoleucine or valine' 0 CA--C 1.548 0.867 0 C-N-CA 125.699 1.6 . . . . 0.0 110.414 -169.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 4.0 tmmm? . . . . . 0 N--CA 1.478 0.944 0 C-N-CA 124.882 1.273 . . . . 0.0 112.325 176.245 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 70.5 mt . . . . . 0 CA--C 1.537 0.447 0 N-CA-C 112.705 0.631 . . . . 0.0 112.705 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 28.1 m -73.43 166.94 22.28 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 124.2 1.0 . . . . 0.0 110.332 170.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -54.37 -43.63 71.52 Favored 'General case' 0 N--CA 1.474 0.765 0 O-C-N 121.132 -0.98 . . . . 0.0 113.052 -175.246 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 8.3 pt20 -75.06 -35.46 61.85 Favored 'General case' 0 N--CA 1.471 0.621 0 O-C-N 121.472 -0.767 . . . . 0.0 112.532 176.603 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 15.6 mm-40 -66.73 -41.09 88.44 Favored 'General case' 0 CA--C 1.537 0.445 0 O-C-N 121.686 -0.634 . . . . 0.0 110.487 179.789 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 15.3 ttmm -59.5 -41.68 90.46 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 123.867 0.867 . . . . 0.0 111.114 174.116 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 56.8 mt -68.41 -39.5 80.89 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.656 0 CA-C-O 117.856 -1.069 . . . . 0.0 111.388 176.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 27.5 mt -66.58 -42.42 89.91 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.976 0 CA-C-N 121.254 1.843 . . . . 0.0 110.629 178.003 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -55.47 -48.57 74.33 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 124.092 0.957 . . . . 0.0 110.017 175.004 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -67.55 -52.28 40.67 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.763 1.225 . . . . 0.0 113.659 178.649 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 52.8 mt-10 -60.15 -29.06 68.41 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-N 119.077 0.853 . . . . 0.0 112.889 -179.048 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -69.11 -54.04 17.08 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 118.613 0.642 . . . . 0.0 111.216 177.149 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 46.5 mt -61.01 -33.92 57.77 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.537 0 C-N-CA 125.281 1.432 . . . . 0.0 111.342 174.281 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -70.21 -22.83 62.88 Favored 'General case' 0 CA--C 1.546 0.816 0 O-C-N 121.211 -0.931 . . . . 0.0 113.064 175.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -93.03 -32.78 14.37 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.794 1.237 . . . . 0.0 112.916 178.644 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 4.7 m -121.9 -19.09 4.61 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.953 0 CA-C-N 119.595 1.089 . . . . 0.0 113.832 -174.006 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 86.18 142.19 6.59 Favored Glycine 0 CA--C 1.532 1.154 0 C-N-CA 125.247 1.404 . . . . 0.0 112.7 -171.787 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 46.4 tp -57.84 -19.75 31.19 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 125.484 1.514 . . . . 0.0 114.406 -177.432 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 35.9 mt-30 -80.75 -17.01 52.36 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 126.911 2.084 . . . . 0.0 113.033 -179.884 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 68.9 m-80 -115.81 -8.68 11.96 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 114.837 1.421 . . . . 0.0 114.837 -173.402 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 20.9 pt -68.21 156.8 6.75 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.546 0 C-N-CA 123.388 0.675 . . . . 0.0 111.736 169.871 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -131.25 149.61 52.5 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 124.269 1.027 . . . . 0.0 111.175 177.028 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -64.3 -27.07 68.78 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 123.645 0.778 . . . . 0.0 111.939 178.442 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -66.57 -50.21 68.5 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.399 0 C-N-CA 124.6 1.16 . . . . 0.0 109.13 173.882 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 82.9 m -73.01 -43.2 62.41 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 123.373 0.669 . . . . 0.0 110.868 -176.743 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 20.2 tp -63.95 -34.92 79.07 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.14 1.376 . . . . 0.0 111.862 176.101 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.452 ' HA ' HG13 ' A' ' 66' ' ' ILE . 25.7 t -55.8 -30.21 60.98 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 124.836 1.255 . . . . 0.0 112.727 169.629 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 11.8 mptt -100.52 -28.7 12.76 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 125.373 1.469 . . . . 0.0 113.51 -175.531 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 15.9 mmtm -64.46 -38.13 89.96 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.932 1.293 . . . . 0.0 111.373 177.868 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.3 mp -111.37 7.72 21.03 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 125.013 1.325 . . . . 0.0 113.823 -178.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 17.0 t30 55.01 57.01 5.96 Favored 'General case' 0 CA--C 1.552 1.052 0 CA-C-O 122.393 1.092 . . . . 0.0 111.605 177.185 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.452 HG13 ' HA ' ' A' ' 61' ' ' SER . 3.4 pt -127.57 -168.8 0.58 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.772 0 C-N-CA 126.617 1.967 . . . . 0.0 110.424 -173.627 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 41.7 p -89.25 160.63 16.83 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 123.935 0.894 . . . . 0.0 111.594 171.446 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 64.7 t -64.5 -23.67 33.92 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.944 0 O-C-N 121.658 -0.651 . . . . 0.0 111.209 168.406 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 26.3 mm-40 -78.61 -35.06 46.19 Favored 'General case' 0 N--CA 1.464 0.267 0 O-C-N 120.815 -1.178 . . . . 0.0 110.387 -177.481 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 35.2 mttm -65.05 -54.18 34.18 Favored 'General case' 0 C--N 1.346 0.432 0 CA-C-N 118.446 0.566 . . . . 0.0 110.587 166.836 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -56.75 -45.19 82.18 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.931 1.292 . . . . 0.0 112.311 -173.022 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 22.5 ttmm -68.65 -32.34 72.11 Favored 'General case' 0 CA--C 1.519 -0.228 0 C-N-CA 124.537 1.135 . . . . 0.0 111.203 178.459 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -63.34 -37.97 89.33 Favored 'General case' 0 CA--C 1.546 0.806 0 CA-C-O 118.793 -0.622 . . . . 0.0 112.578 179.575 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 79.5 m-85 -62.9 -42.91 99.95 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.52 1.128 . . . . 0.0 110.749 174.648 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 87.4 mt -71.03 -22.66 22.91 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.755 0 C-N-CA 125.057 1.343 . . . . 0.0 111.24 179.36 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 75.7 tttt -89.65 -32.96 16.83 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 125.572 1.549 . . . . 0.0 112.721 -177.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 8.9 p30 . . . . . 0 N--CA 1.467 0.384 0 CA-C-N 118.938 0.79 . . . . 0.0 111.617 170.918 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 22.1 mm-40 . . . . . 0 N--CA 1.477 0.887 0 N-CA-C 113.051 0.76 . . . . 0.0 113.051 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . 0.256 35.9 mt-10 52.65 38.96 27.41 Favored 'General case' 0 N--CA 1.48 1.062 0 N-CA-C 116.868 2.173 . . . . 0.0 116.868 172.139 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 33.1 t -81.7 146.82 6.74 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.327 0 C-N-CA 124.841 1.257 . . . . 0.0 111.671 -176.253 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 50.8 m 57.44 26.63 12.82 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 126.694 1.997 . . . . 0.0 115.252 177.721 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 23.2 t -149.65 -41.82 0.14 Allowed 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.559 1.144 . . . . 0.0 112.79 176.337 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 30.3 tpp -123.95 37.32 4.43 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 125.298 1.439 . . . . 0.0 111.889 -179.536 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -76.54 75.23 3.26 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 125.339 1.455 . . . . 0.0 111.504 -176.584 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -144.44 162.86 35.45 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 126.342 1.857 . . . . 0.0 111.979 -178.187 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 67.3 mttm . . . . . 0 N--CA 1.478 0.941 0 C-N-CA 125.643 1.577 . . . . 0.0 111.53 178.292 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.8 ttt . . . . . 0 N--CA 1.47 0.555 0 CA-C-O 120.532 0.206 . . . . 0.0 111.018 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 -141.24 147.02 45.29 Favored Pre-proline 0 CA--C 1.549 0.916 0 C-N-CA 125.241 1.417 . . . . 0.0 112.277 -175.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_endo -79.79 -22.42 7.66 Favored 'Trans proline' 0 C--N 1.35 0.641 0 C-N-CA 123.303 2.669 . . . . 0.0 115.199 -175.762 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 96.9 mt -113.17 42.43 1.92 Allowed 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.981 1.713 . . . . 0.0 112.084 -173.566 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -109.13 0.28 19.73 Favored 'General case' 0 N--CA 1.474 0.728 0 N-CA-C 114.661 1.356 . . . . 0.0 114.661 -177.927 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -126.26 -56.1 1.43 Allowed 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 124.574 1.149 . . . . 0.0 113.423 -164.308 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.9 pp -124.39 13.05 4.78 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 C-N-CA 126.223 1.809 . . . . 0.0 112.772 -173.478 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 11.4 tt -44.23 109.87 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.48 1.068 0 C-N-CA 125.693 1.597 . . . . 0.0 113.345 -177.602 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -150.95 14.95 0.73 Allowed 'General case' 0 N--CA 1.476 0.84 0 N-CA-C 115.173 1.546 . . . . 0.0 115.173 -177.373 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -86.3 8.84 19.77 Favored 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 115.15 1.537 . . . . 0.0 115.15 -170.346 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 6.8 tp -143.45 22.35 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.96 0 C-N-CA 125.547 1.539 . . . . 0.0 114.26 -173.153 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 50.1 mtmt . . . . . 0 N--CA 1.476 0.853 0 N-CA-C 114.508 1.299 . . . . 0.0 114.508 179.333 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.8 mt . . . . . 0 CA--C 1.543 0.681 0 N-CA-C 110.517 -0.179 . . . . 0.0 110.517 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 26.0 p -68.98 169.76 11.1 Favored 'General case' 0 N--CA 1.478 0.969 0 O-C-N 121.82 -0.55 . . . . 0.0 111.159 167.713 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -56.85 -44.36 82.05 Favored 'General case' 0 N--CA 1.473 0.71 0 O-C-N 120.909 -1.12 . . . . 0.0 111.766 176.377 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 9.3 tt0 -70.89 -44.91 65.32 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 123.587 0.755 . . . . 0.0 111.44 177.53 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 90.6 mt-30 -63.79 -37.19 86.43 Favored 'General case' 0 CA--C 1.534 0.363 0 O-C-N 121.722 -0.612 . . . . 0.0 111.777 179.433 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 23.6 ttmm -62.21 -43.5 98.68 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 123.805 0.842 . . . . 0.0 111.105 174.053 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 51.5 mt -65.24 -44.81 95.05 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 CA-C-N 119.021 0.828 . . . . 0.0 111.176 176.722 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 49.3 mt -64.81 -45.26 95.56 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 CA-C-N 120.095 1.316 . . . . 0.0 110.352 -179.711 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -57.09 -49.03 77.13 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 124.783 1.233 . . . . 0.0 110.357 176.838 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -65.94 -52.62 48.2 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 124.436 1.094 . . . . 0.0 112.601 179.116 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 18.7 mm-40 -60.96 -26.04 67.26 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 119.161 0.891 . . . . 0.0 113.089 -179.375 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -70.99 -59.12 2.96 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 123.979 0.912 . . . . 0.0 111.228 175.075 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 54.2 mt -60.12 -34.48 57.0 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 C-N-CA 126.229 1.812 . . . . 0.0 111.984 177.051 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -69.68 -24.82 63.65 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 123.953 0.901 . . . . 0.0 112.775 176.899 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -92.87 -29.41 15.95 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.497 1.119 . . . . 0.0 113.184 179.182 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 5.1 m -123.74 -22.82 2.6 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.981 0 N-CA-C 114.202 1.186 . . . . 0.0 114.202 -174.597 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 86.86 144.34 8.39 Favored Glycine 0 CA--C 1.534 1.275 0 C-N-CA 125.183 1.373 . . . . 0.0 113.373 -172.851 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -69.41 -5.37 23.2 Favored 'General case' 0 N--CA 1.478 0.967 0 N-CA-C 114.706 1.372 . . . . 0.0 114.706 -166.588 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 3.0 pm0 -101.54 -6.06 24.38 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 125.415 1.486 . . . . 0.0 114.087 173.63 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 76.4 m-20 -107.5 -12.08 15.36 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 124.57 1.148 . . . . 0.0 113.759 175.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 40.5 pt -68.07 157.49 6.28 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 C-N-CA 123.949 0.899 . . . . 0.0 111.27 164.691 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.3 p -124.54 144.24 50.24 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 125.002 1.321 . . . . 0.0 110.292 174.299 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -61.81 -30.77 71.05 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 124.182 0.993 . . . . 0.0 111.103 175.892 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -61.42 -58.33 8.06 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.256 0 C-N-CA 124.772 1.229 . . . . 0.0 108.565 174.811 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 46.7 m -69.91 -41.35 74.81 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 123.255 0.622 . . . . 0.0 110.649 -174.413 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 24.4 tp -60.94 -36.38 79.21 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 123.631 0.772 . . . . 0.0 112.032 174.197 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.425 ' HA ' HG13 ' A' ' 66' ' ' ILE . 10.8 p -62.21 -19.63 63.34 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 113.859 1.059 . . . . 0.0 113.859 173.667 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -105.21 -25.19 12.56 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 125.244 1.418 . . . . 0.0 114.665 176.299 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 22.1 mmtt -62.35 -35.8 80.24 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-N 119.778 1.172 . . . . 0.0 110.951 172.404 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 85.8 mt -113.8 -1.33 13.94 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 125.92 1.688 . . . . 0.0 114.029 -171.324 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 32.2 m-80 56.7 61.51 2.62 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 126.066 1.746 . . . . 0.0 113.386 -177.089 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.425 HG13 ' HA ' ' A' ' 61' ' ' SER . 0.5 OUTLIER -135.97 176.64 7.84 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.907 0 C-N-CA 126.486 1.915 . . . . 0.0 112.118 -171.0 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -71.22 154.19 41.86 Favored 'General case' 0 N--CA 1.476 0.829 0 O-C-N 121.307 -0.871 . . . . 0.0 111.535 173.007 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 86.3 t -65.13 -24.47 35.38 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 C-N-CA 124.084 0.954 . . . . 0.0 111.839 175.35 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 75.4 mm-40 -85.97 -35.36 20.47 Favored 'General case' 0 N--CA 1.469 0.484 0 O-C-N 120.907 -1.12 . . . . 0.0 110.67 176.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 45.3 tttt -65.01 -42.52 94.36 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 123.521 0.728 . . . . 0.0 111.117 177.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -58.56 -40.31 82.73 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 125.095 1.358 . . . . 0.0 112.296 170.617 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 23.0 ttpt -70.0 -32.17 70.22 Favored 'General case' 0 C--O 1.224 -0.261 0 C-N-CA 124.672 1.189 . . . . 0.0 111.29 -178.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -57.53 -37.69 73.48 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 123.168 0.587 . . . . 0.0 112.511 179.921 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 63.5 m-85 -66.25 -44.26 84.2 Favored 'General case' 0 N--CA 1.464 0.227 0 C-N-CA 125.088 1.355 . . . . 0.0 110.424 178.151 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 74.6 mt -64.62 -45.86 94.19 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.437 0 C-N-CA 124.751 1.22 . . . . 0.0 109.51 178.371 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 22.7 mmmt -65.72 -32.47 74.04 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 125.449 1.5 . . . . 0.0 112.712 -175.746 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 6.5 p30 . . . . . 0 CA--C 1.538 0.485 0 CA-C-N 119.259 0.936 . . . . 0.0 111.763 176.539 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 63.2 mm-40 . . . . . 0 N--CA 1.477 0.877 0 N-CA-C 113.165 0.802 . . . . 0.0 113.165 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 42.6 59.44 2.76 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 127.082 2.153 . . . . 0.0 115.09 175.46 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 12.3 t -77.23 61.04 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 C-N-CA 126.385 1.874 . . . . 0.0 112.277 -172.017 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 27.5 t -165.39 -42.73 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 125.375 1.47 . . . . 0.0 112.112 176.809 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 46.3 m -126.01 -22.71 4.07 Favored 'General case' 0 N--CA 1.479 0.999 0 N-CA-C 115.055 1.502 . . . . 0.0 115.055 -173.066 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 60.9 mtt -137.53 40.16 2.42 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 124.798 1.239 . . . . 0.0 111.72 -176.244 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 28.5 tt0 -77.2 70.39 3.59 Favored 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 126.168 1.787 . . . . 0.0 112.001 -176.202 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -143.84 149.78 37.48 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.153 1.381 . . . . 0.0 112.706 -178.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 67.2 mttm . . . . . 0 N--CA 1.483 1.189 0 N-CA-C 114.943 1.461 . . . . 0.0 114.943 -179.936 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 95.2 mtp . . . . . 0 N--CA 1.474 0.741 0 N-CA-C 110.815 -0.069 . . . . 0.0 110.815 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 17.6 m-20 -143.3 119.77 6.64 Favored Pre-proline 0 CA--C 1.549 0.924 0 C-N-CA 124.813 1.245 . . . . 0.0 111.405 178.252 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_endo -84.47 -12.1 7.92 Favored 'Trans proline' 0 C--N 1.351 0.661 0 C-N-CA 123.417 2.745 . . . . 0.0 115.173 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -107.9 29.66 7.06 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 125.549 1.539 . . . . 0.0 114.387 -166.601 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -104.66 -6.72 20.17 Favored 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 116.149 1.907 . . . . 0.0 116.149 -173.124 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.14 -28.55 1.71 Allowed 'General case' 0 N--CA 1.481 1.088 0 N-CA-C 117.059 2.244 . . . . 0.0 117.059 -169.482 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.3 pp -134.63 14.14 1.18 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.338 0 C-N-CA 125.545 1.538 . . . . 0.0 113.682 -178.036 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -56.1 114.02 0.59 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.848 0 C-N-CA 124.987 1.315 . . . . 0.0 111.792 -173.213 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -146.91 0.26 0.73 Allowed 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 113.862 1.06 . . . . 0.0 113.862 179.692 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -81.37 2.85 26.58 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 115.372 1.619 . . . . 0.0 115.372 -163.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 13.1 tt -145.31 24.71 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 C-N-CA 125.907 1.683 . . . . 0.0 113.637 -176.804 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 41.4 ttmt . . . . . 0 N--CA 1.472 0.671 0 C-N-CA 123.835 0.854 . . . . 0.0 113.125 174.158 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 5.0 mt . . . . . 0 CA--C 1.542 0.644 0 N-CA-C 110.136 -0.32 . . . . 0.0 110.136 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 73.4 m -72.95 164.02 27.29 Favored 'General case' 0 N--CA 1.479 1.009 0 O-C-N 121.869 -0.519 . . . . 0.0 110.514 170.162 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -55.42 -44.06 75.89 Favored 'General case' 0 N--CA 1.48 1.027 0 O-C-N 120.674 -1.266 . . . . 0.0 113.347 -172.832 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 6.1 pt20 -74.67 -36.75 62.81 Favored 'General case' 0 N--CA 1.47 0.565 0 O-C-N 121.482 -0.761 . . . . 0.0 112.486 174.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 89.7 mt-30 -63.81 -38.7 92.07 Favored 'General case' 0 N--CA 1.466 0.353 0 O-C-N 121.609 -0.682 . . . . 0.0 111.329 177.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 40.8 ttmt -61.91 -42.44 99.09 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 124.29 1.036 . . . . 0.0 111.063 176.763 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 44.5 mt -69.34 -42.44 81.23 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 CA-C-O 118.378 -0.82 . . . . 0.0 111.064 176.868 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 45.6 mt -63.6 -45.5 97.42 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.002 0 CA-C-N 120.278 1.399 . . . . 0.0 110.069 178.32 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -58.51 -48.65 80.11 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 125.301 1.44 . . . . 0.0 110.753 178.099 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -64.05 -52.63 58.51 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 124.461 1.104 . . . . 0.0 112.822 176.156 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.6 mm-40 -60.48 -32.15 71.14 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 118.964 0.802 . . . . 0.0 112.52 -179.456 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.5 t80 -65.71 -55.86 15.12 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 118.716 0.689 . . . . 0.0 110.642 176.939 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 66.6 mt -64.21 -34.59 69.97 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.251 0 C-N-CA 126.786 2.035 . . . . 0.0 111.739 179.205 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -68.82 -38.64 80.0 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 123.486 0.714 . . . . 0.0 111.336 175.705 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -77.42 -38.55 49.45 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.506 0.722 . . . . 0.0 112.548 179.525 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.3 m -108.64 -6.14 10.86 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.162 0 N-CA-C 114.25 1.204 . . . . 0.0 114.25 -174.206 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 86.75 26.02 33.42 Favored Glycine 0 N--CA 1.473 1.161 0 C-N-CA 124.775 1.179 . . . . 0.0 115.316 161.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 54.49 11.22 0.4 Allowed 'General case' 0 CA--C 1.554 1.115 0 C-N-CA 127.602 2.361 . . . . 0.0 115.32 -173.118 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 4.7 pt20 -121.47 -2.34 9.48 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 125.237 1.415 . . . . 0.0 113.546 -170.956 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 53.8 m-80 -125.59 2.73 7.58 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.03 1.332 . . . . 0.0 113.21 174.753 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 18.1 pt -75.16 152.19 6.55 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 CA-C-N 118.443 0.565 . . . . 0.0 111.459 175.214 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -138.81 145.06 39.64 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 124.327 1.051 . . . . 0.0 109.724 178.481 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -60.6 -26.66 67.14 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 119.259 0.936 . . . . 0.0 112.38 -179.296 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -70.27 -41.35 78.67 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.463 0 C-N-CA 126.086 1.754 . . . . 0.0 110.745 175.869 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 73.7 m -81.14 -44.57 17.71 Favored 'General case' 0 C--O 1.222 -0.365 0 O-C-N 121.81 -0.556 . . . . 0.0 109.53 -178.591 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 14.2 tp -61.15 -37.25 82.18 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.76 1.624 . . . . 0.0 111.682 176.214 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.405 ' HA ' HG13 ' A' ' 66' ' ' ILE . 59.7 p -61.42 -24.04 66.25 Favored 'General case' 0 N--CA 1.477 0.879 0 N-CA-C 113.488 0.922 . . . . 0.0 113.488 171.645 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -104.04 -26.54 12.56 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 125.489 1.515 . . . . 0.0 114.236 -175.149 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 60.0 mmtt -64.66 -35.04 79.75 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 125.336 1.454 . . . . 0.0 111.48 173.305 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 6.9 mt -116.39 -2.07 12.15 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 126.274 1.83 . . . . 0.0 112.908 -166.702 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 26.4 m-80 56.11 61.75 2.63 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 126.744 2.018 . . . . 0.0 113.282 -176.547 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.405 HG13 ' HA ' ' A' ' 61' ' ' SER . 0.6 OUTLIER -134.11 176.3 9.21 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 C-N-CA 126.875 2.07 . . . . 0.0 111.441 -173.137 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.4 p -78.72 158.78 28.22 Favored 'General case' 0 N--CA 1.479 1.007 0 O-C-N 121.069 -1.019 . . . . 0.0 111.231 172.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 92.0 t -63.88 -28.56 45.2 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.045 0 O-C-N 121.509 -0.744 . . . . 0.0 111.416 172.863 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -78.74 -38.76 38.01 Favored 'General case' 0 N--CA 1.469 0.497 0 O-C-N 120.923 -1.11 . . . . 0.0 109.722 -177.644 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 5.0 tmtm? -66.54 -47.28 73.38 Favored 'General case' 0 N--CA 1.463 0.213 0 C-N-CA 125.737 1.615 . . . . 0.0 110.615 175.245 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -58.24 -47.71 82.68 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.072 1.349 . . . . 0.0 112.9 172.514 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 35.0 ttmt -69.54 -25.35 63.97 Favored 'General case' 0 N--CA 1.464 0.252 0 O-C-N 120.993 -1.067 . . . . 0.0 111.473 -176.866 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -55.21 -41.44 72.04 Favored 'General case' 0 CA--C 1.545 0.753 0 CA-C-N 118.097 0.408 . . . . 0.0 111.576 173.886 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 53.4 m-85 -65.18 -45.61 84.18 Favored 'General case' 0 C--O 1.221 -0.408 0 C-N-CA 124.68 1.192 . . . . 0.0 111.03 176.089 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 65.3 mt -65.27 -24.87 35.94 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.7 0 C-N-CA 124.128 0.971 . . . . 0.0 111.363 -178.706 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 72.8 mmtt -87.57 -24.87 23.88 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 125.404 1.482 . . . . 0.0 114.547 179.637 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 10.6 p30 . . . . . 0 N--CA 1.47 0.537 0 CA-C-N 120.463 1.483 . . . . 0.0 112.103 169.087 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 . . . . . 0 CA--C 1.543 0.694 0 CA-C-O 120.977 0.418 . . . . 0.0 111.706 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -135.3 113.7 11.52 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 124.844 1.258 . . . . 0.0 110.43 -179.017 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 7.7 t -142.64 151.46 17.81 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 C-N-CA 125.621 1.568 . . . . 0.0 109.95 -174.301 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 38.4 t -138.13 -64.06 0.54 Allowed 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 124.1 0.96 . . . . 0.0 112.456 176.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 15.8 t -65.85 -31.94 73.18 Favored 'General case' 0 N--CA 1.478 0.96 0 O-C-N 121.455 -0.778 . . . . 0.0 113.009 -177.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 98.4 mmm -107.25 18.43 21.66 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.891 1.676 . . . . 0.0 113.106 179.003 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 24.3 tt0 -79.79 53.46 1.64 Allowed 'General case' 0 CA--C 1.553 1.063 0 C-N-CA 124.757 1.223 . . . . 0.0 112.373 -176.144 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 56.32 -179.4 0.04 OUTLIER 'General case' 0 CA--C 1.552 1.05 0 C-N-CA 127.0 2.12 . . . . 0.0 114.713 -170.867 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.477 0.924 0 C-N-CA 125.757 1.623 . . . . 0.0 112.081 177.495 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 95.8 mtp . . . . . 0 N--CA 1.474 0.726 0 CA-C-O 120.983 0.421 . . . . 0.0 110.151 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 -142.51 149.41 50.76 Favored Pre-proline 0 CA--C 1.549 0.905 0 C-N-CA 124.772 1.229 . . . . 0.0 112.422 -174.241 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -78.48 -2.93 12.92 Favored 'Trans proline' 0 C--N 1.353 0.766 0 C-N-CA 124.05 3.167 . . . . 0.0 114.61 178.048 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 94.7 mt -107.86 44.16 1.13 Allowed 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 126.218 1.807 . . . . 0.0 111.526 179.787 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -101.56 -19.04 15.65 Favored 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 114.648 1.351 . . . . 0.0 114.648 176.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.7 -32.37 5.18 Favored 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 115.94 1.83 . . . . 0.0 115.94 -166.267 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.2 pp -132.88 12.06 1.5 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.237 0 C-N-CA 125.011 1.324 . . . . 0.0 113.979 -176.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 14.9 tt -51.44 125.79 5.59 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 C-N-CA 124.805 1.242 . . . . 0.0 112.773 -173.717 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -146.52 -1.71 0.7 Allowed 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 114.154 1.168 . . . . 0.0 114.154 -179.399 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -88.06 9.98 20.69 Favored 'General case' 0 CA--C 1.544 0.715 0 N-CA-C 114.754 1.39 . . . . 0.0 114.754 -169.34 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 14.2 tt -144.08 23.2 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 C-N-CA 126.428 1.891 . . . . 0.0 113.065 -175.181 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 38.1 ttpt . . . . . 0 N--CA 1.471 0.603 0 N-CA-C 115.108 1.521 . . . . 0.0 115.108 -173.287 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.1 mt . . . . . 0 CA--C 1.545 0.766 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 71.1 m -73.38 165.13 25.63 Favored 'General case' 0 N--CA 1.48 1.059 0 O-C-N 121.883 -0.511 . . . . 0.0 110.644 169.879 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -55.77 -43.48 76.79 Favored 'General case' 0 N--CA 1.48 1.058 0 O-C-N 120.588 -1.32 . . . . 0.0 113.382 -174.586 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 12.7 tt0 -73.64 -41.44 62.75 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 123.374 0.67 . . . . 0.0 111.464 175.111 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 85.8 mt-30 -62.78 -37.89 88.47 Favored 'General case' 0 CA--C 1.535 0.37 0 O-C-N 121.648 -0.658 . . . . 0.0 111.967 179.334 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 19.8 ttmm -59.4 -41.47 89.5 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 124.355 1.062 . . . . 0.0 110.978 174.348 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 43.3 mt -70.01 -42.37 79.5 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.561 0 CA-C-O 118.234 -0.889 . . . . 0.0 111.099 177.715 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 42.6 mt -64.71 -43.88 96.56 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.891 0 CA-C-N 120.467 1.485 . . . . 0.0 110.35 177.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -57.24 -49.18 76.85 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.955 1.302 . . . . 0.0 110.254 177.386 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -65.45 -52.22 54.66 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 124.256 1.022 . . . . 0.0 112.854 177.272 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.0 mm-40 -60.58 -27.56 67.8 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 119.165 0.893 . . . . 0.0 113.038 -178.91 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -70.89 -57.4 4.63 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 123.714 0.806 . . . . 0.0 111.153 176.186 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 75.6 mt -60.3 -34.26 56.81 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.49 0 C-N-CA 126.657 1.983 . . . . 0.0 111.338 176.744 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -70.69 -24.42 62.67 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 124.12 0.968 . . . . 0.0 113.111 176.032 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -91.25 -32.41 15.76 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.396 1.078 . . . . 0.0 112.621 178.375 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 5.3 m -121.0 -19.81 4.66 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.981 0 N-CA-C 113.992 1.108 . . . . 0.0 113.992 -173.3 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 83.58 141.47 4.58 Favored Glycine 0 CA--C 1.531 1.085 0 C-N-CA 125.034 1.302 . . . . 0.0 112.205 -171.092 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -65.06 -12.82 54.87 Favored 'General case' 0 N--CA 1.477 0.921 0 CA-C-O 122.986 1.374 . . . . 0.0 113.859 -172.611 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 35.3 mt-30 -78.98 -15.78 57.81 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 126.01 1.724 . . . . 0.0 112.976 175.229 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 60.6 m-80 -116.22 -6.16 11.86 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 114.713 1.375 . . . . 0.0 114.713 -173.061 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 15.5 pt -72.82 160.72 5.2 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 C-N-CA 123.753 0.821 . . . . 0.0 111.644 167.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -133.38 146.89 51.67 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 125.025 1.33 . . . . 0.0 110.577 176.004 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -63.05 -28.22 69.94 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.806 0.843 . . . . 0.0 112.135 177.672 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -64.04 -48.8 84.35 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.513 0 C-N-CA 125.275 1.43 . . . . 0.0 109.689 174.574 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 99.3 m -77.68 -40.02 42.91 Favored 'General case' 0 C--O 1.224 -0.277 0 C-N-CA 123.77 0.828 . . . . 0.0 110.721 -176.765 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 17.3 tp -63.44 -37.07 85.89 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.632 1.173 . . . . 0.0 111.774 173.611 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 40.1 t -55.2 -29.56 58.17 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.849 1.259 . . . . 0.0 112.753 169.341 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 59.5 mttm -95.41 -36.33 11.39 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 125.007 1.323 . . . . 0.0 113.569 -178.036 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 10.3 mmtm -61.94 -35.66 79.1 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 125.486 1.514 . . . . 0.0 112.193 -178.856 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.2 mp -115.53 6.67 14.72 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 114.113 1.153 . . . . 0.0 114.113 -176.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 13.9 m-80 57.21 59.11 3.53 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 126.431 1.893 . . . . 0.0 113.214 -179.327 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -125.67 -168.06 0.53 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.789 0 C-N-CA 126.755 2.022 . . . . 0.0 110.982 -172.427 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.5 p -96.35 160.11 14.59 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.311 1.044 . . . . 0.0 110.85 171.052 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 63.9 t -63.66 -28.75 45.63 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.893 0 O-C-N 121.748 -0.595 . . . . 0.0 111.417 173.801 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 44.4 mm-40 -78.55 -39.57 37.39 Favored 'General case' 0 N--CA 1.468 0.431 0 O-C-N 121.046 -1.034 . . . . 0.0 110.123 -179.16 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 5.4 tmtm? -64.38 -47.19 80.18 Favored 'General case' 0 N--CA 1.463 0.181 0 C-N-CA 125.245 1.418 . . . . 0.0 110.604 176.271 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -58.68 -48.14 82.11 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 125.687 1.595 . . . . 0.0 113.233 172.264 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 20.0 ttmm -68.34 -27.64 66.45 Favored 'General case' 0 N--CA 1.466 0.348 0 O-C-N 120.941 -1.1 . . . . 0.0 111.251 -177.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -56.96 -38.75 73.4 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 122.898 0.479 . . . . 0.0 112.152 176.403 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 68.1 m-85 -64.42 -45.43 87.61 Favored 'General case' 0 N--CA 1.464 0.272 0 C-N-CA 125.215 1.406 . . . . 0.0 110.956 175.091 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 81.5 mt -69.53 -26.81 31.92 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.649 0 C-N-CA 125.205 1.402 . . . . 0.0 111.468 -177.319 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 53.9 mtmt -79.56 -37.64 35.94 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.595 1.158 . . . . 0.0 113.21 177.168 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 5.9 p30 . . . . . 0 C--N 1.342 0.275 0 CA-C-N 119.431 1.014 . . . . 0.0 111.915 177.642 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 . . . . . 0 CA--C 1.548 0.872 0 CA-C-O 120.915 0.388 . . . . 0.0 111.608 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -108.03 109.61 21.1 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 124.885 1.274 . . . . 0.0 111.563 -176.643 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 53.4 t -127.86 91.41 1.7 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 C-N-CA 125.671 1.589 . . . . 0.0 109.099 174.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 38.0 t -169.77 -36.54 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 124.777 1.231 . . . . 0.0 111.949 176.658 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 28.1 t -139.82 130.22 25.46 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 125.142 1.377 . . . . 0.0 111.247 177.211 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 76.3 mtm 51.64 46.06 27.13 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 126.438 1.895 . . . . 0.0 113.835 173.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -85.51 4.92 33.64 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 126.328 1.851 . . . . 0.0 114.431 -177.809 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -74.3 163.22 28.07 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 125.529 1.532 . . . . 0.0 114.078 -177.333 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 62.3 mtpt . . . . . 0 N--CA 1.479 0.989 0 C-N-CA 126.344 1.858 . . . . 0.0 112.041 177.202 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 52.0 tpp . . . . . 0 N--CA 1.474 0.743 0 CA-C-O 121.87 0.843 . . . . 0.0 111.073 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -136.61 149.67 67.95 Favored Pre-proline 0 CA--C 1.547 0.861 0 C-N-CA 125.282 1.433 . . . . 0.0 112.023 -176.428 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_endo -81.84 -12.22 11.02 Favored 'Trans proline' 0 C--N 1.351 0.669 0 C-N-CA 123.297 2.665 . . . . 0.0 114.827 178.326 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 89.0 mt -101.01 47.01 0.92 Allowed 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.748 1.619 . . . . 0.0 113.285 -170.248 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 -105.51 -3.1 22.83 Favored 'General case' 0 N--CA 1.479 1.017 0 N-CA-C 114.795 1.406 . . . . 0.0 114.795 172.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -130.54 -57.32 1.06 Allowed 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 124.339 1.055 . . . . 0.0 113.356 -165.773 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.9 pp -109.1 12.16 8.82 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 C-N-CA 125.923 1.689 . . . . 0.0 112.837 -176.617 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 15.7 tt -46.96 130.09 3.33 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.777 0 C-N-CA 124.817 1.247 . . . . 0.0 112.314 176.113 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -148.79 49.33 1.0 Allowed 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.533 1.133 . . . . 0.0 111.756 -170.895 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 -106.06 11.12 31.84 Favored 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 114.005 1.113 . . . . 0.0 114.005 -175.303 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 7.2 tp -148.98 32.57 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.919 0 C-N-CA 125.589 1.556 . . . . 0.0 113.458 -172.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 3.1 tmtm? . . . . . 0 N--CA 1.474 0.768 0 C-N-CA 123.854 0.861 . . . . 0.0 113.042 -179.449 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.2 mt . . . . . 0 CA--C 1.545 0.775 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 22.8 t -71.48 164.71 25.29 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 123.006 0.523 . . . . 0.0 110.805 170.655 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -56.74 -44.53 81.78 Favored 'General case' 0 N--CA 1.477 0.906 0 O-C-N 120.388 -1.445 . . . . 0.0 113.155 -174.04 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 7.5 pt20 -76.64 -34.72 58.3 Favored 'General case' 0 N--CA 1.47 0.568 0 O-C-N 121.626 -0.671 . . . . 0.0 112.251 174.59 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 89.2 mt-30 -66.0 -39.44 90.3 Favored 'General case' 0 CA--C 1.53 0.207 0 O-C-N 121.693 -0.629 . . . . 0.0 111.535 -179.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 40.8 ttmt -59.6 -42.27 92.23 Favored 'General case' 0 N--CA 1.464 0.248 0 C-N-CA 124.749 1.22 . . . . 0.0 110.621 176.034 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 48.0 mt -68.56 -42.3 83.46 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.481 0 CA-C-O 118.256 -0.878 . . . . 0.0 111.06 177.286 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 40.2 mt -64.47 -44.36 96.97 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 CA-C-N 120.601 1.546 . . . . 0.0 110.335 178.668 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -60.61 -48.78 80.27 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 125.114 1.366 . . . . 0.0 111.128 177.366 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -64.27 -51.36 63.96 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 124.794 1.237 . . . . 0.0 112.49 177.27 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 17.0 mm-40 -61.17 -28.82 69.4 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-N 118.991 0.814 . . . . 0.0 112.545 179.246 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -65.3 -58.55 5.65 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-N 118.944 0.793 . . . . 0.0 110.47 174.434 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.3 mt -62.37 -35.58 70.28 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.363 0 C-N-CA 126.796 2.038 . . . . 0.0 111.796 179.394 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -72.08 -28.04 63.05 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.021 0.928 . . . . 0.0 112.389 178.551 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -86.71 -38.08 17.32 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.146 0.978 . . . . 0.0 112.555 175.429 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.5 m -108.5 -7.06 10.95 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.15 0 N-CA-C 114.664 1.357 . . . . 0.0 114.664 -173.197 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 86.21 27.77 29.84 Favored Glycine 0 CA--C 1.531 1.09 0 C-N-CA 124.732 1.158 . . . . 0.0 115.336 162.488 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 55.38 14.18 1.06 Allowed 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 127.224 2.21 . . . . 0.0 114.895 -176.165 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 5.1 pt20 -124.12 -6.94 7.73 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 125.147 1.379 . . . . 0.0 113.969 -170.449 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 57.2 m-80 -118.74 0.53 11.47 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 124.766 1.226 . . . . 0.0 113.264 174.414 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 23.0 pt -75.96 152.37 6.15 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 C-N-CA 123.271 0.628 . . . . 0.0 112.012 177.519 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -141.48 146.53 36.57 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 125.524 1.529 . . . . 0.0 109.354 176.442 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -62.94 -28.23 69.93 Favored 'General case' 0 C--O 1.222 -0.36 0 C-N-CA 123.743 0.817 . . . . 0.0 112.025 178.455 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -63.55 -43.38 98.25 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.471 0 C-N-CA 125.193 1.397 . . . . 0.0 109.864 174.15 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 81.9 m -83.53 -43.0 16.2 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 123.867 0.867 . . . . 0.0 110.296 -174.18 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 6.2 mt -59.13 -37.19 76.65 Favored 'General case' 0 CA--C 1.539 0.532 0 O-C-N 121.447 -0.783 . . . . 0.0 111.977 169.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.44 ' HA ' HG13 ' A' ' 66' ' ' ILE . 28.7 t -52.31 -33.82 44.09 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 124.055 0.942 . . . . 0.0 111.938 173.179 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -99.2 -29.53 12.78 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 124.729 1.212 . . . . 0.0 113.986 -174.774 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 18.7 mmmt -62.49 -29.13 70.32 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 125.108 1.363 . . . . 0.0 112.817 177.593 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.9 mp -127.34 14.62 7.18 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 124.865 1.266 . . . . 0.0 113.901 -177.51 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . 0.278 8.1 p30 47.12 51.18 13.36 Favored 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 126.211 1.805 . . . . 0.0 113.712 -176.257 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.44 HG13 ' HA ' ' A' ' 61' ' ' SER . 2.7 pt -110.46 -174.88 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 C-N-CA 126.905 2.082 . . . . 0.0 111.253 -177.168 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -84.96 158.55 20.49 Favored 'General case' 0 N--CA 1.477 0.912 0 O-C-N 121.227 -0.92 . . . . 0.0 110.999 170.881 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 95.5 t -63.67 -31.05 51.56 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 O-C-N 121.809 -0.557 . . . . 0.0 111.199 170.901 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -74.94 -35.31 62.16 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 119.783 1.174 . . . . 0.0 110.367 178.511 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 22.2 tttt -65.56 -48.9 70.83 Favored 'General case' 0 C--N 1.342 0.257 0 C-N-CA 123.279 0.631 . . . . 0.0 110.833 175.489 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -58.28 -41.46 84.42 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.917 1.687 . . . . 0.0 113.087 175.942 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 37.2 ttmt -74.13 -30.4 62.28 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 125.472 1.509 . . . . 0.0 111.6 -178.714 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -56.54 -42.92 79.31 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 122.85 0.46 . . . . 0.0 111.772 177.242 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 53.5 m-85 -64.53 -42.57 95.66 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 125.006 1.323 . . . . 0.0 111.004 178.495 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 74.0 mt -65.56 -38.98 83.69 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.477 0 C-N-CA 124.05 0.94 . . . . 0.0 110.672 178.817 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 71.3 mmtt -72.6 -40.72 66.32 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 124.761 1.224 . . . . 0.0 112.969 -177.403 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 4.7 p30 . . . . . 0 CA--C 1.532 0.284 0 CA-C-N 118.636 0.653 . . . . 0.0 111.208 -178.949 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 . . . . . 0 CA--C 1.544 0.731 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -146.23 31.47 1.01 Allowed 'General case' 0 N--CA 1.479 0.984 0 N-CA-C 115.503 1.668 . . . . 0.0 115.503 -166.593 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 52.6 t -135.65 117.9 21.43 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 C-N-CA 123.684 0.794 . . . . 0.0 111.937 -175.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 37.8 t -160.54 -72.69 0.07 Allowed 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 123.931 0.892 . . . . 0.0 112.618 176.605 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 25.5 m -73.0 -21.63 60.8 Favored 'General case' 0 N--CA 1.48 1.058 0 N-CA-C 113.806 1.039 . . . . 0.0 113.806 -176.422 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -132.61 136.62 46.64 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 125.957 1.703 . . . . 0.0 110.109 168.257 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -147.47 100.83 3.3 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.791 1.636 . . . . 0.0 108.463 175.814 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -137.59 149.91 47.03 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.757 1.223 . . . . 0.0 112.15 179.569 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 67.4 mttm . . . . . 0 N--CA 1.475 0.812 0 C-N-CA 125.694 1.598 . . . . 0.0 109.732 175.52 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 10.4 tpt . . . . . 0 CA--C 1.543 0.707 0 CA-C-O 121.039 0.447 . . . . 0.0 110.852 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 48.2 m-20 -95.84 148.87 35.24 Favored Pre-proline 0 CA--C 1.549 0.911 0 C-N-CA 124.329 1.051 . . . . 0.0 113.097 -179.745 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 65.4 Cg_endo -84.39 -5.97 10.1 Favored 'Trans proline' 0 C--N 1.351 0.703 0 C-N-CA 123.872 3.048 . . . . 0.0 114.516 174.58 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 97.8 mt -97.72 44.66 1.04 Allowed 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.153 1.381 . . . . 0.0 113.437 -172.414 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -111.33 -1.67 15.94 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 124.729 1.212 . . . . 0.0 114.235 171.298 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.67 -56.21 1.14 Allowed 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 124.489 1.116 . . . . 0.0 113.191 -165.211 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.7 pp -110.74 10.04 8.67 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.784 0 C-N-CA 125.848 1.659 . . . . 0.0 112.914 -178.134 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 13.3 tt -50.32 133.73 10.24 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 C-N-CA 124.189 0.996 . . . . 0.0 112.392 176.424 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 6.5 t30 -140.17 12.39 2.4 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 124.99 1.316 . . . . 0.0 113.195 -176.732 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -79.57 10.17 4.2 Favored 'General case' 0 CA--C 1.546 0.805 0 N-CA-C 115.029 1.492 . . . . 0.0 115.029 -169.468 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 13.9 tt -139.68 20.57 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 C-N-CA 127.247 2.219 . . . . 0.0 112.579 176.672 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 1.5 tmtp? . . . . . 0 N--CA 1.472 0.65 0 C-N-CA 124.367 1.067 . . . . 0.0 113.603 -176.112 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 2.1 mt . . . . . 0 CA--C 1.543 0.71 0 N-CA-C 110.085 -0.339 . . . . 0.0 110.085 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 15.5 m -72.18 166.66 21.93 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.397 0.679 . . . . 0.0 111.707 176.257 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -57.04 -36.44 70.49 Favored 'General case' 0 N--CA 1.477 0.887 0 N-CA-C 113.951 1.093 . . . . 0.0 113.951 -172.697 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 11.3 tt0 -87.23 -40.9 14.13 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 123.857 0.863 . . . . 0.0 112.253 173.7 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 24.7 mm-40 -53.75 -44.3 69.86 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 124.322 1.049 . . . . 0.0 111.475 176.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 13.7 ptmt -66.0 -32.67 74.29 Favored 'General case' 0 N--CA 1.469 0.507 0 O-C-N 121.561 -0.712 . . . . 0.0 111.926 -179.262 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 49.3 mt -72.82 -43.71 59.93 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 CA-C-N 119.124 0.874 . . . . 0.0 110.864 175.907 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 50.2 mt -60.47 -43.36 94.03 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.978 0 CA-C-N 119.706 1.139 . . . . 0.0 110.362 176.737 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -61.6 -48.54 80.47 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 124.966 1.306 . . . . 0.0 110.958 175.278 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -67.47 -48.84 65.99 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 124.081 0.952 . . . . 0.0 113.033 -178.218 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -61.79 -23.68 66.36 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.707 0.803 . . . . 0.0 113.061 -179.032 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -73.09 -58.72 3.11 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 123.971 0.909 . . . . 0.0 111.141 174.564 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 67.6 mt -57.96 -35.41 51.88 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 C-N-CA 126.869 2.068 . . . . 0.0 111.476 176.267 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -70.21 -22.56 62.91 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 124.256 1.022 . . . . 0.0 113.317 176.644 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -93.72 -31.86 14.26 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.689 1.196 . . . . 0.0 112.719 178.22 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 6.3 m -121.72 -20.65 4.01 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 N-CA-C 113.971 1.101 . . . . 0.0 113.971 -172.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 84.42 142.89 5.69 Favored Glycine 0 CA--C 1.531 1.059 0 C-N-CA 125.047 1.308 . . . . 0.0 112.24 -171.341 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -67.22 -5.89 15.81 Favored 'General case' 0 N--CA 1.479 0.999 0 CA-C-O 122.688 1.232 . . . . 0.0 114.24 -171.207 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 38.8 mt-30 -90.3 -16.25 29.63 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 126.476 1.91 . . . . 0.0 112.753 176.512 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 58.5 m-80 -111.06 -6.03 14.7 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.831 1.252 . . . . 0.0 114.119 -176.336 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 15.5 pt -73.3 161.26 4.97 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 C-N-CA 124.07 0.948 . . . . 0.0 111.42 166.189 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.1 p -131.75 145.49 51.64 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 125.162 1.385 . . . . 0.0 110.495 175.953 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -61.65 -29.88 70.35 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 123.976 0.91 . . . . 0.0 111.844 177.748 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -63.0 -49.07 85.02 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.499 0 C-N-CA 125.316 1.446 . . . . 0.0 109.977 175.261 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 58.5 m -78.48 -42.98 28.2 Favored 'General case' 0 C--O 1.222 -0.357 0 C-N-CA 123.711 0.804 . . . . 0.0 109.854 -175.275 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 20.2 tp -61.5 -36.43 80.5 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.435 1.094 . . . . 0.0 112.17 174.874 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.407 ' HA ' HG13 ' A' ' 66' ' ' ILE . 38.4 t -54.03 -30.72 48.85 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 124.765 1.226 . . . . 0.0 112.725 169.041 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -102.21 -23.98 13.96 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.435 1.494 . . . . 0.0 114.373 -174.724 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 69.9 mmtt -61.5 -39.4 90.84 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 124.582 1.153 . . . . 0.0 110.993 170.429 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 9.2 mt -115.03 4.34 14.68 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 126.666 1.986 . . . . 0.0 113.209 -166.665 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . 0.292 7.4 p30 46.29 57.95 4.92 Favored 'General case' 0 CA--C 1.55 0.943 0 C-N-CA 126.803 2.041 . . . . 0.0 114.085 -175.266 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.407 HG13 ' HA ' ' A' ' 61' ' ' SER . 0.9 OUTLIER -120.83 -168.23 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 C-N-CA 127.386 2.274 . . . . 0.0 111.359 -175.756 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -88.68 156.88 18.75 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.131 0.972 . . . . 0.0 110.867 169.5 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 87.6 t -62.6 -31.58 52.53 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 123.209 0.604 . . . . 0.0 111.345 173.27 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 10.7 mp0 -79.53 -34.41 41.12 Favored 'General case' 0 CA--C 1.532 0.27 0 O-C-N 120.744 -1.222 . . . . 0.0 110.037 -178.317 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 12.2 tmtt? -68.67 -41.82 78.74 Favored 'General case' 0 C--N 1.343 0.304 0 C-N-CA 123.375 0.67 . . . . 0.0 111.306 177.239 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -58.71 -43.53 90.12 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.39 1.476 . . . . 0.0 112.661 169.188 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 37.6 ttpt -69.26 -27.52 65.51 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 125.004 1.322 . . . . 0.0 111.951 -179.346 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -61.47 -34.36 75.32 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 123.321 0.648 . . . . 0.0 112.462 177.661 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 55.9 m-85 -67.18 -45.71 76.13 Favored 'General case' 0 N--CA 1.466 0.348 0 C-N-CA 124.369 1.067 . . . . 0.0 110.528 171.057 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 73.9 mt -65.17 -24.84 36.04 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.834 0 O-C-N 121.135 -0.978 . . . . 0.0 111.675 -179.859 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.412 ' HA ' ' HE3' ' A' ' 76' ' ' LYS . 0.0 OUTLIER -81.78 -37.51 27.04 Favored 'General case' 0 N--CA 1.472 0.655 0 O-C-N 120.248 -1.533 . . . . 0.0 113.291 175.983 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 3.7 p30 . . . . . 0 N--CA 1.467 0.401 0 CA-C-N 119.807 1.185 . . . . 0.0 112.509 -176.776 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 . . . . . 0 CA--C 1.543 0.697 0 N-CA-C 112.726 0.639 . . . . 0.0 112.726 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -99.4 105.56 17.53 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 124.595 1.158 . . . . 0.0 110.493 177.397 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 57.3 t -133.9 100.62 3.42 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.574 0 C-N-CA 125.199 1.4 . . . . 0.0 109.526 174.134 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 43.1 t -166.54 -73.1 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.428 1.091 . . . . 0.0 111.834 171.779 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 18.1 t -84.94 -32.69 22.94 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 124.095 0.958 . . . . 0.0 112.838 -176.502 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -126.06 125.46 42.65 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 125.836 1.654 . . . . 0.0 110.274 175.807 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -152.64 105.91 3.03 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 125.653 1.581 . . . . 0.0 108.254 173.47 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -144.78 -41.49 0.25 Allowed 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 116.009 1.855 . . . . 0.0 116.009 179.388 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 46.8 mmtm . . . . . 0 N--CA 1.484 1.249 0 C-N-CA 126.611 1.964 . . . . 0.0 113.204 -173.443 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.473 0.678 0 CA-C-O 120.731 0.3 . . . . 0.0 110.635 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 58.7 m-20 38.11 55.61 4.47 Favored Pre-proline 0 CA--C 1.555 1.154 0 C-N-CA 127.721 2.409 . . . . 0.0 115.183 -177.711 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_endo -80.42 -7.5 13.82 Favored 'Trans proline' 0 C--N 1.351 0.683 0 C-N-CA 123.034 2.489 . . . . 0.0 114.907 -170.53 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -133.65 23.62 3.99 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 125.307 1.443 . . . . 0.0 114.594 -173.633 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -111.27 0.3 16.67 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 114.59 1.33 . . . . 0.0 114.59 -168.92 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -136.69 -30.13 0.91 Allowed 'General case' 0 N--CA 1.477 0.886 0 N-CA-C 116.442 2.016 . . . . 0.0 116.442 -164.726 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.2 pp -136.93 11.78 0.83 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.29 0 C-N-CA 125.427 1.491 . . . . 0.0 113.848 -177.833 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 19.0 tt -45.89 107.39 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.926 0 C-N-CA 126.246 1.818 . . . . 0.0 114.654 -163.596 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 21.7 t-20 -161.58 104.48 1.23 Allowed 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 125.683 1.593 . . . . 0.0 110.537 175.793 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -149.4 9.56 0.74 Allowed 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 114.477 1.288 . . . . 0.0 114.477 175.786 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 12.7 tt -151.06 27.65 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.164 0 C-N-CA 124.548 1.139 . . . . 0.0 113.83 -169.827 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 58.1 tttp . . . . . 0 N--CA 1.473 0.715 0 C-N-CA 124.353 1.061 . . . . 0.0 113.362 -177.467 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.2 mp . . . . . 0 CA--C 1.544 0.715 0 CA-C-O 120.689 0.281 . . . . 0.0 110.909 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 19.3 t -70.04 165.4 21.95 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 122.781 0.432 . . . . 0.0 110.472 170.547 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -56.45 -46.09 80.5 Favored 'General case' 0 N--CA 1.476 0.84 0 O-C-N 120.388 -1.445 . . . . 0.0 112.933 -173.188 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 9.2 tt0 -72.93 -43.0 62.9 Favored 'General case' 0 CA--C 1.539 0.523 0 O-C-N 121.41 -0.806 . . . . 0.0 111.418 177.686 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 36.7 mm-40 -55.1 -44.44 74.94 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.659 1.184 . . . . 0.0 111.233 175.664 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 42.0 ttmt -62.95 -44.0 97.26 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 125.171 1.388 . . . . 0.0 111.58 177.53 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 54.0 mt -65.95 -41.97 90.9 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 CA-C-N 119.12 0.873 . . . . 0.0 111.134 178.031 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 37.9 mt -66.67 -42.26 89.38 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.885 0 CA-C-N 120.291 1.405 . . . . 0.0 110.512 179.001 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -60.11 -47.26 86.64 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.033 0.933 . . . . 0.0 110.898 175.614 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -68.01 -49.85 59.08 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 124.819 1.248 . . . . 0.0 112.217 -179.931 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -64.27 -23.49 67.32 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 119.209 0.913 . . . . 0.0 112.976 -176.953 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -71.31 -59.68 2.64 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.388 1.075 . . . . 0.0 110.792 173.226 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 62.9 mt -62.5 -34.68 66.09 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.256 0 C-N-CA 127.417 2.287 . . . . 0.0 111.953 -179.625 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -68.58 -33.46 74.1 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 123.784 0.834 . . . . 0.0 111.989 176.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -85.36 -38.18 19.04 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.696 0.799 . . . . 0.0 112.3 179.068 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.0 m -108.39 -5.45 10.68 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.126 0 N-CA-C 114.013 1.116 . . . . 0.0 114.013 -173.909 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 87.79 24.63 34.83 Favored Glycine 0 N--CA 1.472 1.09 0 C-N-CA 125.047 1.308 . . . . 0.0 115.73 159.639 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 56.23 10.67 0.66 Allowed 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 127.146 2.178 . . . . 0.0 114.848 -174.014 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 5.2 pt20 -124.87 -5.91 7.41 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 125.564 1.546 . . . . 0.0 113.573 -169.873 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 59.4 m-80 -121.38 2.33 10.24 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.34 1.456 . . . . 0.0 112.577 173.294 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 23.2 pt -74.97 154.19 6.44 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.583 0 C-N-CA 123.048 0.539 . . . . 0.0 111.147 173.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -136.77 142.58 42.99 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 124.972 1.309 . . . . 0.0 109.177 177.465 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -61.57 -26.88 68.24 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 118.958 0.799 . . . . 0.0 112.494 -179.766 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -65.36 -47.69 86.06 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.559 0 C-N-CA 125.313 1.445 . . . . 0.0 109.989 174.3 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 72.5 m -77.75 -43.11 31.84 Favored 'General case' 0 C--O 1.221 -0.402 0 N-CA-C 109.411 -0.589 . . . . 0.0 109.411 -176.814 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 16.5 tp -60.71 -37.55 82.07 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 125.105 1.362 . . . . 0.0 112.155 175.143 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.411 ' HA ' HG13 ' A' ' 66' ' ' ILE . 24.3 p -63.11 -20.39 65.32 Favored 'General case' 0 N--CA 1.475 0.797 0 N-CA-C 113.567 0.951 . . . . 0.0 113.567 172.095 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 24.0 mtpp -106.89 -23.36 12.39 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 126.108 1.763 . . . . 0.0 114.474 -176.127 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 65.7 mmtt -66.48 -35.27 79.86 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 125.33 1.452 . . . . 0.0 111.125 170.381 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 14.3 mt -117.65 1.47 12.22 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 126.917 2.087 . . . . 0.0 113.099 -168.621 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 18.6 t30 55.08 61.99 2.7 Favored 'General case' 0 CA--C 1.553 1.066 0 C-N-CA 124.701 1.2 . . . . 0.0 112.296 176.655 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.411 HG13 ' HA ' ' A' ' 61' ' ' SER . 0.6 OUTLIER -137.91 178.08 4.81 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.782 0 C-N-CA 127.304 2.241 . . . . 0.0 111.302 -171.378 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 2.6 p -78.09 157.55 29.47 Favored 'General case' 0 N--CA 1.48 1.045 0 O-C-N 120.98 -1.075 . . . . 0.0 111.447 171.806 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 99.3 t -63.38 -29.67 47.84 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 C-N-CA 123.264 0.626 . . . . 0.0 111.365 173.54 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -78.89 -38.72 36.86 Favored 'General case' 0 N--CA 1.468 0.452 0 O-C-N 120.988 -1.07 . . . . 0.0 110.078 -177.794 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 4.1 tmtm? -66.27 -44.91 82.29 Favored 'General case' 0 C--N 1.339 0.137 0 C-N-CA 124.808 1.243 . . . . 0.0 110.856 176.399 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -59.21 -48.8 80.28 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 124.863 1.265 . . . . 0.0 112.738 171.195 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 36.6 ttmt -69.32 -27.42 65.36 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 124.403 1.081 . . . . 0.0 111.4 -175.225 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -53.01 -43.83 66.82 Favored 'General case' 0 CA--C 1.543 0.705 0 CA-C-N 118.154 0.434 . . . . 0.0 111.459 174.227 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 24.8 m-85 -63.05 -42.0 99.61 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 123.432 0.693 . . . . 0.0 111.458 177.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 13.7 mt -66.59 -26.26 37.0 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.651 0 C-N-CA 124.477 1.111 . . . . 0.0 110.996 177.859 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 68.9 mmtt -83.33 -25.63 31.3 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 125.774 1.629 . . . . 0.0 114.711 178.249 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 25.7 p30 . . . . . 0 N--CA 1.475 0.823 0 CA-C-N 120.131 1.332 . . . . 0.0 113.513 -178.521 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 . . . . . 0 N--CA 1.474 0.739 0 N-CA-C 112.976 0.732 . . . . 0.0 112.976 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -134.01 110.29 9.56 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 125.115 1.366 . . . . 0.0 110.354 174.275 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 48.6 t -141.69 127.24 18.32 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 C-N-CA 125.038 1.335 . . . . 0.0 110.229 178.291 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 9.7 t -98.94 83.38 2.9 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 124.792 1.237 . . . . 0.0 111.355 175.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 49.2 m 48.87 73.65 0.22 Allowed 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 126.456 1.902 . . . . 0.0 114.569 173.918 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 20.4 mmt 56.35 56.19 5.96 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 125.244 1.417 . . . . 0.0 112.296 -173.066 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 75.0 tt0 -72.42 96.3 1.88 Allowed 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 125.558 1.543 . . . . 0.0 110.284 174.106 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -139.49 159.47 42.1 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 125.309 1.444 . . . . 0.0 112.382 -174.838 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 14.0 mmmm . . . . . 0 N--CA 1.475 0.791 0 C-N-CA 125.65 1.58 . . . . 0.0 110.826 -177.446 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 76.6 mtm . . . . . 0 N--CA 1.47 0.565 0 CA-C-O 120.555 0.217 . . . . 0.0 110.535 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -147.12 136.47 11.64 Favored Pre-proline 0 CA--C 1.552 1.032 0 C-N-CA 124.897 1.279 . . . . 0.0 111.838 -176.596 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -81.49 -7.91 12.66 Favored 'Trans proline' 0 C--N 1.352 0.714 0 C-N-CA 123.388 2.725 . . . . 0.0 115.688 -177.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 83.3 mt -102.2 39.21 1.52 Allowed 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.303 1.441 . . . . 0.0 113.276 -173.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 12.6 m-20 -101.93 -3.16 28.29 Favored 'General case' 0 N--CA 1.478 0.962 0 N-CA-C 114.705 1.372 . . . . 0.0 114.705 168.335 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.74 -58.61 1.23 Allowed 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 124.297 1.039 . . . . 0.0 113.445 -164.82 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.8 pp -107.33 9.1 9.42 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 C-N-CA 125.495 1.518 . . . . 0.0 112.906 -177.748 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 10.5 tt -52.42 126.44 8.15 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.727 0 C-N-CA 123.825 0.85 . . . . 0.0 112.13 177.151 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -146.93 -1.25 0.68 Allowed 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 124.386 1.075 . . . . 0.0 113.497 -178.279 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -88.63 12.41 14.78 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 114.818 1.414 . . . . 0.0 114.818 -162.297 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 7.1 tp -143.89 21.95 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 125.62 1.568 . . . . 0.0 113.891 -171.337 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 29.4 mtpp . . . . . 0 N--CA 1.479 1.005 0 N-CA-C 115.396 1.628 . . . . 0.0 115.396 -179.974 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 5.2 mt . . . . . 0 CA--C 1.543 0.694 0 N-CA-C 110.397 -0.223 . . . . 0.0 110.397 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 19.8 t -71.77 166.96 20.93 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 122.759 0.424 . . . . 0.0 110.388 167.271 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -57.0 -45.88 82.71 Favored 'General case' 0 N--CA 1.475 0.796 0 O-C-N 120.571 -1.331 . . . . 0.0 112.589 -175.213 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 10.2 tt0 -72.51 -42.42 64.83 Favored 'General case' 0 N--CA 1.469 0.517 0 O-C-N 121.528 -0.732 . . . . 0.0 111.341 177.416 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 34.7 mm-40 -57.03 -43.11 81.57 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 124.082 0.953 . . . . 0.0 111.109 176.782 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 21.8 ttmm -61.65 -43.0 99.68 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.626 1.17 . . . . 0.0 111.288 177.12 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 49.7 mt -67.37 -40.4 84.65 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 CA-C-O 118.197 -0.906 . . . . 0.0 111.097 177.601 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 35.0 mt -65.46 -44.19 94.33 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.956 0 CA-C-N 120.652 1.569 . . . . 0.0 110.721 177.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -56.56 -48.35 77.54 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.27 1.028 . . . . 0.0 110.544 174.589 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -66.97 -51.9 49.42 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.454 1.101 . . . . 0.0 112.926 -179.7 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -59.12 -27.26 65.44 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 119.25 0.932 . . . . 0.0 113.118 179.849 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -70.95 -58.74 3.28 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 123.415 0.686 . . . . 0.0 111.26 176.469 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 55.5 mt -59.24 -34.54 54.12 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.61 0 C-N-CA 126.26 1.824 . . . . 0.0 111.314 176.481 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -70.19 -22.44 62.94 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 124.209 1.003 . . . . 0.0 113.256 176.146 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -96.14 -29.91 13.81 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.591 1.157 . . . . 0.0 113.097 178.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 7.8 m -121.96 -19.13 4.57 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.002 0 N-CA-C 114.121 1.156 . . . . 0.0 114.121 -175.487 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 82.36 142.06 4.04 Favored Glycine 0 CA--C 1.532 1.146 0 C-N-CA 124.77 1.176 . . . . 0.0 112.199 -171.171 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -65.76 -12.1 51.19 Favored 'General case' 0 N--CA 1.479 0.99 0 O-C-N 121.059 -1.259 . . . . 0.0 113.898 -171.709 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 35.9 mt-30 -77.68 -16.85 58.22 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 126.257 1.823 . . . . 0.0 112.969 174.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 67.0 m-80 -114.37 -6.5 12.92 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 114.642 1.349 . . . . 0.0 114.642 -173.058 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 13.8 pt -74.93 159.63 5.45 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.656 0 C-N-CA 124.09 0.956 . . . . 0.0 111.869 170.097 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.4 p -135.16 145.07 47.43 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 125.248 1.419 . . . . 0.0 110.142 175.284 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -60.47 -30.2 69.53 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 124.044 0.938 . . . . 0.0 112.176 179.041 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -61.95 -42.32 94.31 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.513 0 C-N-CA 125.352 1.461 . . . . 0.0 110.264 175.105 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 86.8 m -88.1 -40.84 13.47 Favored 'General case' 0 C--O 1.223 -0.336 0 C-N-CA 125.152 1.381 . . . . 0.0 109.699 -172.351 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 24.7 tp -60.57 -36.97 79.79 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.915 1.286 . . . . 0.0 111.543 170.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 40.8 t -53.99 -34.09 58.85 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 124.865 1.266 . . . . 0.0 113.154 168.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -97.52 -27.05 14.6 Favored 'General case' 0 C--N 1.329 -0.326 0 C-N-CA 124.578 1.151 . . . . 0.0 113.743 -174.205 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 19.8 mttp -69.36 -33.4 73.02 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 124.219 1.007 . . . . 0.0 112.448 174.374 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 4.5 mp -108.02 -0.85 21.0 Favored 'General case' 0 CA--C 1.541 0.596 0 N-CA-C 114.385 1.254 . . . . 0.0 114.385 -178.641 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 33.8 m-80 54.92 43.91 29.16 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 125.336 1.455 . . . . 0.0 112.587 -173.58 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 9.9 pt -103.16 -171.89 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.674 0 C-N-CA 126.218 1.807 . . . . 0.0 111.246 -178.644 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 43.9 p -85.62 159.44 19.85 Favored 'General case' 0 N--CA 1.471 0.625 0 O-C-N 121.473 -0.767 . . . . 0.0 111.057 165.711 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 58.0 t -60.6 -27.31 40.18 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.978 0 O-C-N 121.407 -0.808 . . . . 0.0 111.398 169.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 4.9 tm-20 -80.57 -40.78 25.23 Favored 'General case' 0 CA--C 1.531 0.249 0 O-C-N 120.609 -1.307 . . . . 0.0 110.168 -173.86 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . 0.367 0.0 OUTLIER -86.94 7.79 25.94 Favored 'General case' 0 C--N 1.348 0.502 0 N-CA-C 113.175 0.806 . . . . 0.0 113.175 173.589 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -94.61 -45.12 7.52 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.827 1.251 . . . . 0.0 111.557 158.071 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt -74.47 -27.86 60.77 Favored 'General case' 0 CA--C 1.519 -0.234 0 C-N-CA 124.86 1.264 . . . . 0.0 111.84 -172.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 31.2 p-10 -56.21 -37.85 70.21 Favored 'General case' 0 CA--C 1.545 0.765 0 N-CA-C 112.906 0.706 . . . . 0.0 112.906 175.813 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 28.7 m-85 -65.86 -48.97 69.79 Favored 'General case' 0 C--O 1.222 -0.372 0 C-N-CA 126.791 2.036 . . . . 0.0 109.889 176.449 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 76.7 mt -64.2 -38.72 83.23 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 C-N-CA 123.859 0.864 . . . . 0.0 110.374 -179.619 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 28.4 mmtm -63.41 -31.41 72.55 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 125.668 1.587 . . . . 0.0 113.448 177.509 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 8.9 p30 . . . . . 0 CA--C 1.539 0.553 0 CA-C-N 119.817 1.19 . . . . 0.0 112.463 174.98 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 . . . . . 0 N--CA 1.48 1.026 0 N-CA-C 113.722 1.008 . . . . 0.0 113.722 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -103.51 53.05 0.76 Allowed 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 125.648 1.579 . . . . 0.0 113.084 -169.19 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 59.5 t -139.1 140.72 37.72 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 C-N-CA 125.502 1.521 . . . . 0.0 110.491 -179.825 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 21.9 t -130.41 -62.8 0.91 Allowed 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 124.461 1.104 . . . . 0.0 113.157 178.185 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 75.0 m -138.7 102.28 4.54 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 124.5 1.12 . . . . 0.0 111.429 -176.764 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 69.4 mtm 51.37 31.06 6.7 Favored 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 125.869 1.668 . . . . 0.0 113.933 -177.457 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -96.69 -2.29 44.84 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.242 1.417 . . . . 0.0 113.244 -168.093 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -75.27 160.12 30.72 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.246 1.419 . . . . 0.0 112.893 178.758 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 44.7 mmtm . . . . . 0 N--CA 1.475 0.805 0 C-N-CA 125.171 1.388 . . . . 0.0 110.431 173.314 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 62.7 mtt . . . . . 0 N--CA 1.473 0.676 0 N-CA-C 110.111 -0.329 . . . . 0.0 110.111 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -132.91 57.4 27.92 Favored Pre-proline 0 CA--C 1.555 1.169 0 C-N-CA 124.54 1.136 . . . . 0.0 113.432 -174.909 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_endo -78.12 -4.92 14.78 Favored 'Trans proline' 0 C--N 1.353 0.803 0 C-N-CA 123.391 2.727 . . . . 0.0 115.285 -176.105 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -132.77 35.68 3.56 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.839 1.656 . . . . 0.0 114.018 -175.022 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -104.6 -1.21 26.76 Favored 'General case' 0 N--CA 1.478 0.945 0 N-CA-C 114.547 1.314 . . . . 0.0 114.547 176.302 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -130.07 -58.56 1.07 Allowed 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 124.369 1.068 . . . . 0.0 113.515 -164.124 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.8 pp -107.77 10.2 9.17 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.786 0 C-N-CA 125.631 1.572 . . . . 0.0 113.033 -178.07 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 17.7 tt -47.97 125.5 2.32 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 C-N-CA 124.775 1.23 . . . . 0.0 113.18 179.507 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 21.3 t30 -147.43 0.34 0.68 Allowed 'General case' 0 CA--C 1.543 0.693 0 N-CA-C 114.511 1.3 . . . . 0.0 114.511 -179.788 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -85.31 10.85 11.43 Favored 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 115.02 1.489 . . . . 0.0 115.02 -167.792 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 16.0 tt -144.19 34.59 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 C-N-CA 126.543 1.937 . . . . 0.0 112.049 -177.612 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 33.3 ttmt . . . . . 0 N--CA 1.471 0.578 0 N-CA-C 114.522 1.304 . . . . 0.0 114.522 -173.817 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 5.9 mt . . . . . 0 CA--C 1.542 0.643 0 CA-C-O 120.725 0.298 . . . . 0.0 111.607 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 22.7 t -72.16 166.28 22.67 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 123.31 0.644 . . . . 0.0 110.545 167.074 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -55.57 -43.71 76.19 Favored 'General case' 0 N--CA 1.476 0.831 0 O-C-N 120.83 -1.169 . . . . 0.0 112.495 -177.809 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 13.1 tt0 -73.49 -41.76 62.71 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 123.561 0.744 . . . . 0.0 111.315 176.22 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 84.4 mt-30 -63.07 -38.35 90.84 Favored 'General case' 0 N--CA 1.466 0.335 0 O-C-N 121.698 -0.626 . . . . 0.0 111.94 179.58 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 20.9 ttmm -59.3 -42.19 90.74 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 123.975 0.91 . . . . 0.0 110.748 174.171 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 46.2 mt -69.61 -42.12 80.45 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 CA-C-O 118.036 -0.983 . . . . 0.0 111.361 178.129 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 40.4 mt -64.47 -43.84 96.95 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 CA-C-N 120.644 1.565 . . . . 0.0 110.174 177.997 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -57.98 -47.51 82.76 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.886 1.275 . . . . 0.0 110.336 177.281 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -67.22 -52.19 44.14 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.645 1.178 . . . . 0.0 113.429 177.574 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.7 mm-40 -61.18 -26.42 67.7 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-N 119.1 0.864 . . . . 0.0 113.101 -177.947 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -71.93 -55.71 6.99 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 123.981 0.912 . . . . 0.0 111.21 175.492 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 55.8 mt -58.5 -35.82 56.31 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.589 0 C-N-CA 125.387 1.475 . . . . 0.0 111.168 174.436 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -68.02 -20.78 65.03 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 124.104 0.962 . . . . 0.0 113.326 177.078 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -96.33 -28.15 14.62 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.812 1.245 . . . . 0.0 113.231 178.437 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 9.2 m -126.36 -21.61 2.16 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 N-CA-C 114.376 1.25 . . . . 0.0 114.376 -174.038 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 88.84 141.69 8.17 Favored Glycine 0 CA--C 1.534 1.242 0 C-N-CA 125.633 1.587 . . . . 0.0 112.788 -172.205 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 62.5 tp -60.74 -16.58 41.45 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 125.497 1.519 . . . . 0.0 114.561 -175.395 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -82.83 -18.68 39.56 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.763 1.625 . . . . 0.0 113.079 177.095 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 63.6 m-20 -114.58 -7.69 12.77 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 114.651 1.352 . . . . 0.0 114.651 -170.066 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 26.6 pt -67.32 158.52 5.41 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.42 0 C-N-CA 123.675 0.79 . . . . 0.0 111.265 167.099 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -126.01 146.22 49.98 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 125.086 1.354 . . . . 0.0 111.444 174.916 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -61.68 -27.46 68.7 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.025 0.93 . . . . 0.0 111.975 172.927 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 29.9 mm -63.85 -52.58 55.09 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.444 0 C-N-CA 124.797 1.239 . . . . 0.0 110.567 174.556 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 54.1 m -75.18 -39.33 60.32 Favored 'General case' 0 C--O 1.223 -0.334 0 C-N-CA 123.264 0.625 . . . . 0.0 110.088 -177.749 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 18.1 tp -63.18 -37.04 85.66 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.437 1.095 . . . . 0.0 111.854 175.402 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.401 ' HA ' HG13 ' A' ' 66' ' ' ILE . 44.1 t -53.87 -32.57 53.64 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.951 1.3 . . . . 0.0 112.25 169.411 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -96.98 -31.89 12.3 Favored 'General case' 0 CA--C 1.534 0.351 0 N-CA-C 113.881 1.067 . . . . 0.0 113.881 -176.015 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 47.6 mmtt -60.17 -39.54 86.79 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 125.703 1.601 . . . . 0.0 111.839 178.407 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.3 mp -114.07 15.7 18.3 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 124.753 1.221 . . . . 0.0 113.631 -177.374 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . 0.278 7.5 p30 46.56 55.5 7.52 Favored 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 126.536 1.934 . . . . 0.0 114.037 -177.706 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.401 HG13 ' HA ' ' A' ' 61' ' ' SER . 1.8 pt -119.4 -165.5 0.37 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.761 0 C-N-CA 127.156 2.182 . . . . 0.0 110.958 -174.249 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 5.7 p -98.64 160.38 14.31 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 124.661 1.184 . . . . 0.0 110.901 171.583 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 71.4 t -62.72 -29.66 47.53 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 C-N-CA 123.085 0.554 . . . . 0.0 110.952 173.68 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 58.4 mp0 -77.28 -39.91 46.41 Favored 'General case' 0 CA--C 1.53 0.195 0 O-C-N 121.017 -1.052 . . . . 0.0 109.928 -178.685 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 10.8 tmtt? -66.92 -44.38 80.83 Favored 'General case' 0 C--N 1.341 0.236 0 C-N-CA 124.952 1.301 . . . . 0.0 110.941 178.866 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -58.98 -50.24 74.84 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 126.064 1.746 . . . . 0.0 113.357 170.204 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 21.2 ttmm -69.01 -25.33 64.44 Favored 'General case' 0 N--CA 1.468 0.46 0 O-C-N 120.839 -1.163 . . . . 0.0 111.327 -177.333 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -59.04 -31.7 69.08 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 123.529 0.731 . . . . 0.0 112.608 174.065 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 58.6 m-85 -69.78 -50.21 45.42 Favored 'General case' 0 C--O 1.221 -0.438 0 C-N-CA 124.527 1.131 . . . . 0.0 110.538 170.199 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 84.5 mt -64.15 -25.24 37.61 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.839 0 C-N-CA 124.201 1.0 . . . . 0.0 111.73 -175.589 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 69.0 mmtt -81.54 -25.36 35.94 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 125.461 1.504 . . . . 0.0 114.408 177.741 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 8.6 p30 . . . . . 0 N--CA 1.47 0.55 0 CA-C-N 119.994 1.27 . . . . 0.0 111.958 170.136 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 . . . . . 0 N--CA 1.477 0.893 0 CA-C-O 121.611 0.72 . . . . 0.0 111.852 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -145.91 115.96 7.39 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.463 1.105 . . . . 0.0 110.888 179.449 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 59.9 t -141.12 132.02 27.47 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 C-N-CA 125.199 1.4 . . . . 0.0 110.55 179.027 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 55.1 m -96.77 -50.39 4.69 Favored 'General case' 0 N--CA 1.48 1.06 0 N-CA-C 113.463 0.912 . . . . 0.0 113.463 179.732 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 35.8 t -159.73 -50.38 0.05 Allowed 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 124.708 1.203 . . . . 0.0 112.332 179.982 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 6.0 tpt -121.09 15.74 11.55 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 125.165 1.386 . . . . 0.0 113.068 -174.3 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -83.31 48.75 1.44 Allowed 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 124.867 1.267 . . . . 0.0 112.4 -174.254 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -142.41 155.02 45.08 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.737 1.615 . . . . 0.0 112.268 -175.813 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 4.7 mmpt? . . . . . 0 N--CA 1.474 0.77 0 C-N-CA 124.542 1.137 . . . . 0.0 111.934 178.911 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.7 mpt? . . . . . 0 N--CA 1.469 0.484 0 N-CA-C 110.068 -0.345 . . . . 0.0 110.068 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 44.1 m-20 43.9 63.27 8.42 Favored Pre-proline 0 CA--C 1.555 1.162 0 C-N-CA 126.5 1.92 . . . . 0.0 114.778 176.798 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_endo -72.6 -1.78 10.82 Favored 'Trans proline' 0 C--N 1.351 0.664 0 C-N-CA 123.762 2.975 . . . . 0.0 115.266 -175.714 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 88.7 mt -106.82 38.94 1.96 Allowed 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.902 1.681 . . . . 0.0 112.671 -178.983 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -110.53 1.48 18.19 Favored 'General case' 0 N--CA 1.478 0.959 0 N-CA-C 114.574 1.324 . . . . 0.0 114.574 178.589 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.23 -56.74 1.89 Allowed 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 124.632 1.173 . . . . 0.0 113.269 -165.851 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.0 pp -129.13 13.86 2.66 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.862 0 C-N-CA 126.163 1.785 . . . . 0.0 112.9 -173.523 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 10.7 tt -41.77 126.44 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.02 0 C-N-CA 125.423 1.489 . . . . 0.0 113.402 179.322 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -145.0 16.84 1.57 Allowed 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.816 1.247 . . . . 0.0 112.942 179.981 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -82.95 11.21 6.42 Favored 'General case' 0 CA--C 1.545 0.771 0 N-CA-C 114.534 1.309 . . . . 0.0 114.534 -171.737 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 14.0 tt -141.46 24.38 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 126.473 1.909 . . . . 0.0 113.145 -176.503 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 88.9 tttt . . . . . 0 N--CA 1.473 0.686 0 C-N-CA 124.285 1.034 . . . . 0.0 113.567 179.043 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.5 mt . . . . . 0 CA--C 1.544 0.741 0 N-CA-C 110.497 -0.186 . . . . 0.0 110.497 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 19.0 t -72.1 168.33 18.37 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.088 0.555 . . . . 0.0 110.406 167.298 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -58.65 -45.62 88.92 Favored 'General case' 0 N--CA 1.473 0.695 0 O-C-N 120.25 -1.531 . . . . 0.0 112.607 -174.577 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 9.9 tt0 -71.78 -41.87 67.82 Favored 'General case' 0 N--CA 1.47 0.558 0 O-C-N 121.195 -0.941 . . . . 0.0 111.367 177.344 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 30.6 mm-40 -57.04 -45.32 83.27 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 123.959 0.903 . . . . 0.0 110.72 175.873 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt -60.75 -41.56 95.65 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 124.726 1.21 . . . . 0.0 111.3 178.277 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 51.5 mt -67.54 -41.85 86.26 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 CA-C-O 117.937 -1.03 . . . . 0.0 111.447 177.177 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 36.5 mt -63.8 -44.42 98.21 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 CA-C-N 120.832 1.651 . . . . 0.0 110.072 177.969 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -59.42 -49.21 78.69 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.711 1.204 . . . . 0.0 111.024 177.745 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -64.36 -52.18 59.64 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 124.982 1.313 . . . . 0.0 112.456 177.674 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -60.75 -27.44 67.95 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-N 119.362 0.983 . . . . 0.0 113.027 -179.572 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -69.05 -58.34 4.23 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 123.433 0.693 . . . . 0.0 110.784 174.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 90.8 mt -63.71 -32.68 57.85 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.471 0 C-N-CA 127.016 2.126 . . . . 0.0 111.641 179.572 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -71.48 -25.54 62.31 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.111 0.965 . . . . 0.0 112.713 175.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -90.64 -37.75 13.56 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.188 0.995 . . . . 0.0 112.622 176.233 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.5 m -109.98 -3.41 10.5 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.215 0 N-CA-C 114.371 1.249 . . . . 0.0 114.371 -175.039 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 88.03 10.14 69.6 Favored Glycine 0 N--CA 1.472 1.081 0 C-N-CA 126.096 1.808 . . . . 0.0 116.133 160.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 64.36 4.06 2.05 Favored 'General case' 0 CA--C 1.554 1.116 0 C-N-CA 127.756 2.422 . . . . 0.0 114.677 -164.53 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -85.98 -26.12 25.64 Favored 'General case' 0 N--CA 1.48 1.028 0 O-C-N 120.626 -1.296 . . . . 0.0 113.304 179.631 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 45.6 m-80 -122.63 2.95 9.58 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 113.976 1.102 . . . . 0.0 113.976 -164.85 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 20.5 pt -75.05 155.65 6.26 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.551 0 C-N-CA 123.024 0.53 . . . . 0.0 111.352 174.685 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -139.03 142.18 38.26 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 124.765 1.226 . . . . 0.0 109.304 177.486 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -61.11 -26.51 67.72 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 119.088 0.858 . . . . 0.0 112.439 -179.166 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.9 mp -64.76 -50.88 73.33 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.472 0 C-N-CA 125.555 1.542 . . . . 0.0 109.831 173.778 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 81.1 m -76.3 -41.02 50.0 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 123.849 0.86 . . . . 0.0 110.764 -176.566 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 16.3 tp -61.85 -38.46 88.29 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 125.619 1.568 . . . . 0.0 111.766 174.189 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.422 ' HA ' HG13 ' A' ' 66' ' ' ILE . 39.8 t -56.95 -28.72 62.47 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 124.921 1.288 . . . . 0.0 112.794 170.298 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -100.56 -29.07 12.55 Favored 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 124.789 1.236 . . . . 0.0 114.25 -176.196 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 9.1 mmtm -63.28 -33.61 75.89 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 125.197 1.399 . . . . 0.0 111.715 175.102 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.4 mp -114.43 4.12 15.2 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 125.472 1.509 . . . . 0.0 114.039 -176.584 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 49.2 m-80 53.51 56.66 7.02 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 126.01 1.724 . . . . 0.0 113.366 -179.232 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.422 HG13 ' HA ' ' A' ' 61' ' ' SER . 1.2 pt -125.2 -166.67 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.764 0 C-N-CA 126.885 2.074 . . . . 0.0 110.974 -171.829 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 62.2 p -94.15 155.66 16.96 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 124.514 1.126 . . . . 0.0 111.251 169.915 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 60.6 t -63.93 -24.77 36.58 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 O-C-N 121.628 -0.67 . . . . 0.0 111.086 171.865 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 15.6 mp0 -79.72 -30.33 40.93 Favored 'General case' 0 C--O 1.233 0.209 0 C-N-CA 125.148 1.379 . . . . 0.0 111.124 -174.695 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.16 -32.81 16.48 Favored 'General case' 0 C--N 1.344 0.368 0 CA-C-N 118.156 0.435 . . . . 0.0 111.738 173.978 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -62.14 -46.77 87.5 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 124.239 1.015 . . . . 0.0 111.9 173.149 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 19.9 ptmt -69.0 -24.77 64.26 Favored 'General case' 0 N--CA 1.468 0.449 0 O-C-N 121.296 -0.877 . . . . 0.0 112.121 -176.766 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -60.93 -39.76 90.67 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 120.342 -0.543 . . . . 0.0 110.445 179.247 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 26.4 m-85 -61.48 -38.88 88.88 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 124.609 1.164 . . . . 0.0 112.301 179.752 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 7.3 mt -73.4 -18.11 17.83 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.847 0 C-N-CA 125.852 1.661 . . . . 0.0 111.941 -178.951 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 61.8 tttt -103.52 -33.93 8.86 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 125.678 1.591 . . . . 0.0 110.776 -177.599 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 81.6 m-20 . . . . . 0 CA--C 1.531 0.228 0 C-N-CA 126.72 2.008 . . . . 0.0 109.838 175.799 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 . . . . . 0 CA--C 1.545 0.787 0 CA-C-O 120.964 0.411 . . . . 0.0 111.872 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -145.87 139.86 26.61 Favored 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 125.323 1.449 . . . . 0.0 111.355 175.068 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 95.9 t -138.15 135.13 44.85 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 C-N-CA 126.133 1.773 . . . . 0.0 110.306 179.453 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 19.2 t -154.73 -42.96 0.09 Allowed 'General case' 0 N--CA 1.47 0.529 0 N-CA-C 113.841 1.052 . . . . 0.0 113.841 177.513 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 23.1 p -151.3 117.29 5.54 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-O 122.181 0.991 . . . . 0.0 113.418 -176.187 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 57.9 mtt 54.74 40.97 32.22 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 126.061 1.745 . . . . 0.0 112.983 173.713 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -84.0 3.42 34.45 Favored 'General case' 0 CA--C 1.547 0.828 0 N-CA-C 115.298 1.592 . . . . 0.0 115.298 -163.162 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -133.47 155.37 49.66 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 125.587 1.555 . . . . 0.0 113.167 -174.562 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 33.5 mmtp . . . . . 0 N--CA 1.483 1.178 0 C-N-CA 126.451 1.9 . . . . 0.0 113.515 -176.898 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 58.5 ttm . . . . . 0 CA--C 1.537 0.481 0 CA-C-O 120.667 0.27 . . . . 0.0 110.66 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 25.4 m-20 -127.16 97.62 31.57 Favored Pre-proline 0 CA--C 1.547 0.839 0 C-N-CA 124.922 1.289 . . . . 0.0 111.008 176.217 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 64.8 Cg_endo -83.03 6.87 5.54 Favored 'Trans proline' 0 CA--C 1.539 0.756 0 C-N-CA 123.79 2.993 . . . . 0.0 114.219 179.325 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 92.2 mt -115.55 29.72 7.82 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 125.368 1.467 . . . . 0.0 113.716 -172.734 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -98.02 -1.1 43.36 Favored 'General case' 0 N--CA 1.479 1.024 0 N-CA-C 114.087 1.144 . . . . 0.0 114.087 170.897 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 13.7 ptmt -103.86 -35.38 8.19 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 125.78 1.632 . . . . 0.0 114.78 -171.004 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.3 pp -144.44 -42.12 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.008 0 C-N-CA 125.845 1.658 . . . . 0.0 113.643 -174.324 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . 0.31 10.6 tt 38.27 35.29 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.437 0 N-CA-C 116.283 1.957 . . . . 0.0 116.283 -177.52 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 3.2 t30 55.91 29.07 13.52 Favored 'General case' 0 CA--C 1.552 1.023 0 C-N-CA 125.688 1.595 . . . . 0.0 114.279 -177.744 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 3.2 p-10 -81.2 9.61 6.65 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 116.781 2.141 . . . . 0.0 116.781 -166.11 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 7.1 tp -141.76 18.86 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.835 0 C-N-CA 125.779 1.632 . . . . 0.0 113.733 -175.704 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 13.9 tmtt? . . . . . 0 N--CA 1.475 0.781 0 N-CA-C 115.15 1.537 . . . . 0.0 115.15 -175.753 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 34.5 mt . . . . . 0 CA--C 1.541 0.618 0 CA-C-O 120.73 0.3 . . . . 0.0 111.147 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 29.7 t -69.68 163.28 25.97 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 123.138 0.575 . . . . 0.0 110.735 168.459 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 7.1 tm-20 -53.86 -42.78 68.92 Favored 'General case' 0 N--CA 1.474 0.741 0 O-C-N 120.874 -1.141 . . . . 0.0 112.82 -179.268 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 7.9 pt20 -78.23 -34.62 49.11 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 112.359 0.503 . . . . 0.0 112.359 175.958 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 91.0 mt-30 -68.12 -37.17 80.83 Favored 'General case' 0 CA--C 1.535 0.37 0 O-C-N 121.501 -0.75 . . . . 0.0 111.578 179.517 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 40.1 ttmt -59.3 -39.52 83.28 Favored 'General case' 0 N--CA 1.47 0.568 0 O-C-N 121.272 -0.893 . . . . 0.0 111.209 172.961 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 45.2 mt -72.77 -40.64 61.33 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 CA-C-O 118.262 -0.875 . . . . 0.0 111.296 176.841 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 39.2 mt -64.4 -42.06 94.18 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 CA-C-N 120.644 1.565 . . . . 0.0 110.526 177.8 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -56.38 -52.74 63.5 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 124.336 1.054 . . . . 0.0 109.952 173.903 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -64.64 -50.68 66.13 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 123.687 0.795 . . . . 0.0 113.003 -178.816 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 18.7 mm-40 -62.35 -22.07 65.81 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 113.525 0.935 . . . . 0.0 113.525 -178.423 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -71.55 -60.68 2.1 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 119.038 0.836 . . . . 0.0 110.742 173.376 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 16.2 mt -63.42 -32.45 56.63 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.496 0 C-N-CA 125.939 1.695 . . . . 0.0 111.688 179.847 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -70.26 -21.56 62.96 Favored 'General case' 0 CA--C 1.545 0.754 0 O-C-N 121.255 -0.903 . . . . 0.0 113.066 175.655 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -94.19 -34.77 12.78 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.358 1.063 . . . . 0.0 112.654 177.751 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 11.7 m -116.7 -18.77 6.79 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.066 0 N-CA-C 114.121 1.156 . . . . 0.0 114.121 -174.411 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 80.62 141.05 2.74 Favored Glycine 0 CA--C 1.53 1.001 0 C-N-CA 124.58 1.086 . . . . 0.0 111.649 -171.501 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.0 tt -64.05 -19.02 64.92 Favored 'General case' 0 N--CA 1.473 0.725 0 O-C-N 121.154 -1.203 . . . . 0.0 114.015 -169.029 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 36.8 mt-30 -66.18 -17.1 64.52 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 126.1 1.76 . . . . 0.0 113.324 174.9 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 69.3 m-80 -112.86 -5.93 13.83 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 114.703 1.372 . . . . 0.0 114.703 -174.145 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 3.7 pt -79.72 162.8 3.72 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 C-N-CA 123.55 0.74 . . . . 0.0 112.48 173.117 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -130.83 147.06 52.44 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 124.931 1.292 . . . . 0.0 109.974 171.895 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -63.76 -25.04 68.01 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 121.429 -0.794 . . . . 0.0 112.029 174.387 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -66.42 -46.98 85.36 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.481 0 C-N-CA 125.455 1.502 . . . . 0.0 109.667 173.423 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 89.7 m -74.22 -43.53 56.75 Favored 'General case' 0 C--O 1.224 -0.27 0 C-N-CA 123.344 0.658 . . . . 0.0 110.151 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 18.7 tp -61.96 -36.04 80.24 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 124.491 1.117 . . . . 0.0 111.864 176.046 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 44.9 t -53.01 -33.25 50.84 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.621 1.168 . . . . 0.0 113.146 168.292 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -100.47 -22.65 14.95 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 125.087 1.355 . . . . 0.0 114.518 -175.584 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 63.9 mmtt -65.19 -38.25 89.91 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 124.709 1.204 . . . . 0.0 111.153 173.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.4 mp -111.62 -0.16 16.19 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 125.073 1.349 . . . . 0.0 114.335 -173.028 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 16.0 m-80 56.89 45.41 21.47 Favored 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 125.743 1.617 . . . . 0.0 112.615 -172.875 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 10.5 pt -104.46 -166.83 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 C-N-CA 125.821 1.648 . . . . 0.0 111.227 -179.47 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 44.5 p -94.74 161.19 14.28 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 123.998 0.919 . . . . 0.0 110.889 166.767 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 82.5 t -61.85 -28.28 43.95 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 O-C-N 121.341 -0.849 . . . . 0.0 111.054 170.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -77.31 -40.21 45.11 Favored 'General case' 0 C--O 1.233 0.214 0 O-C-N 120.68 -1.262 . . . . 0.0 110.453 -175.913 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . 0.366 0.0 OUTLIER -91.59 8.37 37.0 Favored 'General case' 0 C--N 1.348 0.508 0 N-CA-C 113.722 1.008 . . . . 0.0 113.722 175.917 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -95.52 -44.37 7.55 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.467 1.507 . . . . 0.0 111.635 159.799 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 23.9 ttmm -74.15 -29.62 61.88 Favored 'General case' 0 CA--C 1.517 -0.29 0 C-N-CA 124.896 1.278 . . . . 0.0 111.465 -174.475 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 51.9 p-10 -55.53 -42.67 74.88 Favored 'General case' 0 CA--C 1.544 0.735 0 CA-C-O 118.631 -0.7 . . . . 0.0 111.905 176.649 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 20.9 m-85 -59.08 -44.01 91.86 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 125.718 1.607 . . . . 0.0 112.376 175.811 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 69.2 mt -68.44 -25.11 30.42 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.795 0 C-N-CA 124.984 1.314 . . . . 0.0 110.041 179.647 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 73.4 mmtt -93.56 -25.32 17.61 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 115.888 1.81 . . . . 0.0 115.888 -179.846 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 8.4 p30 . . . . . 0 N--CA 1.472 0.666 0 CA-C-N 120.682 1.583 . . . . 0.0 113.103 175.949 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 26.1 tt0 . . . . . 0 CA--C 1.546 0.821 0 N-CA-C 113.027 0.751 . . . . 0.0 113.027 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -106.54 98.06 7.78 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 125.071 1.349 . . . . 0.0 111.751 -174.275 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 8.7 m -135.0 31.81 0.79 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.649 0 C-N-CA 125.939 1.696 . . . . 0.0 113.365 -170.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 72.2 m -131.4 -62.19 0.89 Allowed 'General case' 0 N--CA 1.475 0.824 0 N-CA-C 113.524 0.935 . . . . 0.0 113.524 -163.07 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 55.7 p -78.87 -23.74 44.7 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 124.043 0.937 . . . . 0.0 112.963 175.27 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 77.1 mtm -134.69 140.49 46.02 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 126.817 2.047 . . . . 0.0 109.162 169.28 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 6.1 tt0 -145.46 24.31 1.41 Allowed 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 123.865 0.866 . . . . 0.0 112.642 -179.387 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -65.22 127.29 31.11 Favored 'General case' 0 CA--C 1.542 0.65 0 O-C-N 120.701 -1.25 . . . . 0.0 112.55 -173.941 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 47.5 mtmt . . . . . 0 N--CA 1.475 0.809 0 C-N-CA 126.491 1.916 . . . . 0.0 110.778 -177.701 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.4 ttp . . . . . 0 CA--C 1.549 0.909 0 N-CA-C 113.646 0.98 . . . . 0.0 113.646 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 20.6 m-20 -133.45 79.03 61.36 Favored Pre-proline 0 CA--C 1.549 0.916 0 C-N-CA 124.744 1.217 . . . . 0.0 112.227 -169.472 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo -80.95 -3.08 12.14 Favored 'Trans proline' 0 C--N 1.351 0.682 0 C-N-CA 123.88 3.053 . . . . 0.0 115.081 -177.74 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 97.7 mt -112.84 44.46 1.49 Allowed 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 125.938 1.695 . . . . 0.0 112.256 -175.312 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -116.28 1.75 13.14 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 125.08 1.352 . . . . 0.0 114.506 177.831 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.74 -56.0 2.23 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 124.627 1.171 . . . . 0.0 112.899 -167.458 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.0 pp -130.93 14.09 1.99 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 126.236 1.815 . . . . 0.0 112.82 -174.657 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 8.6 tt -43.82 123.46 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 C-N-CA 124.921 1.288 . . . . 0.0 112.537 178.693 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -146.69 10.15 1.05 Allowed 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 124.399 1.08 . . . . 0.0 113.401 179.82 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -81.41 6.39 14.66 Favored 'General case' 0 CA--C 1.546 0.794 0 N-CA-C 114.939 1.459 . . . . 0.0 114.939 -167.626 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 7.0 tp -146.1 23.05 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 C-N-CA 125.916 1.686 . . . . 0.0 113.609 -173.825 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 40.7 ttmt . . . . . 0 N--CA 1.473 0.723 0 N-CA-C 114.081 1.141 . . . . 0.0 114.081 178.802 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.8 mt . . . . . 0 CA--C 1.544 0.726 0 N-CA-C 110.055 -0.35 . . . . 0.0 110.055 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 30.1 t -68.81 163.55 23.93 Favored 'General case' 0 N--CA 1.477 0.911 0 O-C-N 121.81 -0.557 . . . . 0.0 110.636 166.882 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -57.93 -42.0 83.91 Favored 'General case' 0 N--CA 1.477 0.884 0 O-C-N 120.335 -1.478 . . . . 0.0 112.875 -176.595 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 6.9 pt20 -74.96 -35.79 62.09 Favored 'General case' 0 N--CA 1.47 0.544 0 O-C-N 121.71 -0.619 . . . . 0.0 112.323 173.9 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 93.4 mt-30 -66.07 -38.22 87.77 Favored 'General case' 0 CA--C 1.532 0.276 0 O-C-N 121.563 -0.711 . . . . 0.0 111.261 178.823 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 40.7 ttmt -58.83 -41.13 86.15 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 124.228 1.011 . . . . 0.0 111.066 174.941 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 39.4 mt -71.65 -42.44 71.32 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 CA-C-O 118.441 -0.79 . . . . 0.0 110.993 178.106 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 40.1 mt -63.65 -43.04 97.99 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.988 0 CA-C-N 120.282 1.401 . . . . 0.0 110.19 177.851 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -57.4 -51.39 69.6 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 125.043 1.337 . . . . 0.0 110.129 176.097 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -65.14 -46.66 80.03 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.367 1.067 . . . . 0.0 113.508 179.685 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 17.7 mm-40 -67.35 -25.22 65.88 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 123.931 0.892 . . . . 0.0 112.96 179.8 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -72.35 -51.51 20.28 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 118.811 0.732 . . . . 0.0 110.589 175.642 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 42.6 mt -61.51 -32.51 53.67 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.596 0 C-N-CA 124.789 1.236 . . . . 0.0 111.229 173.591 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -66.3 -24.08 66.49 Favored 'General case' 0 CA--C 1.546 0.802 0 O-C-N 121.091 -1.005 . . . . 0.0 113.288 173.953 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -92.43 -31.48 15.28 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.543 1.137 . . . . 0.0 112.828 179.4 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 6.4 m -127.57 -22.39 1.73 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.94 0 N-CA-C 114.209 1.189 . . . . 0.0 114.209 -172.137 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 88.67 148.16 16.39 Favored Glycine 0 CA--C 1.533 1.206 0 C-N-CA 125.422 1.486 . . . . 0.0 113.458 -172.455 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -57.23 -25.63 59.44 Favored 'General case' 0 N--CA 1.481 1.08 0 CA-C-O 123.569 1.652 . . . . 0.0 112.544 -176.833 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 7.2 pt20 -81.16 -13.32 58.75 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 126.738 2.015 . . . . 0.0 114.622 -179.7 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 76.0 m-20 -118.07 -11.93 10.12 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 114.759 1.392 . . . . 0.0 114.759 -177.894 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 46.0 pt -64.21 152.61 8.21 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 CA-C-O 120.899 0.38 . . . . 0.0 110.678 163.418 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -130.15 143.53 50.84 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 124.452 1.101 . . . . 0.0 109.991 178.363 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -62.17 -24.77 67.38 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 118.931 0.787 . . . . 0.0 112.49 -179.65 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.9 mp -70.29 -42.11 78.73 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 C-N-CA 125.868 1.667 . . . . 0.0 110.747 174.629 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 88.8 m -79.09 -42.87 25.31 Favored 'General case' 0 C--N 1.33 -0.276 0 O-C-N 121.675 -0.64 . . . . 0.0 109.62 -179.411 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 17.3 tp -64.86 -35.97 82.83 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 125.701 1.6 . . . . 0.0 112.329 177.022 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.431 ' HA ' HG13 ' A' ' 66' ' ' ILE . 60.5 p -58.29 -26.47 63.05 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 118.995 0.816 . . . . 0.0 112.397 170.982 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -99.49 -30.1 12.35 Favored 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 124.794 1.238 . . . . 0.0 114.22 -178.913 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 11.1 mmtm -63.19 -34.44 77.63 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 125.077 1.351 . . . . 0.0 112.196 177.586 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.1 mp -118.06 8.78 12.53 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 124.981 1.312 . . . . 0.0 113.998 -177.585 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 14.2 t30 55.38 61.82 2.72 Favored 'General case' 0 CA--C 1.552 1.044 0 C-N-CA 125.091 1.357 . . . . 0.0 111.854 177.165 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.431 HG13 ' HA ' ' A' ' 61' ' ' SER . 1.6 pt -136.5 175.87 9.31 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 C-N-CA 126.428 1.891 . . . . 0.0 111.476 -171.148 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 32.4 p -74.99 160.27 30.76 Favored 'General case' 0 N--CA 1.472 0.639 0 O-C-N 120.964 -1.085 . . . . 0.0 111.073 171.987 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 90.6 t -66.61 -26.39 37.27 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.02 0 O-C-N 121.364 -0.835 . . . . 0.0 110.987 169.938 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -77.53 -30.79 52.98 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 124.822 1.249 . . . . 0.0 111.204 -176.916 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . 0.352 0.0 OUTLIER -102.49 18.01 22.23 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 125.254 1.422 . . . . 0.0 113.395 171.254 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -104.05 -43.82 5.17 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.134 1.374 . . . . 0.0 111.616 158.029 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 9.2 ptmm? -73.61 -24.66 60.08 Favored 'General case' 0 N--CA 1.472 0.629 0 O-C-N 120.877 -1.14 . . . . 0.0 112.478 -176.202 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 28.3 p-10 -54.15 -39.63 66.69 Favored 'General case' 0 CA--C 1.545 0.755 0 N-CA-C 113.246 0.832 . . . . 0.0 113.246 173.444 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 28.2 m-85 -69.68 -47.23 63.97 Favored 'General case' 0 C--O 1.226 -0.164 0 C-N-CA 126.902 2.081 . . . . 0.0 110.167 179.314 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 67.7 mt -65.25 -42.76 94.74 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.497 0 C-N-CA 123.974 0.91 . . . . 0.0 109.821 -179.355 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 2.7 tppp? -70.03 -31.54 69.24 Favored 'General case' 0 N--CA 1.467 0.419 0 O-C-N 120.809 -1.182 . . . . 0.0 112.533 -176.17 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 3.6 p30 . . . . . 0 CA--C 1.535 0.367 0 CA-C-N 119.202 0.91 . . . . 0.0 112.032 175.443 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 . . . . . 0 N--CA 1.473 0.711 0 CA-C-O 121.092 0.472 . . . . 0.0 111.393 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -135.52 122.87 21.82 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 124.94 1.296 . . . . 0.0 110.848 -179.004 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 67.9 t -133.94 127.82 52.45 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 C-N-CA 125.513 1.525 . . . . 0.0 109.933 176.835 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 44.2 t -161.29 -56.61 0.05 OUTLIER 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 123.978 0.911 . . . . 0.0 112.635 174.447 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 13.2 t -80.09 -29.6 39.08 Favored 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 113.553 0.945 . . . . 0.0 113.553 -174.517 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 13.3 ttt -135.34 115.08 12.84 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 125.283 1.433 . . . . 0.0 109.991 -178.875 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -117.76 -10.07 10.58 Favored 'General case' 0 N--CA 1.479 0.988 0 N-CA-C 113.89 1.071 . . . . 0.0 113.89 -169.291 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -87.42 124.65 33.64 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 124.866 1.266 . . . . 0.0 112.005 -178.043 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 59.4 mtmt . . . . . 0 N--CA 1.477 0.879 0 C-N-CA 126.098 1.759 . . . . 0.0 110.489 174.957 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.1 mtt . . . . . 0 N--CA 1.471 0.576 0 CA-C-O 120.519 0.2 . . . . 0.0 110.765 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 -135.88 148.44 65.1 Favored Pre-proline 0 CA--C 1.548 0.872 0 C-N-CA 125.11 1.364 . . . . 0.0 112.09 176.67 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -81.43 -7.85 12.72 Favored 'Trans proline' 0 CA--C 1.538 0.678 0 C-N-CA 123.643 2.895 . . . . 0.0 115.097 -177.0 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -130.94 31.4 4.48 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 125.787 1.635 . . . . 0.0 114.206 -174.194 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -101.29 -4.11 27.68 Favored 'General case' 0 N--CA 1.478 0.971 0 N-CA-C 114.67 1.359 . . . . 0.0 114.67 179.589 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -129.79 -57.63 1.11 Allowed 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 124.647 1.179 . . . . 0.0 113.424 -160.62 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.8 pp -107.05 9.5 9.39 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.761 0 C-N-CA 125.925 1.69 . . . . 0.0 112.869 -177.157 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 18.0 tt -48.61 114.4 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.841 0 C-N-CA 125.045 1.338 . . . . 0.0 113.791 -175.219 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 7.7 t30 -161.14 130.15 4.64 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 126.942 2.097 . . . . 0.0 108.586 171.652 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 29.2 t0 -150.42 47.87 0.89 Allowed 'General case' 0 N--CA 1.476 0.835 0 CA-C-O 122.556 1.17 . . . . 0.0 111.106 178.409 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 58.5 mt 48.69 96.7 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 C-N-CA 128.83 2.852 . . . . 0.0 112.539 -168.362 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.445 ' HA ' ' HE2' ' A' ' 12' ' ' LYS . 11.3 mmpt? . . . . . 0 N--CA 1.472 0.663 0 C-N-CA 125.136 1.374 . . . . 0.0 113.321 172.463 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 63.7 mt . . . . . 0 N--CA 1.472 0.637 0 N-CA-C 112.988 0.736 . . . . 0.0 112.988 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 67.4 m -76.33 165.0 25.48 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.73 0.812 . . . . 0.0 110.299 171.144 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -55.22 -45.91 75.95 Favored 'General case' 0 N--CA 1.48 1.027 0 O-C-N 120.746 -1.222 . . . . 0.0 113.185 -174.348 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 10.5 tt0 -67.69 -43.43 80.13 Favored 'General case' 0 N--CA 1.469 0.522 0 O-C-N 121.496 -0.752 . . . . 0.0 111.063 176.758 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 88.7 mt-30 -62.95 -41.48 99.52 Favored 'General case' 0 CA--C 1.536 0.412 0 O-C-N 121.916 -0.49 . . . . 0.0 111.819 178.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 22.6 ttmm -59.74 -40.98 89.89 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 124.27 1.028 . . . . 0.0 110.982 174.742 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 50.6 mt -67.38 -41.53 86.4 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 CA-C-O 118.077 -0.963 . . . . 0.0 111.474 175.583 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 45.6 mt -64.5 -44.91 96.95 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.904 0 CA-C-N 120.773 1.624 . . . . 0.0 110.29 178.074 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -58.29 -48.38 80.66 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.774 1.23 . . . . 0.0 110.587 177.434 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -63.56 -53.11 56.92 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.625 1.17 . . . . 0.0 112.599 176.529 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.3 mm-40 -60.01 -29.99 68.85 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-N 118.998 0.817 . . . . 0.0 112.822 -179.696 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -68.04 -56.95 7.02 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 118.806 0.73 . . . . 0.0 110.93 176.311 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 80.1 mt -64.98 -33.65 65.14 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.333 0 C-N-CA 126.526 1.931 . . . . 0.0 111.195 -179.323 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -72.25 -27.96 62.84 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.892 0.877 . . . . 0.0 112.568 176.309 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -85.53 -39.67 17.16 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 123.861 0.865 . . . . 0.0 112.503 176.337 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.9 m -105.21 -6.95 9.83 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.047 0 N-CA-C 113.654 0.983 . . . . 0.0 113.654 -175.497 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . 0.418 ' C ' ' H ' ' A' ' 53' ' ' GLN . . . 81.48 33.23 28.72 Favored Glycine 0 N--CA 1.471 0.985 0 C-N-CA 124.263 0.935 . . . . 0.0 114.176 164.207 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 20.0 tp 60.86 -26.77 0.04 OUTLIER 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 129.945 3.298 . . . . 0.0 117.708 -174.148 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . 0.418 ' H ' ' C ' ' A' ' 51' ' ' GLY . 29.5 mt-30 -77.27 -13.0 60.02 Favored 'General case' 0 C--N 1.32 -0.684 0 C-N-CA 126.922 2.089 . . . . 0.0 113.752 -169.277 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 60.5 m-80 -123.31 1.16 9.03 Favored 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 114.336 1.236 . . . . 0.0 114.336 -169.736 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 18.3 pt -75.91 155.46 5.95 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 CA-C-O 121.072 0.463 . . . . 0.0 111.705 175.006 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -137.85 143.94 41.19 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 124.658 1.183 . . . . 0.0 110.018 178.794 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -61.33 -26.62 67.93 Favored 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 123.634 0.773 . . . . 0.0 112.316 -179.758 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -67.47 -51.21 54.37 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.327 0 C-N-CA 125.343 1.457 . . . . 0.0 109.631 174.538 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 83.6 m -73.81 -43.82 57.66 Favored 'General case' 0 C--N 1.33 -0.239 0 O-C-N 121.749 -0.594 . . . . 0.0 109.918 -176.719 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 17.2 tp -60.61 -35.09 75.29 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 125.53 1.532 . . . . 0.0 112.343 174.384 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.433 ' HA ' HG13 ' A' ' 66' ' ' ILE . 12.0 t -54.99 -30.43 59.3 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 124.975 1.31 . . . . 0.0 112.581 169.485 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 1.5 mptp? -105.19 -22.78 13.01 Favored 'General case' 0 N--CA 1.468 0.474 0 N-CA-C 114.491 1.293 . . . . 0.0 114.491 -176.464 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 68.4 mmtt -62.9 -34.57 77.69 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 119.797 1.18 . . . . 0.0 111.636 174.074 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.2 mp -120.92 13.65 11.44 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.923 1.289 . . . . 0.0 114.05 -176.401 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . 0.273 0.9 OUTLIER 48.2 53.68 11.4 Favored 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 126.614 1.965 . . . . 0.0 114.218 -177.14 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.433 HG13 ' HA ' ' A' ' 61' ' ' SER . 2.7 pt -117.42 -176.05 0.92 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 C-N-CA 126.781 2.032 . . . . 0.0 111.483 -174.626 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 36.8 p -83.94 156.76 22.19 Favored 'General case' 0 N--CA 1.474 0.734 0 O-C-N 121.214 -0.929 . . . . 0.0 111.084 170.791 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 66.7 t -62.27 -28.94 45.54 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 O-C-N 121.672 -0.643 . . . . 0.0 111.132 170.914 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -74.91 -42.71 57.24 Favored 'General case' 0 C--O 1.234 0.263 0 O-C-N 120.988 -1.07 . . . . 0.0 109.879 -176.597 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . 0.262 0.0 OUTLIER -77.69 -30.17 51.79 Favored 'General case' 0 C--N 1.344 0.348 0 CA-C-N 118.137 0.426 . . . . 0.0 111.88 -178.993 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -65.04 -47.32 77.81 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 124.678 1.191 . . . . 0.0 112.324 169.322 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 38.1 ttmt -68.1 -28.91 67.75 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 124.32 1.048 . . . . 0.0 111.492 -178.258 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -55.17 -36.54 65.96 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 123.494 0.718 . . . . 0.0 112.361 175.729 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 31.5 m-85 -69.54 -42.7 74.28 Favored 'General case' 0 C--O 1.223 -0.324 0 C-N-CA 125.569 1.548 . . . . 0.0 111.02 177.136 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 75.2 mt -68.45 -37.27 77.56 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.468 0 C-N-CA 124.173 0.989 . . . . 0.0 110.264 -178.626 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 88.5 mttt -65.19 -34.91 79.49 Favored 'General case' 0 N--CA 1.471 0.594 0 O-C-N 120.853 -1.154 . . . . 0.0 113.448 178.538 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 9.6 p30 . . . . . 0 N--CA 1.464 0.272 0 CA-C-N 119.315 0.961 . . . . 0.0 111.105 174.202 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 . . . . . 0 N--CA 1.473 0.708 0 CA-C-O 120.982 0.42 . . . . 0.0 111.72 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -121.43 74.25 1.1 Allowed 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 125.166 1.386 . . . . 0.0 110.692 -175.394 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 18.6 m -135.12 21.92 1.05 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.615 0 C-N-CA 125.588 1.555 . . . . 0.0 114.229 -170.76 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 22.9 t -146.45 -56.59 0.28 Allowed 'General case' 0 N--CA 1.476 0.831 0 N-CA-C 113.517 0.932 . . . . 0.0 113.517 -176.625 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 45.6 m -88.15 -40.27 13.87 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 123.261 0.624 . . . . 0.0 112.441 -175.509 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 1.8 mpt? -125.05 141.66 51.98 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 126.473 1.909 . . . . 0.0 108.827 169.75 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -148.04 94.49 2.34 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.752 1.221 . . . . 0.0 109.259 178.31 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -138.2 156.18 47.95 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.195 1.398 . . . . 0.0 112.304 -178.863 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 2.0 mmmp? . . . . . 0 N--CA 1.478 0.93 0 C-N-CA 125.996 1.718 . . . . 0.0 110.831 179.894 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 36.9 ttm . . . . . 0 CA--C 1.547 0.863 0 N-CA-C 112.926 0.713 . . . . 0.0 112.926 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 -84.76 147.81 49.76 Favored Pre-proline 0 CA--C 1.547 0.847 0 C-N-CA 124.628 1.171 . . . . 0.0 112.481 -179.141 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_endo -71.03 -19.18 30.44 Favored 'Trans proline' 0 C--N 1.35 0.655 0 C-N-CA 122.935 2.424 . . . . 0.0 114.963 -173.634 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.414 HD21 ' H ' ' A' ' 4' ' ' LEU . 2.6 pt? -112.63 25.68 11.24 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 126.828 2.051 . . . . 0.0 114.402 -172.353 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -103.01 0.52 32.22 Favored 'General case' 0 N--CA 1.477 0.876 0 N-CA-C 114.815 1.413 . . . . 0.0 114.815 -178.167 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -122.46 -55.36 1.84 Allowed 'General case' 0 N--CA 1.484 1.234 0 N-CA-C 113.894 1.072 . . . . 0.0 113.894 -165.168 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.0 pp -129.84 15.15 2.39 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 C-N-CA 125.652 1.581 . . . . 0.0 112.81 -171.784 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 14.2 tt -39.79 133.33 0.49 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.847 0 C-N-CA 126.407 1.883 . . . . 0.0 114.407 178.724 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 25.8 t30 -148.54 148.85 30.66 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 126.242 1.817 . . . . 0.0 110.732 170.63 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 20.2 m-20 -132.63 71.47 1.47 Allowed 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 125.389 1.475 . . . . 0.0 111.004 170.41 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . 0.34 6.7 tp 52.21 26.26 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.069 0 C-N-CA 128.262 2.625 . . . . 0.0 115.571 175.098 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.476 0.867 0 N-CA-C 114.818 1.414 . . . . 0.0 114.818 177.612 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 11.2 mt . . . . . 0 CA--C 1.54 0.593 0 N-CA-C 110.398 -0.223 . . . . 0.0 110.398 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 68.3 m -69.06 167.19 16.52 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.006 0.522 . . . . 0.0 110.47 171.158 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -56.26 -45.48 80.07 Favored 'General case' 0 N--CA 1.478 0.927 0 O-C-N 120.463 -1.398 . . . . 0.0 112.651 -176.327 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 10.3 tt0 -70.16 -44.25 69.18 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 123.527 0.731 . . . . 0.0 111.347 176.338 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 82.9 mt-30 -59.71 -41.66 91.3 Favored 'General case' 0 N--CA 1.468 0.453 0 O-C-N 121.805 -0.559 . . . . 0.0 111.693 178.16 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 3.4 ttmp? -62.34 -40.05 95.11 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 124.206 1.002 . . . . 0.0 111.215 177.542 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 52.4 mt -70.53 -39.46 76.18 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.558 0 CA-C-O 117.958 -1.02 . . . . 0.0 111.585 175.655 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 50.7 mt -62.87 -45.64 98.36 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.99 0 CA-C-N 120.942 1.701 . . . . 0.0 109.733 176.676 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -58.58 -49.44 77.45 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.829 1.251 . . . . 0.0 110.924 178.56 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -63.94 -52.21 60.8 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 124.784 1.234 . . . . 0.0 112.766 177.086 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -60.22 -30.36 69.34 Favored 'General case' 0 N--CA 1.472 0.625 0 CA-C-N 118.99 0.814 . . . . 0.0 112.724 179.867 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -67.02 -56.84 8.38 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 118.631 0.65 . . . . 0.0 110.605 176.659 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 87.1 mt -62.81 -34.14 64.14 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 C-N-CA 126.383 1.873 . . . . 0.0 111.287 178.126 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -70.91 -28.08 64.26 Favored 'General case' 0 CA--C 1.542 0.663 0 O-C-N 121.267 -0.896 . . . . 0.0 112.654 177.169 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -85.67 -40.26 16.37 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.127 0.971 . . . . 0.0 112.208 175.689 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.5 m -108.75 -5.04 10.73 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.159 0 N-CA-C 114.32 1.23 . . . . 0.0 114.32 -172.275 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 84.96 25.25 41.66 Favored Glycine 0 CA--C 1.529 0.96 0 C-N-CA 125.111 1.339 . . . . 0.0 115.263 161.318 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 58.01 6.64 0.51 Allowed 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 127.267 2.227 . . . . 0.0 115.155 -172.923 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 29.2 mt-30 -105.71 -18.01 14.21 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 125.856 1.663 . . . . 0.0 113.098 -172.139 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 47.0 m-80 -124.06 3.79 8.64 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 124.257 1.023 . . . . 0.0 113.542 -172.631 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 24.6 pt -74.36 154.31 6.68 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 CA-C-O 121.085 0.469 . . . . 0.0 111.116 172.666 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -138.85 142.65 38.63 Favored 'General case' 0 N--CA 1.466 0.375 0 C-N-CA 124.824 1.25 . . . . 0.0 109.525 178.68 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -61.01 -27.87 68.63 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 118.838 0.745 . . . . 0.0 112.274 -179.772 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -63.84 -49.29 82.58 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.466 0 C-N-CA 125.576 1.55 . . . . 0.0 109.922 174.626 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 83.9 m -78.98 -43.0 25.35 Favored 'General case' 0 C--O 1.223 -0.32 0 C-N-CA 123.806 0.842 . . . . 0.0 110.302 -175.904 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 14.0 tp -60.01 -36.75 77.89 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 125.078 1.351 . . . . 0.0 111.745 174.098 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 30.4 t -56.44 -31.41 63.93 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 124.839 1.255 . . . . 0.0 112.632 170.601 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -101.24 -26.36 13.67 Favored 'General case' 0 N--CA 1.467 0.39 0 N-CA-C 114.643 1.349 . . . . 0.0 114.643 -175.81 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 58.7 mmtt -64.41 -33.01 74.87 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 125.135 1.374 . . . . 0.0 111.577 175.387 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.7 mp -117.84 3.92 12.22 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.213 1.405 . . . . 0.0 114.353 -175.086 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 24.7 m-80 57.0 57.52 4.57 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 126.388 1.875 . . . . 0.0 113.415 -178.659 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 1.2 pt -124.74 -163.99 0.38 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.849 0 C-N-CA 127.243 2.217 . . . . 0.0 110.554 -174.641 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 2.4 p -100.8 162.24 13.04 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 124.296 1.039 . . . . 0.0 111.126 170.284 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 69.2 t -61.65 -28.9 45.05 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 C-N-CA 123.545 0.738 . . . . 0.0 111.391 173.242 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -80.87 -38.17 28.59 Favored 'General case' 0 N--CA 1.471 0.613 0 O-C-N 120.893 -1.129 . . . . 0.0 110.394 -178.971 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 9.5 tmtt? -64.67 -45.5 86.45 Favored 'General case' 0 C--O 1.224 -0.237 0 C-N-CA 125.632 1.573 . . . . 0.0 110.518 176.961 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -60.34 -48.62 80.97 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 126.275 1.83 . . . . 0.0 113.444 170.71 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 36.5 ttmt -71.62 -23.03 61.64 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 124.227 1.011 . . . . 0.0 111.758 -174.417 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -52.02 -47.73 64.86 Favored 'General case' 0 CA--C 1.545 0.76 0 CA-C-N 118.137 0.426 . . . . 0.0 110.527 171.421 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 33.9 m-85 -64.6 -43.28 94.29 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 123.845 0.858 . . . . 0.0 111.982 179.776 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 55.8 mt -63.91 -25.38 38.04 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.629 0 C-N-CA 123.978 0.911 . . . . 0.0 111.099 179.15 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -91.06 -31.85 16.11 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 125.176 1.39 . . . . 0.0 114.686 179.724 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 23.5 p30 . . . . . 0 CA--C 1.54 0.57 0 CA-C-N 120.247 1.385 . . . . 0.0 114.224 -179.258 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 . . . . . 0 N--CA 1.473 0.676 0 CA-C-O 120.825 0.345 . . . . 0.0 111.276 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -144.64 96.8 2.93 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 124.833 1.253 . . . . 0.0 110.345 -175.535 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 71.7 t -136.59 137.99 46.99 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 C-N-CA 125.577 1.551 . . . . 0.0 110.683 -177.33 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 67.5 p -161.92 -66.26 0.05 Allowed 'General case' 0 N--CA 1.476 0.837 0 N-CA-C 113.609 0.966 . . . . 0.0 113.609 172.632 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 77.9 p -82.43 -23.54 34.77 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 124.977 1.311 . . . . 0.0 114.291 -173.157 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 93.1 mtp -133.5 130.93 39.21 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 126.023 1.729 . . . . 0.0 109.495 174.551 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -138.69 65.63 1.45 Allowed 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 125.074 1.35 . . . . 0.0 109.93 -174.683 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 53.4 -155.62 0.2 Allowed 'General case' 0 CA--C 1.555 1.147 0 C-N-CA 125.855 1.662 . . . . 0.0 113.886 -174.94 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 71.2 mmtt . . . . . 0 N--CA 1.478 0.973 0 C-N-CA 126.287 1.835 . . . . 0.0 111.947 177.851 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 21.0 ttt . . . . . 0 CA--C 1.55 0.972 0 CA-C-O 121.157 0.503 . . . . 0.0 112.298 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -120.82 98.39 47.81 Favored Pre-proline 0 CA--C 1.546 0.809 0 O-C-N 120.639 -1.288 . . . . 0.0 111.981 -168.796 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 95.5 Cg_endo -83.66 -8.59 10.31 Favored 'Trans proline' 0 C--N 1.351 0.665 0 C-N-CA 123.205 2.603 . . . . 0.0 114.699 178.145 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 94.3 mt -102.69 44.22 1.03 Allowed 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.626 1.57 . . . . 0.0 113.683 -170.582 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -106.91 -1.77 21.98 Favored 'General case' 0 N--CA 1.479 1.004 0 N-CA-C 114.907 1.447 . . . . 0.0 114.907 172.073 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -128.49 -56.46 1.23 Allowed 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 124.174 0.99 . . . . 0.0 113.363 -166.833 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.7 pp -109.54 9.07 8.96 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 C-N-CA 126.029 1.732 . . . . 0.0 112.888 -175.912 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 13.3 tt -49.85 120.31 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 124.223 1.009 . . . . 0.0 112.559 -179.252 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 53.85 21.48 2.79 Favored 'General case' 0 CA--C 1.55 0.965 0 C-N-CA 126.536 1.935 . . . . 0.0 115.244 179.937 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -86.32 13.83 7.5 Favored 'General case' 0 CA--C 1.547 0.832 0 N-CA-C 114.794 1.405 . . . . 0.0 114.794 -168.636 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 12.7 tt -143.69 21.35 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.879 0 C-N-CA 125.325 1.45 . . . . 0.0 114.201 -174.076 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 54.3 mtpt . . . . . 0 N--CA 1.479 0.979 0 N-CA-C 115.572 1.693 . . . . 0.0 115.572 178.895 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 8.1 mt . . . . . 0 CA--C 1.543 0.677 0 N-CA-C 110.224 -0.287 . . . . 0.0 110.224 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 22.8 t -70.93 164.46 25.39 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 122.93 0.492 . . . . 0.0 110.747 169.83 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -57.24 -44.17 83.58 Favored 'General case' 0 N--CA 1.476 0.836 0 O-C-N 120.531 -1.355 . . . . 0.0 112.965 -175.3 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 8.1 pt20 -75.9 -33.88 59.93 Favored 'General case' 0 N--CA 1.471 0.6 0 O-C-N 121.693 -0.63 . . . . 0.0 112.155 174.769 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 93.2 mt-30 -67.52 -39.5 85.11 Favored 'General case' 0 CA--C 1.532 0.264 0 O-C-N 121.662 -0.649 . . . . 0.0 111.52 -179.691 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 23.7 ttmm -59.36 -41.0 88.24 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 124.213 1.005 . . . . 0.0 110.81 174.682 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 46.2 mt -69.65 -42.2 80.38 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.656 0 CA-C-O 118.136 -0.935 . . . . 0.0 111.283 177.026 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 42.4 mt -63.86 -44.5 98.11 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.069 0 CA-C-N 120.702 1.592 . . . . 0.0 110.361 178.357 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -59.69 -47.52 85.33 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 125.033 1.333 . . . . 0.0 110.865 176.74 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -63.92 -51.83 62.67 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 124.634 1.173 . . . . 0.0 112.67 176.703 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -58.95 -31.62 68.87 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-N 119.261 0.937 . . . . 0.0 112.689 179.124 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -66.07 -57.41 7.78 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 118.621 0.646 . . . . 0.0 110.587 176.869 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 71.0 mt -62.7 -35.13 69.17 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.352 0 C-N-CA 127.199 2.2 . . . . 0.0 111.896 178.631 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -71.97 -29.03 63.83 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.023 0.929 . . . . 0.0 112.408 178.138 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -86.27 -38.76 17.22 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 123.988 0.915 . . . . 0.0 112.312 176.236 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.3 m -106.55 -5.91 10.19 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.191 0 N-CA-C 114.285 1.217 . . . . 0.0 114.285 -174.372 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 86.32 25.85 35.27 Favored Glycine 0 N--CA 1.472 1.085 0 C-N-CA 124.967 1.27 . . . . 0.0 115.306 161.594 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 54.3 14.24 0.74 Allowed 'General case' 0 CA--C 1.554 1.116 0 C-N-CA 127.381 2.272 . . . . 0.0 115.129 -173.538 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 5.2 pt20 -124.6 -3.17 7.84 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 124.854 1.262 . . . . 0.0 113.662 -171.589 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 50.4 m-80 -124.55 3.52 8.31 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 124.935 1.294 . . . . 0.0 113.411 174.419 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 33.0 pt -74.51 152.95 6.76 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.648 0 O-C-N 121.68 -0.638 . . . . 0.0 112.192 177.007 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -135.49 146.13 47.83 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 125.237 1.415 . . . . 0.0 109.864 174.522 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -65.0 -24.99 67.67 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.884 0.874 . . . . 0.0 112.125 177.397 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -68.02 -38.5 79.99 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.488 0 C-N-CA 125.905 1.682 . . . . 0.0 110.419 173.464 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 90.7 m -83.06 -43.67 16.04 Favored 'General case' 0 C--N 1.33 -0.25 0 O-C-N 121.661 -0.649 . . . . 0.0 109.668 -178.643 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 8.0 mt -60.44 -36.86 79.18 Favored 'General case' 0 N--CA 1.468 0.439 0 O-C-N 121.442 -0.786 . . . . 0.0 112.571 171.297 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.416 ' HA ' HG13 ' A' ' 66' ' ' ILE . 62.1 p -59.98 -24.69 64.64 Favored 'General case' 0 N--CA 1.477 0.921 0 CA-C-N 119.509 1.049 . . . . 0.0 112.669 175.938 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -103.13 -28.23 12.07 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 125.277 1.431 . . . . 0.0 114.246 -177.625 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 19.7 mmmt -64.31 -31.0 72.03 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.841 1.257 . . . . 0.0 112.775 176.889 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.3 mp -126.71 9.5 7.03 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 114.158 1.17 . . . . 0.0 114.158 -175.378 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 16.4 m-80 56.04 59.8 3.55 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 125.932 1.693 . . . . 0.0 113.222 -178.541 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.416 HG13 ' HA ' ' A' ' 61' ' ' SER . 1.1 pt -128.41 173.83 12.81 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 C-N-CA 126.747 2.019 . . . . 0.0 111.679 -173.986 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.2 p -77.17 158.16 30.53 Favored 'General case' 0 N--CA 1.477 0.905 0 O-C-N 120.998 -1.064 . . . . 0.0 111.054 173.931 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 87.6 t -63.69 -28.88 45.89 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.909 0 O-C-N 121.632 -0.667 . . . . 0.0 111.25 172.752 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -77.63 -37.83 49.27 Favored 'General case' 0 N--CA 1.47 0.551 0 O-C-N 120.711 -1.243 . . . . 0.0 110.19 -179.757 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 5.0 tmtm? -65.01 -48.52 73.62 Favored 'General case' 0 C--O 1.225 -0.227 0 C-N-CA 125.489 1.515 . . . . 0.0 110.402 176.423 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -59.61 -42.9 93.67 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 126.107 1.763 . . . . 0.0 113.213 172.808 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 36.3 ttmt -74.16 -29.37 61.75 Favored 'General case' 0 CA--C 1.516 -0.342 0 C-N-CA 124.477 1.111 . . . . 0.0 111.838 -175.958 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -50.5 -45.98 56.86 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 118.415 0.552 . . . . 0.0 110.405 176.837 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 35.6 m-85 -64.58 -39.17 93.25 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.75 0.82 . . . . 0.0 111.559 -176.453 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 20.2 mt -71.91 -28.07 29.23 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.623 0 C-N-CA 124.594 1.157 . . . . 0.0 110.955 -179.952 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 25.4 mmmt -76.98 -39.93 48.69 Favored 'General case' 0 N--CA 1.466 0.33 0 O-C-N 120.878 -1.138 . . . . 0.0 112.251 178.032 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 24.2 p30 . . . . . 0 N--CA 1.468 0.431 0 CA-C-N 119.123 0.874 . . . . 0.0 112.63 -174.771 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.476 0.858 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -132.17 43.07 3.06 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 125.092 1.357 . . . . 0.0 112.291 -179.911 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 7.2 p -152.37 142.83 15.38 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.442 0 C-N-CA 124.916 1.286 . . . . 0.0 111.321 -173.369 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 43.9 m 53.17 28.26 6.84 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 125.859 1.664 . . . . 0.0 115.361 177.618 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 35.4 t -153.57 -49.42 0.09 Allowed 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 124.916 1.286 . . . . 0.0 112.145 -179.029 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 78.1 mtm -131.16 69.08 1.48 Allowed 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 125.401 1.48 . . . . 0.0 110.556 178.648 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -77.1 74.7 3.67 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 124.836 1.255 . . . . 0.0 110.318 176.376 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 56.27 -170.98 0.08 Allowed 'General case' 0 CA--C 1.554 1.133 0 C-N-CA 126.479 1.912 . . . . 0.0 113.899 -167.887 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 98.4 mttt . . . . . 0 N--CA 1.478 0.97 0 C-N-CA 126.028 1.731 . . . . 0.0 111.712 178.757 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 98.8 mmm . . . . . 0 N--CA 1.47 0.531 0 CA-C-O 120.795 0.331 . . . . 0.0 111.437 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 22.2 m-20 -122.42 102.18 39.79 Favored Pre-proline 0 CA--C 1.547 0.834 0 C-N-CA 125.225 1.41 . . . . 0.0 111.008 177.902 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 65.1 Cg_endo -86.29 2.82 7.18 Favored 'Trans proline' 0 C--N 1.35 0.607 0 C-N-CA 123.66 2.906 . . . . 0.0 114.559 -179.336 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 84.6 mt -111.32 41.69 1.81 Allowed 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 125.449 1.5 . . . . 0.0 113.176 -171.575 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -110.02 1.02 18.72 Favored 'General case' 0 N--CA 1.48 1.031 0 N-CA-C 114.985 1.476 . . . . 0.0 114.985 176.572 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -117.13 -55.51 2.33 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 124.142 0.977 . . . . 0.0 113.418 -168.443 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.9 pp -129.22 12.23 2.61 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 C-N-CA 126.238 1.815 . . . . 0.0 112.996 -171.975 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 11.7 tt -41.98 126.81 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.908 0 C-N-CA 125.569 1.547 . . . . 0.0 113.794 -176.854 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 49.5 t30 -153.93 138.93 17.26 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.497 1.519 . . . . 0.0 110.516 165.515 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 33.5 t0 -152.59 62.07 0.81 Allowed 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.765 1.226 . . . . 0.0 110.204 171.509 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 86.8 mt 54.95 106.57 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.543 0 C-N-CA 128.363 2.665 . . . . 0.0 112.153 -162.013 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 11.6 mmpt? . . . . . 0 N--CA 1.48 1.075 0 C-N-CA 125.57 1.548 . . . . 0.0 113.438 175.611 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.1 mt . . . . . 0 CA--C 1.543 0.708 0 CA-C-O 120.328 0.109 . . . . 0.0 111.081 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 23.2 t -73.45 166.34 23.4 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.452 0.701 . . . . 0.0 110.768 169.015 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -56.98 -44.29 82.52 Favored 'General case' 0 N--CA 1.476 0.83 0 O-C-N 120.343 -1.473 . . . . 0.0 113.106 -174.732 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 6.7 pt20 -76.3 -35.88 58.63 Favored 'General case' 0 N--CA 1.47 0.542 0 O-C-N 121.642 -0.661 . . . . 0.0 112.233 175.028 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 92.7 mt-30 -65.35 -38.98 91.75 Favored 'General case' 0 N--CA 1.464 0.271 0 O-C-N 121.595 -0.69 . . . . 0.0 111.21 179.254 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 40.9 ttmt -58.87 -41.44 87.06 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 124.522 1.129 . . . . 0.0 110.814 175.569 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 42.5 mt -71.24 -41.21 74.85 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.638 0 CA-C-O 118.358 -0.829 . . . . 0.0 111.219 177.911 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 37.9 mt -65.15 -41.44 91.77 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.964 0 CA-C-N 120.166 1.348 . . . . 0.0 110.363 177.416 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -60.72 -48.45 81.72 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.541 1.137 . . . . 0.0 110.737 176.763 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -66.04 -50.21 64.96 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 124.472 1.109 . . . . 0.0 112.141 178.608 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -65.56 -22.65 66.72 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 119.222 0.919 . . . . 0.0 113.104 -176.185 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -71.58 -58.96 3.02 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.228 1.011 . . . . 0.0 110.834 173.075 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 86.8 mt -63.84 -33.06 59.61 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.451 0 C-N-CA 126.794 2.038 . . . . 0.0 111.598 -179.861 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -71.04 -24.75 62.41 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.076 0.951 . . . . 0.0 112.704 176.234 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -90.78 -38.81 12.76 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.199 0.999 . . . . 0.0 112.517 175.767 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.3 m -110.24 -3.41 10.54 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.111 0 N-CA-C 114.167 1.173 . . . . 0.0 114.167 -173.577 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 85.21 23.11 49.75 Favored Glycine 0 N--CA 1.473 1.112 0 C-N-CA 125.219 1.39 . . . . 0.0 115.457 159.326 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 56.87 6.9 0.35 Allowed 'General case' 0 CA--C 1.554 1.128 0 C-N-CA 127.577 2.351 . . . . 0.0 115.181 -170.335 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 29.2 mt-30 -104.71 -17.69 14.55 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 125.545 1.538 . . . . 0.0 112.977 -173.005 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 44.5 m-80 -123.98 4.17 8.68 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.396 1.078 . . . . 0.0 113.634 -173.543 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 23.1 pt -75.28 155.26 6.22 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 C-N-CA 122.976 0.51 . . . . 0.0 111.291 173.377 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -137.62 142.85 41.23 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 124.487 1.115 . . . . 0.0 110.257 179.106 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -60.7 -27.45 67.89 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.741 0.816 . . . . 0.0 112.227 -179.867 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -65.93 -49.76 74.64 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.484 0 C-N-CA 125.606 1.562 . . . . 0.0 110.125 175.044 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 61.9 m -77.79 -43.41 30.73 Favored 'General case' 0 C--O 1.222 -0.387 0 C-N-CA 123.612 0.765 . . . . 0.0 109.962 -175.642 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 19.8 tp -61.39 -35.11 76.6 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 125.481 1.513 . . . . 0.0 112.171 174.322 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.409 ' HA ' HG13 ' A' ' 66' ' ' ILE . 30.3 t -54.96 -31.65 60.82 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 124.719 1.208 . . . . 0.0 112.513 168.501 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -100.57 -26.9 13.67 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 125.033 1.333 . . . . 0.0 114.162 -174.892 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 64.6 mmtt -61.44 -37.7 84.51 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 125.018 1.327 . . . . 0.0 111.773 174.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.2 mp -116.95 6.73 13.06 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 114.146 1.165 . . . . 0.0 114.146 -174.373 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 20.4 m-80 56.56 57.46 4.82 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 126.485 1.914 . . . . 0.0 113.23 -179.046 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.409 HG13 ' HA ' ' A' ' 61' ' ' SER . 1.6 pt -124.76 -170.93 0.67 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.693 0 C-N-CA 126.584 1.954 . . . . 0.0 110.917 -172.753 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.5 p -89.76 159.98 16.77 Favored 'General case' 0 N--CA 1.476 0.862 0 O-C-N 121.311 -0.868 . . . . 0.0 110.921 170.258 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 88.8 t -62.14 -30.18 48.2 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.893 0 C-N-CA 123.187 0.595 . . . . 0.0 111.307 172.641 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -79.73 -36.7 36.99 Favored 'General case' 0 N--CA 1.469 0.492 0 O-C-N 121.001 -1.062 . . . . 0.0 110.514 -179.055 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 4.6 tmtm? -68.08 -44.45 76.26 Favored 'General case' 0 C--O 1.222 -0.362 0 C-N-CA 124.421 1.088 . . . . 0.0 110.715 177.242 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -59.33 -46.87 87.42 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 125.046 1.338 . . . . 0.0 112.752 170.107 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 18.9 ttmm -67.67 -26.69 66.32 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 124.417 1.087 . . . . 0.0 111.523 -176.79 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -51.26 -42.14 60.86 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-N 118.171 0.441 . . . . 0.0 111.216 174.2 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 24.2 m-85 -70.39 -39.71 74.37 Favored 'General case' 0 C--O 1.225 -0.211 0 C-N-CA 124.479 1.111 . . . . 0.0 111.588 -177.474 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 52.6 mt -67.15 -24.79 32.58 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 C-N-CA 125.608 1.563 . . . . 0.0 111.185 179.292 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.437 ' HA ' ' HE2' ' A' ' 76' ' ' LYS . 10.6 mmpt? -95.23 -25.44 16.37 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 125.322 1.449 . . . . 0.0 113.177 178.46 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 42.6 m-20 . . . . . 0 N--CA 1.465 0.298 0 C-N-CA 125.305 1.442 . . . . 0.0 110.679 174.242 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 17.3 mm-40 . . . . . 0 N--CA 1.474 0.76 0 N-CA-C 114.083 1.142 . . . . 0.0 114.083 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -143.41 79.9 1.65 Allowed 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 124.579 1.152 . . . . 0.0 111.2 178.614 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 11.6 p -151.1 154.77 7.95 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.715 0 C-N-CA 125.71 1.604 . . . . 0.0 110.578 177.099 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 25.5 m 63.76 -39.42 0.2 Allowed 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 128.301 2.64 . . . . 0.0 116.909 -179.333 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 49.8 m -86.01 -19.56 30.16 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.738 1.215 . . . . 0.0 114.122 -177.547 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 13.5 ttt -144.57 28.99 1.28 Allowed 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.986 1.315 . . . . 0.0 112.458 -177.731 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -83.54 59.68 5.25 Favored 'General case' 0 CA--C 1.55 0.943 0 C-N-CA 124.881 1.273 . . . . 0.0 111.624 -174.75 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -152.02 165.1 35.71 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 125.841 1.656 . . . . 0.0 112.442 -177.628 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 36.4 mtmm . . . . . 0 N--CA 1.478 0.94 0 C-N-CA 125.848 1.659 . . . . 0.0 111.539 171.569 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 60.6 mtt . . . . . 0 N--CA 1.477 0.884 0 CA-C-O 121.418 0.628 . . . . 0.0 111.231 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -130.09 110.03 16.78 Favored Pre-proline 0 CA--C 1.55 0.949 0 C-N-CA 124.75 1.22 . . . . 0.0 111.79 -173.726 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 69.3 Cg_endo -85.28 -8.52 8.69 Favored 'Trans proline' 0 C--N 1.352 0.741 0 C-N-CA 123.51 2.807 . . . . 0.0 115.179 -176.609 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 96.6 mt -111.92 48.65 0.95 Allowed 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 126.261 1.825 . . . . 0.0 111.183 -177.757 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -118.29 1.52 11.86 Favored 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 114.26 1.208 . . . . 0.0 114.26 -179.836 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -119.12 -55.84 2.13 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 124.673 1.189 . . . . 0.0 112.879 -168.402 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.1 pp -128.98 14.32 2.72 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 C-N-CA 126.414 1.886 . . . . 0.0 112.762 -173.741 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 7.7 tt -46.54 105.31 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.1 0 C-N-CA 125.346 1.458 . . . . 0.0 112.4 179.79 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -154.71 -3.29 0.16 Allowed 'General case' 0 N--CA 1.478 0.929 0 N-CA-C 114.519 1.303 . . . . 0.0 114.519 -177.406 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -84.62 12.12 7.65 Favored 'General case' 0 CA--C 1.546 0.796 0 N-CA-C 115.157 1.54 . . . . 0.0 115.157 -162.383 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 7.1 tp -147.01 29.29 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 C-N-CA 125.73 1.612 . . . . 0.0 113.32 -173.707 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 2.3 tppp? . . . . . 0 N--CA 1.476 0.834 0 N-CA-C 114.824 1.416 . . . . 0.0 114.824 -179.085 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 49.7 mt . . . . . 0 CA--C 1.54 0.595 0 CA-C-O 120.537 0.208 . . . . 0.0 111.045 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 70.7 m -72.98 164.8 26.14 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 122.891 0.476 . . . . 0.0 110.255 169.794 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -55.21 -44.2 75.18 Favored 'General case' 0 N--CA 1.478 0.932 0 O-C-N 120.76 -1.213 . . . . 0.0 112.797 -176.261 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 12.8 tt0 -69.7 -42.92 73.41 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 123.552 0.741 . . . . 0.0 111.19 176.187 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 83.9 mt-30 -63.71 -39.0 93.2 Favored 'General case' 0 CA--C 1.536 0.42 0 O-C-N 121.659 -0.65 . . . . 0.0 112.12 179.183 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -61.21 -40.11 92.77 Favored 'General case' 0 N--CA 1.468 0.475 0 O-C-N 121.06 -1.025 . . . . 0.0 110.903 173.719 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 51.6 mt -69.62 -39.51 78.36 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 CA-C-O 117.789 -1.101 . . . . 0.0 111.704 175.817 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 47.3 mt -64.03 -43.28 97.53 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.947 0 CA-C-N 121.01 1.732 . . . . 0.0 110.285 176.814 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -59.5 -47.49 85.3 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.056 0.943 . . . . 0.0 110.885 176.795 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -69.44 -49.17 57.51 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 124.335 1.054 . . . . 0.0 112.86 -179.714 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -64.29 -23.14 67.19 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-N 118.91 0.777 . . . . 0.0 112.96 -176.646 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -69.4 -59.55 2.92 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 124.206 1.002 . . . . 0.0 110.72 174.309 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 50.5 mt -60.74 -34.28 58.37 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.436 0 C-N-CA 125.309 1.444 . . . . 0.0 111.492 176.95 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -67.07 -21.04 65.91 Favored 'General case' 0 CA--C 1.546 0.807 0 O-C-N 121.269 -0.895 . . . . 0.0 113.271 176.379 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -98.03 -31.27 12.23 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 124.748 1.219 . . . . 0.0 113.309 178.308 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 5.9 m -122.36 -19.21 4.36 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 N-CA-C 114.139 1.163 . . . . 0.0 114.139 -173.857 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 83.43 147.1 7.21 Favored Glycine 0 CA--C 1.532 1.096 0 C-N-CA 124.964 1.269 . . . . 0.0 112.864 -172.128 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 12.3 tp -61.63 -13.25 20.66 Favored 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 125.244 1.418 . . . . 0.0 113.81 -175.05 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 7.6 pt20 -87.8 -16.26 34.62 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 127.143 2.177 . . . . 0.0 114.134 179.437 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 76.1 m-80 -111.15 -11.66 14.22 Favored 'General case' 0 N--CA 1.476 0.858 0 N-CA-C 114.513 1.301 . . . . 0.0 114.513 -178.138 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 43.8 pt -67.92 156.87 6.64 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.614 0 C-N-CA 123.83 0.852 . . . . 0.0 111.722 168.856 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.2 p -131.21 142.24 50.15 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 125.704 1.602 . . . . 0.0 109.645 174.215 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -63.17 -25.81 68.52 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 123.769 0.828 . . . . 0.0 112.27 177.573 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.9 mp -63.29 -49.61 82.31 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 C-N-CA 125.124 1.37 . . . . 0.0 109.601 173.055 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 97.2 m -75.26 -41.7 56.77 Favored 'General case' 0 C--O 1.224 -0.289 0 C-N-CA 123.929 0.892 . . . . 0.0 110.749 -177.846 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.9 tt -67.03 -32.63 73.97 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 124.627 1.171 . . . . 0.0 111.954 177.825 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 44.5 t -53.98 -33.33 56.73 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 124.791 1.236 . . . . 0.0 113.034 165.455 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -97.87 -22.79 16.16 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 125.071 1.348 . . . . 0.0 113.667 -175.166 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 7.9 mmtm -69.04 -37.95 78.86 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 124.792 1.237 . . . . 0.0 111.386 175.924 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.4 mp -107.52 -0.98 21.76 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 125.14 1.376 . . . . 0.0 114.057 -175.577 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 16.7 m-80 57.89 48.13 14.03 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 126.133 1.773 . . . . 0.0 112.603 -175.041 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 15.3 pt -111.98 -159.19 0.14 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.632 0 C-N-CA 125.964 1.706 . . . . 0.0 110.992 -177.078 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 44.6 p -100.79 161.04 13.87 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 124.649 1.179 . . . . 0.0 111.323 168.084 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 59.6 t -61.59 -24.31 33.47 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 O-C-N 121.58 -0.7 . . . . 0.0 111.059 169.34 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -78.18 -37.02 46.73 Favored 'General case' 0 C--O 1.232 0.166 0 O-C-N 120.901 -1.124 . . . . 0.0 110.246 -178.15 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 33.5 mttm -64.71 -52.86 54.91 Favored 'General case' 0 C--N 1.347 0.498 0 CA-C-N 118.888 0.767 . . . . 0.0 110.568 167.395 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -58.99 -37.55 77.11 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.012 0.925 . . . . 0.0 112.773 -172.13 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 23.7 ttmm -77.57 -31.02 52.88 Favored 'General case' 0 CA--C 1.522 -0.123 0 C-N-CA 125.444 1.498 . . . . 0.0 111.889 177.777 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -57.09 -42.38 80.6 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 119.037 0.835 . . . . 0.0 111.531 179.596 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 39.3 m-85 -61.93 -51.5 67.88 Favored 'General case' 0 C--O 1.222 -0.389 0 C-N-CA 124.451 1.101 . . . . 0.0 109.641 178.481 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 71.3 mt -62.27 -25.07 36.69 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.875 0 C-N-CA 124.475 1.11 . . . . 0.0 111.517 -179.363 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 13.1 tppt? -87.48 -27.29 22.75 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 126.498 1.919 . . . . 0.0 113.28 -179.385 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 31.6 p30 . . . . . 0 CA--C 1.546 0.825 0 CA-C-N 119.897 1.226 . . . . 0.0 113.401 177.88 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 . . . . . 0 CA--C 1.541 0.623 0 CA-C-O 120.889 0.376 . . . . 0.0 110.302 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -133.62 65.22 1.59 Allowed 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 125.096 1.358 . . . . 0.0 111.307 -173.933 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 94.6 t -132.28 143.68 39.24 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.687 0 C-N-CA 125.061 1.344 . . . . 0.0 111.227 -179.569 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 82.8 p -147.4 -53.64 0.21 Allowed 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 173.138 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 22.6 t -149.99 113.32 4.93 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 124.634 1.173 . . . . 0.0 111.322 177.33 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 54.2 mtt 55.0 24.39 5.91 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 126.041 1.737 . . . . 0.0 115.145 -178.089 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 -82.62 67.48 8.69 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 125.33 1.452 . . . . 0.0 111.329 179.291 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -140.12 159.58 41.87 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 125.391 1.476 . . . . 0.0 112.6 -178.217 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 98.4 mttt . . . . . 0 N--CA 1.478 0.945 0 C-N-CA 125.92 1.688 . . . . 0.0 111.993 177.901 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.546 0.792 0 CA-C-O 122.37 1.081 . . . . 0.0 111.802 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 59.6 m-20 47.15 70.71 1.92 Allowed Pre-proline 0 CA--C 1.551 1.007 0 C-N-CA 127.006 2.122 . . . . 0.0 114.59 171.828 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 88.8 Cg_endo -69.35 0.39 5.4 Favored 'Trans proline' 0 CA--C 1.542 0.893 0 C-N-CA 124.21 3.274 . . . . 0.0 115.455 -173.634 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -134.93 33.14 3.17 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 126.408 1.883 . . . . 0.0 113.626 -178.65 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -99.58 -2.08 36.59 Favored 'General case' 0 N--CA 1.477 0.898 0 N-CA-C 114.407 1.262 . . . . 0.0 114.407 172.855 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -131.5 -60.78 0.93 Allowed 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 124.782 1.233 . . . . 0.0 113.458 -160.361 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.8 pp -106.45 9.66 9.35 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 C-N-CA 125.609 1.564 . . . . 0.0 112.937 -178.55 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 19.2 tt -46.11 129.06 2.45 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 124.632 1.173 . . . . 0.0 112.854 175.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -151.48 49.67 0.82 Allowed 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 125.683 1.593 . . . . 0.0 109.935 -179.646 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -115.71 15.56 16.46 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 124.347 1.059 . . . . 0.0 112.84 -170.378 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 15.9 tt -159.23 40.25 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 C-N-CA 126.692 1.997 . . . . 0.0 112.272 -175.815 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 87.0 tttt . . . . . 0 N--CA 1.476 0.85 0 N-CA-C 115.914 1.82 . . . . 0.0 115.914 -170.574 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 62.8 mt . . . . . 0 N--CA 1.471 0.616 0 CA-C-O 120.932 0.396 . . . . 0.0 112.015 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 66.0 m -71.33 164.3 26.01 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 123.295 0.638 . . . . 0.0 110.491 170.889 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -56.6 -44.72 81.4 Favored 'General case' 0 N--CA 1.477 0.901 0 O-C-N 120.633 -1.292 . . . . 0.0 112.974 -174.669 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 10.7 tt0 -68.82 -43.1 76.24 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 123.763 0.825 . . . . 0.0 110.989 175.752 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 85.0 mt-30 -61.13 -42.44 98.54 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 122.914 0.486 . . . . 0.0 111.968 178.349 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 40.1 ttmt -59.94 -39.07 84.26 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 124.073 0.949 . . . . 0.0 111.232 176.139 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 45.2 mt -68.26 -41.83 84.1 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 CA-C-O 118.121 -0.942 . . . . 0.0 111.386 174.386 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 48.3 mt -64.3 -44.66 97.32 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.982 0 CA-C-N 120.777 1.626 . . . . 0.0 110.48 178.555 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -56.02 -49.41 73.75 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 124.799 1.24 . . . . 0.0 110.195 176.54 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -65.52 -52.34 53.37 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.177 0.991 . . . . 0.0 113.024 178.185 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 19.6 mm-40 -62.24 -26.95 68.66 Favored 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 112.925 0.713 . . . . 0.0 112.925 -179.137 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -70.38 -55.28 9.48 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 123.576 0.751 . . . . 0.0 111.126 175.875 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 44.6 mt -60.57 -35.11 61.24 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.553 0 C-N-CA 124.958 1.303 . . . . 0.0 111.48 175.571 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -68.51 -21.46 64.58 Favored 'General case' 0 CA--C 1.545 0.765 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 176.761 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -95.92 -30.2 13.76 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.666 1.187 . . . . 0.0 113.029 178.963 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 6.0 m -122.27 -25.21 2.3 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.003 0 CA-C-N 119.651 1.114 . . . . 0.0 113.946 -173.966 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 94.07 142.38 12.19 Favored Glycine 0 CA--C 1.533 1.21 0 C-N-CA 125.303 1.43 . . . . 0.0 113.213 -172.694 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 55.0 tp -60.03 -16.85 34.43 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 127.046 2.139 . . . . 0.0 115.503 -171.879 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 7.9 pm0 -99.05 -10.15 22.97 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 127.732 2.413 . . . . 0.0 113.825 179.74 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 80.9 m-20 -107.18 -14.29 14.94 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.86 1.264 . . . . 0.0 114.111 178.907 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 26.5 pt -63.27 157.14 4.39 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 C-N-CA 123.267 0.627 . . . . 0.0 111.276 164.679 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -130.09 145.93 51.72 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.523 1.129 . . . . 0.0 110.035 175.28 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -61.73 -26.82 68.29 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 123.773 0.829 . . . . 0.0 112.271 177.288 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.9 mp -69.99 -40.08 78.18 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.454 0 C-N-CA 125.993 1.717 . . . . 0.0 110.519 175.857 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 90.8 m -80.78 -41.31 23.63 Favored 'General case' 0 C--O 1.223 -0.292 0 O-C-N 121.64 -0.663 . . . . 0.0 109.522 179.209 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 17.0 tp -64.77 -35.65 81.78 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 125.014 1.326 . . . . 0.0 111.946 177.026 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.404 ' HA ' HG13 ' A' ' 66' ' ' ILE . 60.2 p -60.38 -24.62 65.26 Favored 'General case' 0 N--CA 1.476 0.841 0 CA-C-N 118.893 0.77 . . . . 0.0 113.006 170.449 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -100.94 -31.03 11.32 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 125.3 1.44 . . . . 0.0 114.107 -177.119 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 54.9 mmtt -63.76 -34.51 78.06 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 125.331 1.452 . . . . 0.0 111.582 177.875 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.4 mp -117.67 4.23 12.33 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 124.987 1.315 . . . . 0.0 114.415 -175.165 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 21.6 m-80 57.58 60.96 2.62 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 126.276 1.831 . . . . 0.0 113.375 -178.591 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.404 HG13 ' HA ' ' A' ' 61' ' ' SER . 1.1 pt -133.48 174.8 12.64 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.843 0 C-N-CA 126.771 2.028 . . . . 0.0 111.946 -171.536 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.3 p -76.72 157.9 31.36 Favored 'General case' 0 N--CA 1.478 0.945 0 O-C-N 121.096 -1.003 . . . . 0.0 111.352 173.082 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 89.5 t -62.92 -28.47 45.09 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 CA-C-O 118.838 -0.601 . . . . 0.0 111.421 173.637 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 65.3 mm-40 -81.75 -36.62 28.34 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 120.307 1.412 . . . . 0.0 110.825 -178.872 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 5.2 tmtm? -62.6 -44.67 95.73 Favored 'General case' 0 N--CA 1.464 0.268 0 C-N-CA 125.456 1.503 . . . . 0.0 110.348 175.249 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -66.25 -48.74 69.51 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.989 1.716 . . . . 0.0 112.757 173.927 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -71.12 -27.95 63.95 Favored 'General case' 0 CA--C 1.515 -0.376 0 O-C-N 120.976 -1.077 . . . . 0.0 111.673 -173.388 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -60.59 -36.6 78.93 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 119.929 -0.708 . . . . 0.0 111.306 178.029 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 23.9 m-85 -61.28 -41.22 96.6 Favored 'General case' 0 N--CA 1.463 0.2 0 O-C-N 121.312 -0.867 . . . . 0.0 111.742 174.063 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 61.1 mt -70.44 -29.12 37.51 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.643 0 C-N-CA 124.683 1.193 . . . . 0.0 110.903 179.598 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 7.3 tptm -76.49 -35.16 58.54 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 125.169 1.388 . . . . 0.0 111.862 174.707 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 96.0 m-20 . . . . . 0 N--CA 1.462 0.153 0 C-N-CA 126.405 1.882 . . . . 0.0 110.338 -172.775 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 . . . . . 0 CA--C 1.543 0.701 0 N-CA-C 111.403 0.149 . . . . 0.0 111.403 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 54.18 65.82 1.4 Allowed 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 126.094 1.758 . . . . 0.0 113.594 -179.225 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 21.0 t -130.17 72.49 0.43 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 C-N-CA 125.166 1.387 . . . . 0.0 110.428 179.272 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 45.4 t -163.82 -68.32 0.04 OUTLIER 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.766 0.826 . . . . 0.0 113.013 172.638 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 17.1 t -74.05 -31.92 63.09 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 123.611 0.765 . . . . 0.0 112.786 -175.403 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 97.2 mtp -127.29 137.25 52.8 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 125.949 1.7 . . . . 0.0 109.556 169.524 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 17.7 tt0 -153.85 41.66 0.52 Allowed 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 124.616 1.166 . . . . 0.0 111.046 -177.317 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 52.41 -141.87 0.8 Allowed 'General case' 0 CA--C 1.552 1.045 0 C-N-CA 125.233 1.413 . . . . 0.0 112.253 -165.694 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 66.9 mttm . . . . . 0 N--CA 1.476 0.838 0 C-N-CA 125.777 1.631 . . . . 0.0 111.512 177.294 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 16.9 ttt . . . . . 0 CA--C 1.548 0.894 0 N-CA-C 112.716 0.636 . . . . 0.0 112.716 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 11.6 t0 -138.97 121.68 10.56 Favored Pre-proline 0 CA--C 1.55 0.981 0 O-C-N 120.626 -1.296 . . . . 0.0 112.344 -170.053 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_endo -83.83 -2.32 10.26 Favored 'Trans proline' 0 C--N 1.352 0.726 0 C-N-CA 123.768 2.979 . . . . 0.0 114.971 179.054 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 75.7 mt -107.54 41.59 1.48 Allowed 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.867 1.667 . . . . 0.0 112.173 -176.82 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -106.91 0.83 24.13 Favored 'General case' 0 N--CA 1.476 0.873 0 N-CA-C 114.779 1.4 . . . . 0.0 114.779 178.345 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -120.05 -56.87 1.98 Allowed 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 124.396 1.079 . . . . 0.0 113.328 -167.975 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.0 pp -129.1 14.7 2.67 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.925 0 C-N-CA 126.176 1.791 . . . . 0.0 112.988 -171.888 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 14.1 tt -41.08 130.4 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.917 0 C-N-CA 125.496 1.518 . . . . 0.0 112.851 177.824 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 35.3 t30 -141.71 0.63 1.45 Allowed 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 115.332 1.604 . . . . 0.0 115.332 -176.881 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -85.1 11.25 10.08 Favored 'General case' 0 CA--C 1.546 0.805 0 N-CA-C 114.601 1.334 . . . . 0.0 114.601 -173.777 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 13.5 tt -147.97 27.17 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.913 0 C-N-CA 125.533 1.533 . . . . 0.0 113.694 -170.989 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 58.5 mtmt . . . . . 0 N--CA 1.477 0.909 0 N-CA-C 115.311 1.597 . . . . 0.0 115.311 179.392 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.9 mt . . . . . 0 CA--C 1.545 0.751 0 N-CA-C 109.227 -0.657 . . . . 0.0 109.227 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 23.3 t -71.95 163.46 27.81 Favored 'General case' 0 N--CA 1.48 1.052 0 O-C-N 121.878 -0.514 . . . . 0.0 110.26 170.253 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -56.26 -45.48 80.05 Favored 'General case' 0 N--CA 1.477 0.924 0 O-C-N 120.257 -1.527 . . . . 0.0 112.863 -174.175 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 9.4 tt0 -71.18 -43.15 68.03 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 123.526 0.73 . . . . 0.0 111.553 175.675 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 89.3 mt-30 -61.29 -38.28 86.21 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 123.302 0.641 . . . . 0.0 111.885 178.587 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 41.2 ttmt -62.91 -44.23 96.65 Favored 'General case' 0 N--CA 1.464 0.249 0 C-N-CA 124.86 1.264 . . . . 0.0 110.731 175.732 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 49.8 mt -65.65 -43.97 93.7 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 CA-C-O 118.45 -0.786 . . . . 0.0 110.924 177.117 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 52.6 mt -63.97 -46.44 94.01 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 CA-C-N 120.078 1.308 . . . . 0.0 110.299 179.296 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -59.04 -48.9 79.91 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 125.14 1.376 . . . . 0.0 110.931 178.263 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -63.82 -53.04 56.98 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 124.954 1.301 . . . . 0.0 112.185 177.096 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 17.0 mm-40 -60.13 -30.45 69.3 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 119.088 0.858 . . . . 0.0 112.5 179.476 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -66.2 -58.83 4.53 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 118.988 0.813 . . . . 0.0 110.705 175.592 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 70.6 mt -62.72 -35.02 68.72 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.329 0 C-N-CA 126.573 1.949 . . . . 0.0 111.622 179.884 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -74.65 -29.42 61.25 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.05 0.94 . . . . 0.0 112.415 178.98 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -82.69 -40.0 21.23 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.778 0.831 . . . . 0.0 112.183 174.621 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.8 m -104.15 -12.55 9.15 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.086 0 N-CA-C 114.386 1.254 . . . . 0.0 114.386 -173.612 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 91.59 27.85 16.16 Favored Glycine 0 CA--C 1.534 1.253 0 C-N-CA 125.108 1.337 . . . . 0.0 115.805 164.589 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 56.13 9.08 0.45 Allowed 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 127.427 2.291 . . . . 0.0 115.027 -173.9 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 2.5 pt20 -117.92 -7.96 10.84 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 125.798 1.639 . . . . 0.0 113.435 -167.087 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 67.3 m-80 -123.28 -1.4 8.68 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 125.094 1.358 . . . . 0.0 113.305 178.339 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 21.7 pt -72.16 150.39 8.7 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 CA-C-O 121.016 0.436 . . . . 0.0 111.417 177.734 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -138.04 143.61 40.62 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 124.448 1.099 . . . . 0.0 109.398 177.687 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -61.39 -26.62 67.97 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 118.787 0.722 . . . . 0.0 112.468 -179.418 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -66.96 -42.99 89.48 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 C-N-CA 125.654 1.582 . . . . 0.0 110.548 174.601 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 81.6 m -79.77 -46.46 16.94 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 123.681 0.793 . . . . 0.0 109.192 -177.466 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 17.3 tp -62.59 -34.69 77.5 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.561 1.544 . . . . 0.0 112.511 177.563 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.412 ' HA ' HG13 ' A' ' 66' ' ' ILE . 60.2 p -61.95 -25.2 67.46 Favored 'General case' 0 N--CA 1.475 0.81 0 N-CA-C 113.222 0.823 . . . . 0.0 113.222 171.667 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -101.55 -24.67 14.1 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 125.434 1.493 . . . . 0.0 114.115 -178.112 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 21.0 mmmt -65.74 -34.87 79.19 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.9 1.28 . . . . 0.0 111.497 172.82 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 49.6 mt -115.91 -1.1 12.64 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 125.931 1.692 . . . . 0.0 113.52 -169.319 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 26.7 m-80 57.0 61.63 2.52 Favored 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 126.683 1.993 . . . . 0.0 113.542 -177.342 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.412 HG13 ' HA ' ' A' ' 61' ' ' SER . 0.6 OUTLIER -136.17 178.18 5.4 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 C-N-CA 127.118 2.167 . . . . 0.0 111.548 -171.838 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -78.25 159.13 28.67 Favored 'General case' 0 N--CA 1.478 0.975 0 O-C-N 121.047 -1.033 . . . . 0.0 111.392 172.266 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 98.6 t -63.49 -31.44 52.91 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.955 0 O-C-N 121.605 -0.685 . . . . 0.0 111.187 172.808 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -78.4 -35.95 46.44 Favored 'General case' 0 N--CA 1.471 0.584 0 O-C-N 120.895 -1.128 . . . . 0.0 110.065 -177.353 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 5.4 tmtm? -65.24 -49.96 67.65 Favored 'General case' 0 C--O 1.223 -0.292 0 C-N-CA 125.316 1.447 . . . . 0.0 110.379 174.255 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -58.53 -42.9 88.81 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 125.036 1.334 . . . . 0.0 112.605 174.23 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 34.5 ttmt -71.73 -28.13 63.46 Favored 'General case' 0 CA--C 1.519 -0.219 0 CA-C-O 118.076 -0.964 . . . . 0.0 111.577 -176.586 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -50.58 -44.6 56.89 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 118.973 0.806 . . . . 0.0 111.145 175.849 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 40.3 m-85 -65.54 -38.1 88.63 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.815 0.846 . . . . 0.0 110.782 -177.191 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 35.5 mt -69.39 -27.63 35.13 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.674 0 C-N-CA 124.916 1.286 . . . . 0.0 110.724 176.967 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 45.1 mttt -79.11 -31.88 44.35 Favored 'General case' 0 N--CA 1.47 0.563 0 O-C-N 120.393 -1.442 . . . . 0.0 114.553 176.51 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 24.7 p30 . . . . . 0 N--CA 1.471 0.625 0 CA-C-N 119.844 1.202 . . . . 0.0 112.351 -176.155 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 2.7 pp20? . . . . . 0 N--CA 1.474 0.774 0 N-CA-C 112.234 0.457 . . . . 0.0 112.234 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -147.12 57.12 1.14 Allowed 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 124.155 0.982 . . . . 0.0 111.939 175.617 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 26.5 t -134.87 133.54 53.85 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.94 0 C-N-CA 124.126 0.97 . . . . 0.0 112.14 -179.361 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 9.2 t -114.38 78.37 1.15 Allowed 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 125.015 1.326 . . . . 0.0 111.294 177.025 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 6.1 t 47.37 74.52 0.16 Allowed 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 126.848 2.059 . . . . 0.0 114.364 175.821 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 91.4 mtp 54.21 61.74 2.9 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 125.743 1.617 . . . . 0.0 113.485 -176.032 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -79.05 47.31 0.76 Allowed 'General case' 0 CA--C 1.553 1.07 0 C-N-CA 125.126 1.371 . . . . 0.0 112.037 174.808 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -147.74 155.73 42.01 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 126.165 1.786 . . . . 0.0 112.02 -176.213 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 36.6 mtmm . . . . . 0 N--CA 1.475 0.819 0 C-N-CA 125.397 1.479 . . . . 0.0 111.002 -176.976 . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 83.6 mtp . . . . . 0 N--CA 1.475 0.803 0 CA-C-O 121.749 0.785 . . . . 0.0 111.175 . . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -119.99 148.25 46.31 Favored Pre-proline 0 CA--C 1.545 0.758 0 C-N-CA 125.552 1.541 . . . . 0.0 112.194 -170.852 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -69.24 -19.08 39.08 Favored 'Trans proline' 0 C--N 1.35 0.632 0 C-N-CA 123.284 2.656 . . . . 0.0 114.745 -175.04 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.2 pt? -95.11 12.41 28.77 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 126.271 1.828 . . . . 0.0 114.343 -179.585 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -71.05 -8.04 50.62 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 115.189 1.551 . . . . 0.0 115.189 -176.809 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -116.72 -63.31 1.46 Allowed 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 124.796 1.238 . . . . 0.0 113.243 -163.631 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.3 pp -103.15 -18.09 6.79 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.85 0 C-N-CA 124.72 1.208 . . . . 0.0 113.053 -175.875 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . 0.287 11.3 tt 35.99 48.81 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.167 0 C-N-CA 127.301 2.24 . . . . 0.0 116.332 170.903 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -126.33 88.9 2.92 Favored 'General case' 0 CA--C 1.542 0.658 0 O-C-N 120.844 -1.16 . . . . 0.0 111.911 -177.136 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -138.17 79.98 1.77 Allowed 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.84 1.256 . . . . 0.0 110.813 -178.707 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . 0.358 9.5 tt 50.31 26.23 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.205 0 C-N-CA 127.708 2.403 . . . . 0.0 115.124 179.458 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 3.8 ttpt . . . . . 0 N--CA 1.473 0.679 0 C-N-CA 124.949 1.299 . . . . 0.0 114.462 -178.316 . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.4 mt . . . . . 0 CA--C 1.544 0.723 0 N-CA-C 109.898 -0.408 . . . . 0.0 109.898 . . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 67.1 m -74.3 165.09 25.77 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 123.199 0.6 . . . . 0.0 110.829 171.925 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -55.06 -43.99 74.35 Favored 'General case' 0 N--CA 1.48 1.037 0 O-C-N 120.665 -1.272 . . . . 0.0 113.54 -172.983 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 8.5 pt20 -77.82 -35.21 51.5 Favored 'General case' 0 N--CA 1.472 0.625 0 O-C-N 121.56 -0.713 . . . . 0.0 112.547 174.802 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 84.6 mt-30 -65.17 -38.47 90.63 Favored 'General case' 0 N--CA 1.466 0.369 0 O-C-N 121.616 -0.678 . . . . 0.0 111.397 178.961 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 23.4 ttmm -58.99 -42.34 89.78 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 124.555 1.142 . . . . 0.0 110.879 175.173 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 41.0 mt -71.01 -42.3 76.86 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.557 0 CA-C-O 118.265 -0.874 . . . . 0.0 110.977 178.818 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 43.3 mt -63.13 -44.34 99.38 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 CA-C-N 120.412 1.46 . . . . 0.0 110.215 177.246 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -59.0 -49.11 79.15 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 125.12 1.368 . . . . 0.0 110.897 178.069 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -63.25 -52.83 60.51 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 124.858 1.263 . . . . 0.0 112.435 176.374 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -58.52 -31.48 67.94 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-N 119.28 0.945 . . . . 0.0 112.771 179.205 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -66.83 -58.44 5.04 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 118.794 0.725 . . . . 0.0 110.593 177.296 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 72.3 mt -65.82 -33.48 63.89 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.442 0 C-N-CA 126.323 1.849 . . . . 0.0 111.615 -178.638 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -72.41 -26.83 62.01 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 123.693 0.797 . . . . 0.0 112.294 177.733 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -86.21 -40.88 15.14 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.039 0.935 . . . . 0.0 112.096 174.939 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.2 m -108.4 -5.57 10.7 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.241 0 N-CA-C 114.552 1.315 . . . . 0.0 114.552 -171.918 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 86.72 26.94 30.76 Favored Glycine 0 CA--C 1.532 1.1 0 C-N-CA 124.711 1.148 . . . . 0.0 115.519 160.543 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 55.99 10.11 0.55 Allowed 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 127.479 2.312 . . . . 0.0 115.322 -173.991 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 5.1 pt20 -123.18 -3.7 8.49 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 124.946 1.298 . . . . 0.0 113.694 -168.948 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 58.8 m-80 -122.43 0.88 9.52 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 124.995 1.318 . . . . 0.0 113.191 174.638 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 18.0 pt -76.97 154.25 5.59 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 C-N-CA 123.039 0.535 . . . . 0.0 111.593 175.963 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -139.82 143.65 36.93 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 124.805 1.242 . . . . 0.0 109.634 179.623 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -60.65 -27.09 67.54 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 118.871 0.76 . . . . 0.0 112.379 179.698 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -67.14 -48.45 78.71 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.463 0 C-N-CA 125.644 1.577 . . . . 0.0 110.194 175.574 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 76.9 m -78.33 -43.65 27.25 Favored 'General case' 0 C--O 1.224 -0.257 0 C-N-CA 123.477 0.711 . . . . 0.0 109.97 -176.659 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 18.6 tp -60.17 -34.58 73.78 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 125.375 1.47 . . . . 0.0 112.082 173.713 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.428 ' HA ' HG13 ' A' ' 66' ' ' ILE . 35.1 t -52.92 -36.14 59.24 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 124.363 1.065 . . . . 0.0 112.571 168.527 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -100.66 -22.82 14.8 Favored 'General case' 0 CA--C 1.533 0.299 0 N-CA-C 114.405 1.261 . . . . 0.0 114.405 -173.088 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 66.6 mmtt -63.99 -34.64 78.46 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 124.721 1.208 . . . . 0.0 111.947 174.953 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.5 mp -117.72 2.67 12.29 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 124.866 1.266 . . . . 0.0 114.076 -174.781 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 12.9 m-80 56.57 46.4 20.52 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 125.613 1.565 . . . . 0.0 112.763 -172.917 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.428 HG13 ' HA ' ' A' ' 61' ' ' SER . 9.9 pt -105.15 -171.99 0.36 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.619 0 C-N-CA 125.913 1.685 . . . . 0.0 111.11 -179.953 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -89.33 158.16 17.91 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 123.523 0.729 . . . . 0.0 110.41 170.081 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 49.7 t -59.1 -31.23 45.41 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.119 0 O-C-N 121.595 -0.69 . . . . 0.0 111.422 170.059 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -80.41 -35.95 34.44 Favored 'General case' 0 CA--C 1.53 0.211 0 O-C-N 121.139 -0.976 . . . . 0.0 110.184 -177.111 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 26.0 tttt -65.97 -44.71 84.14 Favored 'General case' 0 C--N 1.344 0.341 0 C-N-CA 123.393 0.677 . . . . 0.0 110.731 174.06 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -58.51 -49.56 76.95 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.673 1.589 . . . . 0.0 112.35 173.923 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 35.0 ttmt -68.88 -30.0 68.41 Favored 'General case' 0 N--CA 1.463 0.18 0 O-C-N 121.11 -0.994 . . . . 0.0 111.195 -177.152 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -56.15 -37.28 69.29 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 122.97 0.508 . . . . 0.0 112.362 175.311 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 48.6 m-85 -68.55 -45.13 72.96 Favored 'General case' 0 N--CA 1.463 0.218 0 C-N-CA 125.482 1.513 . . . . 0.0 110.609 176.092 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 79.7 mt -64.33 -31.53 53.88 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 C-N-CA 124.961 1.304 . . . . 0.0 111.35 -179.535 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 47.9 mtmt -81.81 -33.65 30.66 Favored 'General case' 0 N--CA 1.469 0.521 0 N-CA-C 113.875 1.065 . . . . 0.0 113.875 -178.188 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 5.7 p30 . . . . . 0 N--CA 1.465 0.322 0 CA-C-N 119.417 1.008 . . . . 0.0 111.31 173.944 . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 . . . . . 0 CA--C 1.543 0.699 0 N-CA-C 112.331 0.493 . . . . 0.0 112.331 . . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 57.91 49.98 11.07 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 125.498 1.519 . . . . 0.0 114.41 179.671 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 45.3 t -130.27 137.52 56.14 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.743 0 C-N-CA 125.383 1.473 . . . . 0.0 110.546 176.066 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 13.7 t -136.81 -44.13 0.58 Allowed 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 123.829 0.851 . . . . 0.0 113.131 174.71 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 21.1 t -147.42 103.36 3.55 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.048 0.939 . . . . 0.0 111.826 175.101 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 24.8 mmt 52.13 31.92 9.73 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 126.04 1.736 . . . . 0.0 114.8 178.99 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 11.7 mt-10 -83.4 48.68 1.44 Allowed 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 125.657 1.583 . . . . 0.0 113.221 -176.227 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -119.23 155.44 31.71 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 126.642 1.977 . . . . 0.0 111.787 177.35 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 8.8 mptt . . . . . 0 N--CA 1.477 0.896 0 C-N-CA 125.091 1.357 . . . . 0.0 110.667 -178.963 . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 77.6 mtm . . . . . 0 N--CA 1.474 0.77 0 CA-C-O 121.308 0.575 . . . . 0.0 112.184 . . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -128.84 75.04 80.49 Favored Pre-proline 0 CA--C 1.551 0.986 0 C-N-CA 124.981 1.312 . . . . 0.0 112.049 176.79 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 80.3 Cg_endo -78.9 -3.83 13.51 Favored 'Trans proline' 0 C--N 1.352 0.735 0 C-N-CA 123.973 3.115 . . . . 0.0 114.909 -179.834 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 94.1 mt -108.76 41.34 1.61 Allowed 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 126.279 1.832 . . . . 0.0 112.167 -177.261 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -107.14 -5.04 18.24 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 114.472 1.286 . . . . 0.0 114.472 178.035 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.21 -58.29 2.15 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 124.296 1.038 . . . . 0.0 113.027 -162.508 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.1 pp -129.04 15.11 2.69 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 C-N-CA 126.615 1.966 . . . . 0.0 112.713 -174.981 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 10.2 tt -41.55 124.35 0.49 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.995 0 C-N-CA 125.413 1.485 . . . . 0.0 112.488 177.121 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -147.11 29.87 0.96 Allowed 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 124.027 0.931 . . . . 0.0 112.996 -175.113 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -106.19 11.57 31.1 Favored 'General case' 0 N--CA 1.476 0.841 0 O-C-N 120.899 -1.126 . . . . 0.0 113.553 -179.321 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 15.5 tt -150.13 36.78 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.477 0.876 0 C-N-CA 126.509 1.924 . . . . 0.0 111.799 -175.343 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 2.9 tppt? . . . . . 0 N--CA 1.478 0.935 0 N-CA-C 115.309 1.596 . . . . 0.0 115.309 -176.175 . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 6.9 mt . . . . . 0 CA--C 1.543 0.699 0 CA-C-O 120.303 0.097 . . . . 0.0 110.796 . . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 63.4 m -75.88 165.09 25.51 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 123.302 0.641 . . . . 0.0 110.528 171.628 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -55.15 -44.46 75.15 Favored 'General case' 0 N--CA 1.48 1.042 0 O-C-N 120.72 -1.237 . . . . 0.0 113.472 -173.526 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 8.9 pt20 -75.35 -36.64 60.95 Favored 'General case' 0 N--CA 1.469 0.51 0 O-C-N 121.601 -0.687 . . . . 0.0 112.486 175.306 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 76.4 mt-30 -65.75 -36.92 84.94 Favored 'General case' 0 N--CA 1.466 0.341 0 O-C-N 121.508 -0.745 . . . . 0.0 111.595 178.9 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 40.3 ttmt -61.59 -42.17 98.49 Favored 'General case' 0 N--CA 1.465 0.307 0 C-N-CA 124.405 1.082 . . . . 0.0 111.008 174.99 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 46.2 mt -69.03 -43.14 82.15 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 CA-C-O 118.449 -0.786 . . . . 0.0 111.045 176.732 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 44.0 mt -63.01 -44.25 99.54 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 CA-C-N 120.167 1.349 . . . . 0.0 110.343 178.73 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -59.53 -49.07 79.22 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.9 1.28 . . . . 0.0 110.794 176.586 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -67.42 -51.46 51.44 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 124.364 1.065 . . . . 0.0 112.799 -179.369 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 18.9 mm-40 -61.9 -24.12 66.75 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 118.968 0.804 . . . . 0.0 113.162 -178.385 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -70.29 -60.17 2.44 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 123.891 0.876 . . . . 0.0 110.841 174.031 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 64.7 mt -59.72 -35.15 58.24 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 C-N-CA 127.003 2.121 . . . . 0.0 111.762 177.846 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -70.86 -22.57 62.28 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 123.969 0.908 . . . . 0.0 113.116 178.143 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -94.9 -32.19 13.33 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.472 1.109 . . . . 0.0 112.731 178.013 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 4.5 m -118.57 -20.61 5.05 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.916 0 CA-C-N 119.552 1.069 . . . . 0.0 113.731 -173.461 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 83.2 141.98 4.54 Favored Glycine 0 CA--C 1.531 1.061 0 C-N-CA 124.787 1.184 . . . . 0.0 112.33 -171.312 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -66.83 -9.96 42.92 Favored 'General case' 0 N--CA 1.479 0.994 0 CA-C-O 122.721 1.248 . . . . 0.0 113.93 -171.485 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 5.6 pt20 -84.96 -11.74 54.85 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 126.268 1.827 . . . . 0.0 113.854 174.753 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 73.4 m-80 -114.35 -9.4 12.79 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 114.585 1.328 . . . . 0.0 114.585 -177.877 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 21.8 pt -71.43 159.98 5.46 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 C-N-CA 123.574 0.749 . . . . 0.0 111.608 168.684 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.1 p -129.22 144.37 51.19 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 125.149 1.379 . . . . 0.0 110.014 173.805 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -63.9 -26.14 68.46 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.933 0.893 . . . . 0.0 112.169 175.875 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -63.49 -49.26 83.37 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.459 0 C-N-CA 125.291 1.436 . . . . 0.0 109.48 173.099 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 99.2 m -75.14 -43.02 54.89 Favored 'General case' 0 C--O 1.223 -0.309 0 C-N-CA 123.538 0.735 . . . . 0.0 110.156 -178.248 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 17.3 tp -62.22 -35.13 77.95 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.469 1.108 . . . . 0.0 112.093 176.23 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 47.2 t -53.79 -32.5 52.79 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.367 1.067 . . . . 0.0 113.015 168.349 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -100.74 -23.55 14.59 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 125.621 1.568 . . . . 0.0 114.008 -174.137 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 67.1 mmtt -66.05 -37.58 86.19 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 124.858 1.263 . . . . 0.0 111.343 173.977 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.3 mp -114.21 1.38 14.51 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 125.092 1.357 . . . . 0.0 114.256 -172.819 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 12.7 m-80 57.21 46.36 18.89 Favored 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 125.712 1.605 . . . . 0.0 112.868 -175.155 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 7.0 pt -106.39 -166.42 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 C-N-CA 125.974 1.709 . . . . 0.0 111.537 -178.992 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -94.5 159.41 15.11 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 123.9 0.88 . . . . 0.0 110.491 167.644 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 93.8 t -60.39 -30.1 45.66 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 O-C-N 121.563 -0.711 . . . . 0.0 111.241 172.22 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -82.68 -32.52 28.06 Favored 'General case' 0 N--CA 1.465 0.287 0 O-C-N 121.049 -1.032 . . . . 0.0 110.567 -178.194 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 15.2 tttt -70.19 -41.59 73.52 Favored 'General case' 0 C--N 1.343 0.326 0 C-N-CA 123.313 0.645 . . . . 0.0 110.855 174.502 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -60.78 -47.33 86.8 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 125.56 1.544 . . . . 0.0 112.355 171.531 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 36.7 ttmt -72.78 -28.04 62.36 Favored 'General case' 0 CA--C 1.517 -0.296 0 CA-C-O 118.004 -0.998 . . . . 0.0 111.298 -173.519 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -49.72 -47.24 50.69 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 118.833 0.742 . . . . 0.0 110.408 174.272 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 18.9 m-85 -63.56 -43.19 97.75 Favored 'General case' 0 C--O 1.223 -0.326 0 C-N-CA 123.491 0.716 . . . . 0.0 110.43 -175.593 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 48.4 mt -67.92 -28.39 41.15 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.675 0 C-N-CA 125.435 1.494 . . . . 0.0 111.637 -178.773 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 28.4 mmmt -80.46 -23.41 40.23 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 125.423 1.489 . . . . 0.0 112.369 174.941 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 90.2 m-20 . . . . . 0 C--O 1.234 0.244 0 C-N-CA 126.326 1.85 . . . . 0.0 111.609 -173.502 . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 . . . . . 0 CA--C 1.542 0.671 0 N-CA-C 110.018 -0.364 . . . . 0.0 110.018 . . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -133.6 122.41 23.48 Favored 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 124.694 1.197 . . . . 0.0 110.721 -176.336 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 60.6 t -134.21 108.7 11.52 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.469 0 C-N-CA 125.375 1.47 . . . . 0.0 109.712 178.749 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 32.2 t -162.99 -79.32 0.04 OUTLIER 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 123.757 0.823 . . . . 0.0 112.126 169.014 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 42.9 m -95.3 -27.54 15.43 Favored 'General case' 0 N--CA 1.478 0.948 0 N-CA-C 114.079 1.14 . . . . 0.0 114.079 -172.588 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 65.6 mtt -137.57 110.41 7.65 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 125.419 1.488 . . . . 0.0 109.658 -179.69 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -144.52 85.98 1.8 Allowed 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 124.768 1.227 . . . . 0.0 109.145 -179.693 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -153.29 161.71 42.08 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 124.884 1.273 . . . . 0.0 112.566 -178.437 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 52.3 mmtt . . . . . 0 N--CA 1.481 1.086 0 C-N-CA 125.75 1.62 . . . . 0.0 111.88 174.24 . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 33.9 ttm . . . . . 0 CA--C 1.547 0.859 0 CA-C-O 121.349 0.595 . . . . 0.0 112.518 . . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 15.6 m-20 -126.96 156.23 74.47 Favored Pre-proline 0 CA--C 1.548 0.872 0 C-N-CA 125.691 1.597 . . . . 0.0 111.945 -177.001 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 91.7 Cg_endo -74.29 -0.25 9.4 Favored 'Trans proline' 0 CA--C 1.538 0.688 0 C-N-CA 123.468 2.778 . . . . 0.0 114.601 179.969 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 95.0 mt -117.28 36.69 4.14 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 125.878 1.671 . . . . 0.0 112.998 -175.296 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 27.9 m-20 -103.84 2.62 32.92 Favored 'General case' 0 N--CA 1.477 0.898 0 N-CA-C 114.301 1.223 . . . . 0.0 114.301 173.36 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -119.92 -57.17 1.97 Allowed 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 124.398 1.079 . . . . 0.0 113.525 -164.502 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.1 pp -131.36 16.39 1.87 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.94 0 C-N-CA 126.144 1.778 . . . . 0.0 112.869 -172.534 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 15.5 tt -42.03 -39.08 0.76 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.284 0 C-N-CA 126.156 1.782 . . . . 0.0 115.772 -177.164 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 15.9 m120 -121.54 108.38 13.54 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 125.514 1.526 . . . . 0.0 110.497 177.594 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 29.2 t0 -165.38 62.91 0.12 Allowed 'General case' 0 CA--C 1.533 0.29 0 CA-C-O 122.352 1.072 . . . . 0.0 110.655 -168.582 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 29.5 mt 50.08 59.36 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.742 0 C-N-CA 125.931 1.693 . . . . 0.0 110.626 -169.097 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.474 0.747 0 CA-C-N 114.62 -1.173 . . . . 0.0 112.064 -179.814 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 5.2 mt . . . . . 0 CA--C 1.544 0.717 0 CA-C-O 120.587 0.232 . . . . 0.0 111.104 . . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 18.3 t -73.57 165.89 24.25 Favored 'General case' 0 N--CA 1.479 0.99 0 O-C-N 121.965 -0.459 . . . . 0.0 110.396 167.54 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -59.57 -43.18 93.68 Favored 'General case' 0 CA--C 1.542 0.656 0 O-C-N 120.461 -1.399 . . . . 0.0 112.824 -173.724 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 10.2 tt0 -73.47 -41.88 62.6 Favored 'General case' 0 N--CA 1.469 0.524 0 O-C-N 121.299 -0.875 . . . . 0.0 111.43 175.743 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 30.4 mm-40 -57.06 -43.42 82.02 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 123.894 0.877 . . . . 0.0 111.032 176.637 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 40.8 ttmt -60.14 -42.31 94.57 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 124.981 1.313 . . . . 0.0 111.651 176.733 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 47.1 mt -68.88 -40.87 81.73 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 CA-C-O 118.413 -0.803 . . . . 0.0 111.053 177.535 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 43.6 mt -63.91 -44.22 97.95 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.933 0 CA-C-N 120.307 1.412 . . . . 0.0 110.385 177.705 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -59.22 -50.07 75.44 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.681 1.193 . . . . 0.0 110.396 176.105 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -65.68 -50.68 64.04 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.346 1.058 . . . . 0.0 112.93 -179.576 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.8 mm-40 -60.89 -24.38 65.92 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 118.997 0.817 . . . . 0.0 113.13 -179.145 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -73.23 -58.17 3.5 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 123.714 0.806 . . . . 0.0 111.31 175.865 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 15.3 mt -59.91 -33.79 53.91 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.583 0 C-N-CA 125.903 1.681 . . . . 0.0 111.629 175.815 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -69.78 -22.4 63.34 Favored 'General case' 0 CA--C 1.545 0.771 0 O-C-N 121.267 -0.895 . . . . 0.0 113.293 175.372 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -93.76 -32.96 13.78 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 124.526 1.13 . . . . 0.0 112.732 178.539 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 10.5 m -120.15 -19.68 5.04 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.911 0 N-CA-C 114.005 1.113 . . . . 0.0 114.005 -174.094 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 83.58 142.56 5.02 Favored Glycine 0 CA--C 1.531 1.052 0 C-N-CA 124.802 1.192 . . . . 0.0 112.145 -171.486 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 2.2 tt -65.48 -11.19 40.94 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 114.928 1.455 . . . . 0.0 114.928 -170.219 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 38.8 mt-30 -80.18 -20.69 44.19 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.672 1.589 . . . . 0.0 112.921 174.813 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 69.5 m-80 -109.63 -7.07 15.16 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 114.4 1.259 . . . . 0.0 114.4 -171.793 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 16.5 pt -71.85 160.67 5.15 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 C-N-CA 123.676 0.791 . . . . 0.0 111.492 166.689 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.1 p -130.81 144.77 51.69 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 125.357 1.463 . . . . 0.0 109.991 173.923 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -62.98 -27.83 69.68 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 123.935 0.894 . . . . 0.0 112.239 176.679 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -62.83 -52.04 64.44 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.313 0 C-N-CA 125.41 1.484 . . . . 0.0 109.144 174.043 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 58.6 m -73.83 -42.89 60.22 Favored 'General case' 0 C--O 1.223 -0.303 0 C-N-CA 123.357 0.663 . . . . 0.0 110.442 -177.968 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 18.4 tp -59.79 -35.31 74.41 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.413 1.085 . . . . 0.0 111.996 174.819 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 47.7 t -55.39 -34.37 64.3 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 124.132 0.973 . . . . 0.0 113.124 170.156 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.1 -22.41 16.24 Favored 'General case' 0 CA--C 1.534 0.362 0 N-CA-C 114.533 1.308 . . . . 0.0 114.533 -177.448 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 68.0 mmtt -64.1 -38.44 91.06 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 119.508 1.049 . . . . 0.0 111.154 173.744 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.2 mp -112.34 -0.2 15.48 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 125.315 1.446 . . . . 0.0 114.363 -173.162 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 48.8 m-80 54.39 47.84 21.99 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 125.459 1.504 . . . . 0.0 112.84 -172.569 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 8.2 pt -104.35 -162.63 0.14 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.766 0 C-N-CA 126.456 1.902 . . . . 0.0 110.849 178.72 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -100.2 159.22 15.28 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 124.364 1.066 . . . . 0.0 110.4 167.701 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 67.7 t -60.96 -29.18 45.06 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.958 0 O-C-N 121.634 -0.666 . . . . 0.0 111.26 172.425 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 85.6 mt-10 -80.16 -34.11 37.88 Favored 'General case' 0 N--CA 1.466 0.357 0 O-C-N 120.953 -1.092 . . . . 0.0 110.092 -178.766 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 13.5 tttp -69.7 -44.38 70.52 Favored 'General case' 0 C--N 1.345 0.378 0 C-N-CA 124.287 1.035 . . . . 0.0 110.344 175.984 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -59.85 -46.75 88.3 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 125.843 1.657 . . . . 0.0 112.688 173.293 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 38.8 ttmt -75.28 -25.12 57.71 Favored 'General case' 0 CA--C 1.518 -0.28 0 C-N-CA 124.099 0.96 . . . . 0.0 111.799 -172.42 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -52.79 -50.11 64.24 Favored 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 118.138 0.426 . . . . 0.0 110.47 171.597 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 19.0 m-85 -62.15 -39.16 91.67 Favored 'General case' 0 C--N 1.34 0.183 0 C-N-CA 124.113 0.965 . . . . 0.0 111.319 -175.847 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 73.8 mt -68.04 -37.78 78.79 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.409 0 C-N-CA 123.956 0.902 . . . . 0.0 110.122 179.4 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 15.8 ttmt -73.0 -40.42 65.24 Favored 'General case' 0 C--N 1.344 0.333 0 C-N-CA 124.338 1.055 . . . . 0.0 112.533 -176.618 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 23.9 p30 . . . . . 0 CA--C 1.532 0.256 0 C-N-CA 123.324 0.65 . . . . 0.0 111.696 -178.035 . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 . . . . . 0 N--CA 1.471 0.605 0 CA-C-O 120.851 0.357 . . . . 0.0 111.384 . . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -145.47 111.04 5.39 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.792 1.237 . . . . 0.0 110.512 176.223 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 57.8 t -141.26 133.65 29.5 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 C-N-CA 125.333 1.453 . . . . 0.0 109.651 178.936 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 42.7 t -162.94 -71.43 0.05 OUTLIER 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 123.701 0.8 . . . . 0.0 112.498 175.322 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 60.8 p -85.85 -20.57 28.92 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 124.881 1.272 . . . . 0.0 113.956 -176.179 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 97.0 mtp -124.02 113.79 18.89 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 126.076 1.75 . . . . 0.0 109.199 176.035 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -142.62 74.21 1.44 Allowed 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.084 1.354 . . . . 0.0 109.757 -177.461 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -147.39 147.88 30.74 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 124.779 1.232 . . . . 0.0 112.144 -179.076 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 30.1 mtpp . . . . . 0 N--CA 1.478 0.969 0 C-N-CA 125.946 1.698 . . . . 0.0 110.751 177.47 . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 11.2 mmt . . . . . 0 N--CA 1.478 0.945 0 N-CA-C 114.203 1.186 . . . . 0.0 114.203 . . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 46.5 t0 -148.4 108.76 3.62 Favored Pre-proline 0 CA--C 1.549 0.939 0 O-C-N 121.065 -1.022 . . . . 0.0 112.312 -178.183 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 65.2 Cg_endo -83.8 -2.09 10.21 Favored 'Trans proline' 0 C--N 1.351 0.682 0 C-N-CA 123.828 3.019 . . . . 0.0 114.712 178.333 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 96.8 mt -120.8 39.35 3.8 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 126.212 1.805 . . . . 0.0 111.78 -175.576 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -106.13 -3.58 21.31 Favored 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 114.253 1.205 . . . . 0.0 114.253 176.533 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.09 -57.06 2.31 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 124.233 1.013 . . . . 0.0 113.112 -161.017 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.9 pp -129.05 12.22 2.67 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.794 0 C-N-CA 126.389 1.876 . . . . 0.0 112.863 -175.118 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 8.4 tt -42.34 105.73 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.082 0 C-N-CA 126.0 1.72 . . . . 0.0 113.46 -176.459 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 4.3 t30 -150.52 10.94 0.67 Allowed 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 114.878 1.436 . . . . 0.0 114.878 179.87 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -81.6 5.25 18.7 Favored 'General case' 0 CA--C 1.545 0.771 0 N-CA-C 115.147 1.536 . . . . 0.0 115.147 -168.53 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 13.5 tt -148.33 27.57 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 C-N-CA 125.616 1.566 . . . . 0.0 113.975 -172.717 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 52.7 mtmt . . . . . 0 N--CA 1.477 0.883 0 N-CA-C 113.981 1.104 . . . . 0.0 113.981 176.555 . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.1 mt . . . . . 0 CA--C 1.543 0.704 0 N-CA-C 109.26 -0.644 . . . . 0.0 109.26 . . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 70.0 m -71.48 164.64 25.43 Favored 'General case' 0 N--CA 1.481 1.077 0 O-C-N 121.788 -0.57 . . . . 0.0 110.5 169.559 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -55.89 -43.76 77.55 Favored 'General case' 0 N--CA 1.481 1.078 0 O-C-N 120.492 -1.38 . . . . 0.0 113.181 -174.949 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 11.6 tt0 -72.24 -41.42 66.82 Favored 'General case' 0 CA--C 1.536 0.442 0 O-C-N 121.549 -0.719 . . . . 0.0 111.537 175.47 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 86.8 mt-30 -62.4 -39.29 92.75 Favored 'General case' 0 N--CA 1.466 0.374 0 O-C-N 121.657 -0.652 . . . . 0.0 111.79 178.465 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 40.0 ttmt -60.81 -41.32 95.45 Favored 'General case' 0 N--CA 1.465 0.281 0 C-N-CA 123.987 0.915 . . . . 0.0 110.625 175.764 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 46.7 mt -67.86 -43.46 86.03 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 CA-C-O 118.332 -0.842 . . . . 0.0 111.266 176.673 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 45.5 mt -64.74 -44.78 96.48 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.956 0 CA-C-N 120.518 1.508 . . . . 0.0 110.481 179.314 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -58.63 -48.77 79.88 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.434 1.494 . . . . 0.0 110.87 176.154 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -64.0 -51.7 63.0 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 124.042 0.937 . . . . 0.0 112.333 176.939 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 13.9 mm-40 -59.75 -23.0 62.86 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 119.318 0.963 . . . . 0.0 113.394 -179.745 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -71.47 -64.15 0.98 Allowed 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 119.001 0.819 . . . . 0.0 110.824 172.905 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 27.4 mt -58.84 -34.61 52.81 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 C-N-CA 126.534 1.934 . . . . 0.0 112.019 178.862 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -71.71 -23.45 61.64 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.265 1.026 . . . . 0.0 112.996 177.721 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -91.44 -36.28 13.87 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 124.327 1.051 . . . . 0.0 112.624 176.109 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 19.4 m -112.66 -23.56 4.32 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.269 0 N-CA-C 115.326 1.602 . . . . 0.0 115.326 -174.385 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 83.86 139.16 3.89 Favored Glycine 0 CA--C 1.533 1.183 0 C-N-CA 124.916 1.246 . . . . 0.0 112.288 -167.845 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.2 tt -65.64 -7.94 17.78 Favored 'General case' 0 CA--C 1.551 0.992 0 N-CA-C 114.16 1.17 . . . . 0.0 114.16 -173.4 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 37.7 mt-30 -74.26 -19.3 60.55 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 126.411 1.884 . . . . 0.0 113.566 -178.548 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 13.5 p30 -130.7 2.34 4.47 Favored 'General case' 0 N--CA 1.476 0.868 0 N-CA-C 115.741 1.756 . . . . 0.0 115.741 -176.166 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 31.2 pt -63.01 156.98 4.33 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.655 0 CA-C-N 118.797 0.726 . . . . 0.0 111.707 164.826 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -130.63 144.79 51.67 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 125.139 1.376 . . . . 0.0 110.631 176.063 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -62.97 -26.39 68.81 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 124.005 0.922 . . . . 0.0 112.256 175.923 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -66.35 -41.07 88.27 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.502 0 C-N-CA 125.415 1.486 . . . . 0.0 110.562 174.222 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 98.7 m -80.84 -43.65 19.64 Favored 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 123.23 0.612 . . . . 0.0 109.738 -179.289 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.4 tt -66.06 -33.45 75.82 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 124.648 1.179 . . . . 0.0 112.333 178.158 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.416 ' HA ' HG13 ' A' ' 66' ' ' ILE . 60.4 p -60.91 -26.28 67.34 Favored 'General case' 0 N--CA 1.475 0.795 0 CA-C-N 119.232 0.924 . . . . 0.0 112.978 169.878 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -96.32 -31.27 12.97 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 125.026 1.33 . . . . 0.0 113.39 -178.497 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 8.3 mmtm -61.06 -36.53 79.85 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 125.255 1.422 . . . . 0.0 111.75 175.7 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.1 mt -118.22 9.31 12.53 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 125.678 1.591 . . . . 0.0 113.654 -171.1 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . 0.291 7.4 p30 47.31 60.32 3.53 Favored 'General case' 0 CA--C 1.551 0.996 0 C-N-CA 126.771 2.029 . . . . 0.0 114.132 -176.821 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.416 HG13 ' HA ' ' A' ' 61' ' ' SER . 0.6 OUTLIER -130.64 178.5 5.34 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 127.788 2.435 . . . . 0.0 111.359 -173.438 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.1 p -79.56 158.88 27.05 Favored 'General case' 0 N--CA 1.477 0.91 0 O-C-N 121.011 -1.056 . . . . 0.0 111.598 173.337 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 86.3 t -63.7 -29.94 48.59 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.029 0 O-C-N 121.628 -0.67 . . . . 0.0 111.36 172.468 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -76.68 -38.4 54.54 Favored 'General case' 0 N--CA 1.468 0.468 0 O-C-N 120.985 -1.072 . . . . 0.0 109.951 -178.344 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 5.6 tmtm? -65.06 -47.92 75.61 Favored 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 125.56 1.544 . . . . 0.0 110.771 176.359 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -60.62 -43.03 97.94 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 125.95 1.7 . . . . 0.0 113.479 174.062 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 34.8 ttmt -72.31 -27.09 62.22 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 124.633 1.173 . . . . 0.0 111.657 -179.352 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -56.91 -43.11 81.07 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-O 119.02 -0.515 . . . . 0.0 111.245 177.419 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 65.2 m-85 -60.9 -42.74 98.64 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 124.922 1.289 . . . . 0.0 111.571 175.243 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 62.5 mt -69.23 -21.05 24.85 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.765 0 C-N-CA 124.457 1.103 . . . . 0.0 111.168 -179.855 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 30.3 mmtm -92.96 -23.46 18.71 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 125.656 1.582 . . . . 0.0 113.394 178.547 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 10.3 p30 . . . . . 0 N--CA 1.468 0.466 0 N-CA-C 113.822 1.045 . . . . 0.0 113.822 177.986 . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 11.0 mp0 . . . . . 0 CA--C 1.549 0.939 0 CA-C-O 121.702 0.763 . . . . 0.0 112.427 . . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 24.5 tt0 -126.21 45.33 2.67 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 125.162 1.385 . . . . 0.0 112.325 -174.969 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 15.2 t -140.64 68.17 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 C-N-CA 124.978 1.311 . . . . 0.0 110.691 -179.911 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 36.0 t -161.49 -72.02 0.06 Allowed 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.375 0.67 . . . . 0.0 112.636 169.946 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 46.2 m -90.19 -22.67 21.57 Favored 'General case' 0 N--CA 1.478 0.972 0 N-CA-C 113.815 1.043 . . . . 0.0 113.815 -173.391 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 7.4 tpt -144.41 136.1 25.84 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 125.668 1.587 . . . . 0.0 109.358 174.823 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 13.6 tt0 -148.52 29.18 0.86 Allowed 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 124.191 0.996 . . . . 0.0 112.009 -172.904 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -123.59 151.18 43.23 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 125.326 1.45 . . . . 0.0 112.83 -171.678 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 52.2 mtmt . . . . . 0 N--CA 1.474 0.753 0 C-N-CA 125.474 1.509 . . . . 0.0 111.149 177.635 . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 79.7 mtp . . . . . 0 N--CA 1.48 1.026 0 N-CA-C 114.083 1.142 . . . . 0.0 114.083 . . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 10.9 t0 -88.2 123.69 68.06 Favored Pre-proline 0 CA--C 1.553 1.082 0 C-N-CA 124.422 1.089 . . . . 0.0 112.027 -175.49 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_endo -87.68 0.2 7.2 Favored 'Trans proline' 0 C--N 1.353 0.779 0 C-N-CA 123.607 2.871 . . . . 0.0 115.224 -178.136 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 74.8 mt -109.85 28.78 8.24 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 124.874 1.27 . . . . 0.0 113.94 -171.376 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -99.15 -5.52 29.94 Favored 'General case' 0 N--CA 1.478 0.93 0 N-CA-C 115.661 1.726 . . . . 0.0 115.661 176.889 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -130.47 -30.58 1.89 Allowed 'General case' 0 N--CA 1.481 1.109 0 N-CA-C 117.17 2.285 . . . . 0.0 117.17 -169.066 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.5 pp -135.4 17.82 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.334 0 C-N-CA 125.337 1.455 . . . . 0.0 113.601 -177.531 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 13.1 tt -51.22 135.16 11.87 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 C-N-CA 125.289 1.435 . . . . 0.0 112.876 -176.826 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -156.24 124.74 5.84 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.876 1.27 . . . . 0.0 110.097 -175.762 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 18.9 p-10 -163.23 62.82 0.18 Allowed 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 122.654 1.216 . . . . 0.0 110.793 -178.101 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 52.5 mt 53.31 59.01 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.75 0 C-N-CA 126.125 1.77 . . . . 0.0 110.378 -173.797 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 4.3 tmmm? . . . . . 0 N--CA 1.475 0.823 0 CA-C-N 114.807 -1.088 . . . . 0.0 113.67 -177.447 . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.3 mt . . . . . 0 CA--C 1.544 0.714 0 CA-C-O 120.53 0.205 . . . . 0.0 110.609 . . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 21.4 t -73.15 166.76 22.51 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 123.053 0.541 . . . . 0.0 110.509 166.95 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -57.52 -44.54 85.13 Favored 'General case' 0 N--CA 1.475 0.794 0 O-C-N 120.705 -1.247 . . . . 0.0 112.744 -175.131 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -74.58 -36.16 63.02 Favored 'General case' 0 N--CA 1.47 0.554 0 O-C-N 121.509 -0.744 . . . . 0.0 112.317 176.045 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 30.0 mm-40 -63.19 -41.47 99.19 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 123.669 0.788 . . . . 0.0 110.438 177.896 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 21.4 ttmm -60.02 -42.59 94.67 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 124.3 1.04 . . . . 0.0 111.159 176.18 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 46.5 mt -69.28 -42.6 81.44 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 CA-C-O 118.341 -0.838 . . . . 0.0 111.115 178.466 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 31.6 mt -63.67 -42.85 97.43 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 CA-C-N 120.586 1.539 . . . . 0.0 110.518 178.218 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -58.47 -47.69 83.23 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.629 1.172 . . . . 0.0 110.621 174.795 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -67.53 -50.42 58.82 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.569 1.147 . . . . 0.0 113.12 -179.597 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -60.46 -26.16 66.56 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-N 118.991 0.814 . . . . 0.0 113.188 -179.625 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 2.1 t80 -74.24 -54.37 7.86 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 123.606 0.762 . . . . 0.0 111.447 177.249 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 45.8 mt -58.81 -35.01 53.86 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 C-N-CA 125.053 1.341 . . . . 0.0 111.23 173.168 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -68.0 -21.07 65.06 Favored 'General case' 0 CA--C 1.547 0.835 0 N-CA-C 113.37 0.878 . . . . 0.0 113.37 175.655 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -95.34 -30.39 13.96 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.833 1.253 . . . . 0.0 113.165 178.406 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 7.7 m -124.54 -22.46 2.48 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 CA-C-N 119.695 1.134 . . . . 0.0 114.049 -173.659 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 89.12 143.96 10.14 Favored Glycine 0 CA--C 1.534 1.256 0 C-N-CA 125.56 1.552 . . . . 0.0 113.246 -172.96 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 58.2 tp -60.08 -17.96 43.49 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 125.707 1.603 . . . . 0.0 115.243 -172.218 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 1.2 pm0 -88.55 -13.4 40.21 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.13 1.372 . . . . 0.0 114.5 176.495 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 77.7 m-20 -110.83 -11.68 14.35 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 114.45 1.278 . . . . 0.0 114.45 -175.084 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 32.2 pt -64.38 156.46 5.46 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 C-N-CA 123.379 0.672 . . . . 0.0 111.205 166.101 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -126.81 144.05 51.08 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 124.752 1.221 . . . . 0.0 110.591 173.886 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -60.62 -26.73 67.23 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.723 0.809 . . . . 0.0 112.099 174.0 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 27.9 mm -63.9 -53.58 42.43 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.396 0 C-N-CA 124.831 1.252 . . . . 0.0 110.6 174.005 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 79.5 m -72.16 -41.52 67.0 Favored 'General case' 0 C--O 1.223 -0.338 0 C-N-CA 123.735 0.814 . . . . 0.0 109.895 -178.331 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 21.0 tp -62.86 -36.88 84.71 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.938 1.295 . . . . 0.0 111.868 177.052 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 43.5 t -54.04 -32.67 55.19 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 124.47 1.108 . . . . 0.0 113.143 168.724 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -100.44 -23.3 14.77 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 114.57 1.322 . . . . 0.0 114.57 -175.153 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 68.5 mmtt -65.76 -38.08 88.09 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 125.093 1.357 . . . . 0.0 111.262 172.861 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.4 mp -111.17 -0.61 16.46 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 125.342 1.457 . . . . 0.0 114.431 -173.535 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 42.7 m-80 55.21 49.51 17.12 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 125.535 1.534 . . . . 0.0 112.78 -173.513 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 6.2 pt -109.14 -163.4 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 C-N-CA 126.467 1.907 . . . . 0.0 111.022 -179.33 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.2 p -99.16 161.45 13.62 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.33 1.052 . . . . 0.0 110.538 168.435 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 92.3 t -61.05 -29.11 45.05 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 O-C-N 121.601 -0.687 . . . . 0.0 111.196 173.339 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -82.27 -34.31 28.77 Favored 'General case' 0 N--CA 1.472 0.65 0 O-C-N 120.615 -1.303 . . . . 0.0 110.868 179.489 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 4.1 tttp -80.36 -3.83 51.15 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 126.341 1.856 . . . . 0.0 113.379 178.644 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -102.88 -46.35 4.71 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 129.248 3.019 . . . . 0.0 112.84 167.69 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 36.9 ttmt -69.92 -28.77 65.86 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 124.843 1.257 . . . . 0.0 111.14 -175.307 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 42.5 p-10 -45.7 -55.05 6.92 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 123.239 0.616 . . . . 0.0 111.07 171.646 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 25.0 m-85 -55.14 -42.1 72.6 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 126.021 1.728 . . . . 0.0 112.47 -179.844 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 50.5 mt -70.25 -26.53 29.52 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.728 0 C-N-CA 125.745 1.618 . . . . 0.0 111.467 -178.866 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 30.8 mmmt -87.17 -36.31 18.1 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 125.994 1.718 . . . . 0.0 112.27 175.641 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 73.6 m-20 . . . . . 0 CA--C 1.532 0.268 0 C-N-CA 125.858 1.663 . . . . 0.0 108.692 -175.381 . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 . . . . . 0 N--CA 1.476 0.862 0 N-CA-C 112.451 0.538 . . . . 0.0 112.451 . . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -141.19 39.29 1.76 Allowed 'General case' 0 N--CA 1.479 0.982 0 N-CA-C 114.431 1.271 . . . . 0.0 114.431 -171.488 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 34.4 m -83.34 148.75 4.87 Favored 'Isoleucine or valine' 0 C--O 1.234 0.279 0 C-N-CA 124.71 1.204 . . . . 0.0 112.663 177.662 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 43.4 t -164.96 -73.36 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 124.477 1.111 . . . . 0.0 112.475 168.919 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 18.2 t -74.64 -31.2 61.89 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 123.863 0.865 . . . . 0.0 112.476 -177.98 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 62.5 mtt -128.3 151.4 49.36 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 125.914 1.685 . . . . 0.0 110.742 169.367 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 20.2 tt0 -141.4 19.65 2.22 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 125.393 1.477 . . . . 0.0 111.822 -176.451 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -119.95 105.52 11.14 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 125.257 1.423 . . . . 0.0 112.048 -170.776 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 96.8 mttt . . . . . 0 N--CA 1.482 1.135 0 C-N-CA 125.802 1.641 . . . . 0.0 113.584 174.581 . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 16.9 ttp . . . . . 0 N--CA 1.477 0.919 0 N-CA-C 113.112 0.782 . . . . 0.0 113.112 . . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 -120.42 130.7 24.72 Favored Pre-proline 0 CA--C 1.547 0.833 0 C-N-CA 124.834 1.254 . . . . 0.0 111.848 -171.931 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -80.07 -15.73 11.53 Favored 'Trans proline' 0 C--N 1.352 0.75 0 C-N-CA 123.084 2.522 . . . . 0.0 114.992 -175.454 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 96.9 mt -116.78 42.05 2.57 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 126.165 1.786 . . . . 0.0 111.806 -174.884 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -113.18 1.29 15.2 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 114.307 1.225 . . . . 0.0 114.307 179.241 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -119.22 -56.0 2.11 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 124.767 1.227 . . . . 0.0 113.063 -167.762 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.1 pp -129.72 14.38 2.44 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.875 0 C-N-CA 126.407 1.883 . . . . 0.0 112.892 -173.199 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 9.4 tt -44.73 124.05 0.83 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 C-N-CA 125.12 1.368 . . . . 0.0 112.254 178.074 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -147.1 12.61 1.09 Allowed 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 113.812 1.042 . . . . 0.0 113.812 -176.62 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -88.46 7.86 30.76 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 114.696 1.369 . . . . 0.0 114.696 -171.753 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 14.2 tt -148.71 30.61 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 C-N-CA 125.763 1.625 . . . . 0.0 113.318 -172.034 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 60.0 tttp . . . . . 0 N--CA 1.476 0.837 0 N-CA-C 114.28 1.215 . . . . 0.0 114.28 -179.437 . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.9 mt . . . . . 0 CA--C 1.545 0.761 0 N-CA-C 110.044 -0.354 . . . . 0.0 110.044 . . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 17.9 m -71.41 167.56 19.33 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 123.749 0.819 . . . . 0.0 110.733 169.293 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -56.25 -45.37 80.06 Favored 'General case' 0 N--CA 1.478 0.94 0 O-C-N 120.591 -1.318 . . . . 0.0 113.357 -174.799 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 10.4 tt0 -74.61 -42.1 59.23 Favored 'General case' 0 N--CA 1.471 0.593 0 O-C-N 121.416 -0.802 . . . . 0.0 111.46 177.004 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 29.2 mm-40 -55.3 -44.94 76.21 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.079 0.952 . . . . 0.0 110.812 176.577 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt -60.55 -42.03 95.76 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 125.058 1.343 . . . . 0.0 111.396 178.457 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 45.4 mt -69.29 -40.59 80.4 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 CA-C-O 118.117 -0.944 . . . . 0.0 111.245 177.912 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 38.2 mt -64.08 -43.05 97.42 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.848 0 CA-C-N 120.256 1.389 . . . . 0.0 110.205 177.301 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -60.24 -47.67 85.01 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.372 1.069 . . . . 0.0 110.931 177.159 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -67.51 -50.29 59.53 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 124.886 1.274 . . . . 0.0 112.328 179.722 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -64.2 -26.06 68.35 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 118.999 0.818 . . . . 0.0 112.783 -176.61 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.457 ' CD1' ' HE2' ' A' ' 63' ' ' LYS . 1.1 t80 -67.61 -58.43 4.69 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 123.913 0.885 . . . . 0.0 110.509 174.421 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.0 mt -62.61 -35.63 71.25 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 C-N-CA 126.539 1.935 . . . . 0.0 111.368 179.512 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -70.96 -26.64 63.25 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 123.881 0.873 . . . . 0.0 112.617 178.25 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -88.11 -38.84 15.05 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.267 1.027 . . . . 0.0 112.541 175.329 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.5 m -108.56 -6.99 10.96 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.147 0 N-CA-C 114.529 1.307 . . . . 0.0 114.529 -172.616 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 87.52 26.46 30.09 Favored Glycine 0 CA--C 1.531 1.056 0 C-N-CA 124.695 1.141 . . . . 0.0 115.476 161.865 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 57.15 10.21 0.8 Allowed 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 127.223 2.209 . . . . 0.0 115.09 -174.957 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 4.7 pt20 -123.27 -3.78 8.44 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 125.141 1.376 . . . . 0.0 113.713 -168.561 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 59.5 m-80 -123.47 0.52 8.85 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.953 1.301 . . . . 0.0 113.196 174.75 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 19.0 pt -74.9 152.33 6.66 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.57 0 CA-C-O 121.099 0.476 . . . . 0.0 111.223 175.125 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -140.04 143.84 36.58 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 124.668 1.187 . . . . 0.0 109.581 179.625 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -60.4 -28.24 68.08 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 123.417 0.687 . . . . 0.0 112.247 179.732 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -64.78 -48.81 82.95 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 C-N-CA 125.467 1.507 . . . . 0.0 110.157 175.222 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 78.2 m -80.71 -41.43 23.65 Favored 'General case' 0 C--O 1.223 -0.326 0 C-N-CA 124.103 0.961 . . . . 0.0 110.202 -174.722 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 20.0 tp -62.51 -35.6 79.9 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 125.214 1.406 . . . . 0.0 112.265 173.448 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.414 ' HA ' HG13 ' A' ' 66' ' ' ILE . 29.6 t -54.51 -33.47 59.96 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.706 1.203 . . . . 0.0 112.366 168.781 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -94.89 -31.85 13.5 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.755 1.222 . . . . 0.0 113.68 -176.322 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.457 ' HE2' ' CD1' ' A' ' 46' ' ' TYR . 1.0 OUTLIER -62.02 -32.75 73.27 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 125.42 1.488 . . . . 0.0 112.52 178.413 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.6 mp -118.6 8.34 11.95 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.751 1.221 . . . . 0.0 114.01 -177.97 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 44.9 m-80 53.37 56.22 7.66 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 126.243 1.817 . . . . 0.0 113.304 -178.659 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.414 HG13 ' HA ' ' A' ' 61' ' ' SER . 1.5 pt -122.08 -168.33 0.5 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.701 0 C-N-CA 127.132 2.173 . . . . 0.0 110.536 -173.738 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 2.4 p -93.48 160.2 14.9 Favored 'General case' 0 N--CA 1.476 0.835 0 O-C-N 121.264 -0.898 . . . . 0.0 111.04 170.641 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 86.9 t -61.73 -29.98 47.39 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 C-N-CA 123.086 0.554 . . . . 0.0 111.271 172.527 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -79.25 -37.73 37.23 Favored 'General case' 0 N--CA 1.468 0.429 0 O-C-N 120.854 -1.154 . . . . 0.0 110.283 -178.224 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 5.2 tmtm? -67.66 -45.31 75.65 Favored 'General case' 0 C--N 1.339 0.138 0 C-N-CA 124.56 1.144 . . . . 0.0 110.741 178.275 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -60.3 -45.86 91.9 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.713 1.605 . . . . 0.0 113.278 170.877 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 33.5 ttmt -69.46 -27.12 64.96 Favored 'General case' 0 N--CA 1.466 0.373 0 O-C-N 121.005 -1.059 . . . . 0.0 111.546 -177.251 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -55.67 -43.67 76.55 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-O 119.372 -0.347 . . . . 0.0 111.334 175.806 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 30.7 m-85 -62.16 -44.35 96.8 Favored 'General case' 0 C--O 1.224 -0.263 0 C-N-CA 125.269 1.428 . . . . 0.0 111.515 177.339 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 65.0 mt -64.59 -30.34 49.94 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.586 0 C-N-CA 123.947 0.899 . . . . 0.0 110.571 178.653 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -77.24 -38.01 52.03 Favored 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 125.0 1.32 . . . . 0.0 113.368 -178.704 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 8.3 p30 . . . . . 0 N--CA 1.466 0.36 0 CA-C-N 119.105 0.866 . . . . 0.0 111.587 178.841 . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 . . . . . 0 N--CA 1.474 0.739 0 CA-C-O 121.104 0.478 . . . . 0.0 111.858 . . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -83.11 88.09 6.9 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 124.226 1.01 . . . . 0.0 110.992 178.264 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 12.2 p -149.06 145.77 17.73 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 C-N-CA 124.909 1.284 . . . . 0.0 111.724 176.08 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 75.0 m -147.38 -54.19 0.22 Allowed 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 124.724 1.21 . . . . 0.0 112.814 -178.295 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 25.9 t -107.51 -46.52 3.82 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 124.521 1.128 . . . . 0.0 112.955 -175.424 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 94.8 mtp -88.86 51.49 2.18 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 125.021 1.328 . . . . 0.0 112.143 -176.162 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 21.7 tt0 -80.41 57.73 2.92 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 125.42 1.488 . . . . 0.0 112.126 -177.114 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -137.36 124.74 21.93 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.439 1.496 . . . . 0.0 111.196 -179.522 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 59.9 mtpt . . . . . 0 N--CA 1.482 1.159 0 C-N-CA 125.448 1.499 . . . . 0.0 112.587 -179.029 . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 12.1 tmm? . . . . . 0 CA--C 1.539 0.531 0 N-CA-C 109.956 -0.387 . . . . 0.0 109.956 . . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 77.4 m-20 39.72 58.66 6.8 Favored Pre-proline 0 CA--C 1.555 1.135 0 C-N-CA 127.346 2.258 . . . . 0.0 115.159 177.994 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 78.7 Cg_endo -70.02 -16.53 36.48 Favored 'Trans proline' 0 C--N 1.352 0.752 0 C-N-CA 123.29 2.66 . . . . 0.0 115.365 -170.801 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -113.93 13.1 18.25 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 126.148 1.779 . . . . 0.0 115.011 -176.974 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -74.94 -2.03 25.2 Favored 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 115.166 1.543 . . . . 0.0 115.166 -175.768 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -125.65 -61.86 1.23 Allowed 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 125.407 1.483 . . . . 0.0 112.951 -163.392 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.4 pp -104.16 -14.83 8.46 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 C-N-CA 124.681 1.193 . . . . 0.0 113.53 -177.105 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . 0.291 14.2 tt 34.44 48.95 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.27 0 C-N-CA 127.502 2.321 . . . . 0.0 116.234 170.04 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -95.94 37.33 1.23 Allowed 'General case' 0 CA--C 1.547 0.83 0 O-C-N 120.418 -1.426 . . . . 0.0 113.077 -170.902 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 -109.44 10.72 25.29 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 113.851 1.056 . . . . 0.0 113.851 -176.635 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 6.9 tp -150.14 31.34 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.48 1.047 0 C-N-CA 125.013 1.325 . . . . 0.0 113.61 -173.299 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 7.0 tmtm? . . . . . 0 N--CA 1.475 0.785 0 C-N-CA 123.717 0.807 . . . . 0.0 113.045 -176.827 . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.7 mt . . . . . 0 CA--C 1.545 0.759 0 N-CA-C 110.194 -0.298 . . . . 0.0 110.194 . . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 18.9 t -75.31 166.77 23.11 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 123.178 0.591 . . . . 0.0 110.503 169.727 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -55.83 -46.04 78.21 Favored 'General case' 0 N--CA 1.476 0.844 0 O-C-N 120.591 -1.318 . . . . 0.0 113.077 -173.017 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 11.8 tt0 -72.29 -42.22 65.77 Favored 'General case' 0 N--CA 1.47 0.566 0 O-C-N 121.53 -0.731 . . . . 0.0 111.268 176.796 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 14.8 mm100 -60.22 -42.25 94.78 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.797 0.839 . . . . 0.0 110.695 179.744 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 41.4 ttmt -60.73 -43.07 98.35 Favored 'General case' 0 N--CA 1.466 0.332 0 C-N-CA 125.194 1.398 . . . . 0.0 111.008 176.538 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 53.2 mt -67.25 -41.59 86.83 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 CA-C-O 118.179 -0.915 . . . . 0.0 111.155 177.185 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 44.1 mt -63.89 -45.38 97.14 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.928 0 CA-C-N 120.593 1.542 . . . . 0.0 110.166 178.097 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -58.18 -49.6 76.46 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.709 1.204 . . . . 0.0 110.87 176.953 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -65.59 -52.18 54.08 Favored 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 125.028 1.331 . . . . 0.0 112.677 179.515 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 -61.43 -29.21 69.8 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-N 119.169 0.895 . . . . 0.0 112.798 -179.294 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -66.83 -56.42 10.45 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 118.685 0.675 . . . . 0.0 110.849 175.342 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 81.1 mt -65.03 -32.01 56.44 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 C-N-CA 126.886 2.074 . . . . 0.0 111.763 178.856 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -73.0 -28.06 62.15 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 123.9 0.88 . . . . 0.0 112.436 176.149 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -85.29 -39.92 17.16 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.01 0.924 . . . . 0.0 112.165 176.054 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.1 m -109.94 -3.62 10.56 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.199 0 N-CA-C 114.152 1.167 . . . . 0.0 114.152 -173.761 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 86.43 19.87 55.86 Favored Glycine 0 N--CA 1.474 1.172 0 C-N-CA 125.539 1.542 . . . . 0.0 115.525 160.538 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 57.13 5.53 0.26 Allowed 'General case' 0 CA--C 1.555 1.164 0 C-N-CA 127.057 2.143 . . . . 0.0 114.706 -166.778 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 15.9 mt-30 -98.81 -14.31 19.74 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 125.901 1.681 . . . . 0.0 112.751 -173.481 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 39.2 m-80 -131.22 6.23 4.51 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 113.937 1.088 . . . . 0.0 113.937 -171.962 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 20.1 pt -77.23 154.38 5.49 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 CA-C-N 118.691 0.678 . . . . 0.0 111.81 176.123 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -133.15 144.01 49.61 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 124.374 1.069 . . . . 0.0 110.306 175.959 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -60.58 -29.17 69.01 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.959 0.904 . . . . 0.0 111.756 177.995 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.9 mp -63.43 -57.18 12.97 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.218 0 C-N-CA 124.81 1.244 . . . . 0.0 108.903 173.93 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 52.9 m -68.42 -45.67 71.98 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 123.696 0.799 . . . . 0.0 109.764 -175.138 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 19.0 tp -57.87 -35.77 71.42 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.915 1.286 . . . . 0.0 112.175 174.324 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.405 ' HA ' HG13 ' A' ' 66' ' ' ILE . 19.4 p -63.91 -20.67 66.02 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 113.883 1.068 . . . . 0.0 113.883 172.551 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 13.6 mptt -103.82 -31.4 9.82 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 125.224 1.409 . . . . 0.0 113.351 -178.287 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 7.2 mtpp -65.87 -28.98 69.36 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 120.035 1.289 . . . . 0.0 112.105 176.836 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.9 mp -115.55 4.48 14.2 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.402 1.481 . . . . 0.0 114.381 -178.653 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 31.9 m-80 56.19 59.57 3.63 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 125.998 1.719 . . . . 0.0 113.651 179.611 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.405 HG13 ' HA ' ' A' ' 61' ' ' SER . 0.9 OUTLIER -135.41 176.63 8.11 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 C-N-CA 126.607 1.963 . . . . 0.0 111.492 -169.853 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.4 p -77.09 158.73 30.3 Favored 'General case' 0 N--CA 1.479 0.985 0 O-C-N 120.947 -1.095 . . . . 0.0 111.317 172.006 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 98.8 t -64.33 -28.5 45.03 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.984 0 O-C-N 121.684 -0.635 . . . . 0.0 111.349 173.644 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -77.86 -38.13 46.72 Favored 'General case' 0 N--CA 1.469 0.475 0 O-C-N 121.183 -0.948 . . . . 0.0 110.055 179.449 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 5.5 tmtm? -67.25 -43.24 82.4 Favored 'General case' 0 N--CA 1.462 0.175 0 C-N-CA 125.138 1.375 . . . . 0.0 111.346 177.244 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -60.7 -50.0 75.25 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.861 1.264 . . . . 0.0 112.92 170.277 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 33.8 ttmt -68.44 -24.79 64.77 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 124.615 1.166 . . . . 0.0 111.846 -176.525 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -53.64 -40.05 65.49 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 123.679 0.792 . . . . 0.0 111.444 171.899 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -70.79 -42.41 70.37 Favored 'General case' 0 C--O 1.224 -0.24 0 C-N-CA 124.152 0.981 . . . . 0.0 111.633 176.593 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 42.9 mt -65.45 -30.82 51.36 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 C-N-CA 124.711 1.204 . . . . 0.0 111.414 -179.289 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 12.4 tppt? -89.47 -22.8 22.3 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.808 1.643 . . . . 0.0 113.002 179.924 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 56.6 m-20 . . . . . 0 N--CA 1.466 0.347 0 C-N-CA 124.942 1.297 . . . . 0.0 110.409 172.961 . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 . . . . . 0 N--CA 1.474 0.758 0 CA-C-O 120.66 0.267 . . . . 0.0 111.108 . . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -99.99 97.71 8.54 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 124.49 1.116 . . . . 0.0 110.159 175.696 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 25.8 t -129.18 -67.48 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 C-N-CA 124.56 1.144 . . . . 0.0 112.589 -172.311 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 31.2 p 51.43 11.41 0.12 Allowed 'General case' 0 CA--C 1.547 0.851 0 N-CA-C 118.89 2.922 . . . . 0.0 118.89 177.31 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 27.6 t -123.79 -44.27 2.09 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 125.349 1.46 . . . . 0.0 113.318 -178.161 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 3.0 tmm? -137.36 60.05 1.66 Allowed 'General case' 0 N--CA 1.474 0.775 0 CA-C-O 123.388 1.566 . . . . 0.0 110.148 178.552 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 22.1 tt0 -82.5 53.78 2.43 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 126.022 1.729 . . . . 0.0 112.63 -170.716 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -75.5 94.01 3.07 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 124.846 1.258 . . . . 0.0 111.769 -178.741 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 20.0 mmmt . . . . . 0 N--CA 1.477 0.907 0 C-N-CA 126.494 1.918 . . . . 0.0 109.439 -177.746 . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 17.7 ttt . . . . . 0 CA--C 1.547 0.854 0 CA-C-O 121.444 0.64 . . . . 0.0 111.617 . . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 -119.65 94.11 48.15 Favored Pre-proline 0 CA--C 1.545 0.778 0 C-N-CA 125.102 1.361 . . . . 0.0 111.481 -172.224 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -78.83 -13.77 14.23 Favored 'Trans proline' 0 C--N 1.351 0.658 0 C-N-CA 122.977 2.451 . . . . 0.0 114.9 -178.949 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 96.8 mt -101.71 46.07 0.95 Allowed 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 126.015 1.726 . . . . 0.0 113.189 -170.709 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -109.79 -2.66 17.19 Favored 'General case' 0 N--CA 1.479 0.975 0 N-CA-C 114.885 1.439 . . . . 0.0 114.885 171.693 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -128.63 -55.76 1.22 Allowed 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 124.303 1.041 . . . . 0.0 113.18 -166.384 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.8 pp -108.4 9.12 9.21 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 C-N-CA 125.593 1.557 . . . . 0.0 112.882 -178.201 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 10.0 tt -54.09 117.62 0.99 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.825 0 C-N-CA 123.781 0.833 . . . . 0.0 111.769 178.301 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -150.35 15.48 0.8 Allowed 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 124.131 0.972 . . . . 0.0 113.621 -178.167 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -85.2 5.2 31.12 Favored 'General case' 0 CA--C 1.545 0.763 0 N-CA-C 114.931 1.456 . . . . 0.0 114.931 -169.183 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 13.6 tt -146.77 24.4 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.805 0 C-N-CA 125.396 1.478 . . . . 0.0 114.262 -170.217 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 35.4 ttpt . . . . . 0 N--CA 1.475 0.789 0 N-CA-C 114.546 1.313 . . . . 0.0 114.546 177.98 . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 36.6 mt . . . . . 0 CA--C 1.541 0.621 0 CA-C-O 120.531 0.205 . . . . 0.0 110.885 . . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 71.2 m -71.66 165.15 24.56 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 122.976 0.51 . . . . 0.0 110.412 169.741 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -53.79 -44.9 70.49 Favored 'General case' 0 N--CA 1.478 0.952 0 O-C-N 120.952 -1.092 . . . . 0.0 112.877 -176.19 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 6.9 pt20 -72.41 -36.0 68.53 Favored 'General case' 0 N--CA 1.47 0.539 0 O-C-N 121.733 -0.605 . . . . 0.0 112.211 176.683 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 86.7 mt-30 -67.87 -40.21 83.61 Favored 'General case' 0 CA--C 1.534 0.348 0 O-C-N 121.662 -0.648 . . . . 0.0 111.271 179.373 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 17.6 ttmm -59.65 -40.87 89.16 Favored 'General case' 0 N--CA 1.471 0.595 0 O-C-N 121.469 -0.769 . . . . 0.0 110.687 174.359 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 51.5 mt -69.73 -41.54 79.99 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 CA-C-O 117.865 -1.065 . . . . 0.0 111.638 176.969 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 35.9 mt -64.0 -43.08 97.53 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.943 0 CA-C-N 121.144 1.793 . . . . 0.0 110.04 177.598 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -58.12 -49.62 76.35 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.605 1.162 . . . . 0.0 110.688 177.381 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -62.77 -52.93 61.28 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 124.776 1.23 . . . . 0.0 112.834 175.78 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -59.06 -30.99 68.47 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-N 119.154 0.888 . . . . 0.0 112.729 -179.838 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -67.73 -57.31 6.56 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 123.35 0.66 . . . . 0.0 110.644 176.871 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 89.0 mt -64.15 -33.63 63.65 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 C-N-CA 126.212 1.805 . . . . 0.0 111.352 179.686 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -71.42 -27.24 63.16 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.016 0.926 . . . . 0.0 112.544 177.097 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -88.19 -37.61 15.98 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.085 0.954 . . . . 0.0 112.533 176.151 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.5 m -109.9 -4.79 10.9 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.223 0 N-CA-C 114.488 1.292 . . . . 0.0 114.488 -174.087 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 83.13 25.8 47.03 Favored Glycine 0 N--CA 1.471 1.004 0 C-N-CA 125.028 1.299 . . . . 0.0 115.049 162.203 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 57.6 6.65 0.45 Allowed 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 127.511 2.325 . . . . 0.0 115.175 -172.061 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 27.2 mt-30 -102.17 -15.34 16.71 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 125.55 1.54 . . . . 0.0 113.181 -172.637 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 42.4 m-80 -126.49 5.68 6.89 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.167 0.987 . . . . 0.0 113.569 -172.543 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 15.1 pt -79.35 152.45 4.8 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.555 0 O-C-N 121.903 -0.498 . . . . 0.0 111.309 173.978 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -139.52 144.99 38.15 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 124.55 1.14 . . . . 0.0 109.592 178.915 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -61.94 -23.16 66.19 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 119.193 0.906 . . . . 0.0 112.59 -179.255 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 2.0 mp -70.29 -55.01 16.04 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.232 0 C-N-CA 125.336 1.454 . . . . 0.0 109.091 172.662 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 91.2 m -68.92 -43.32 75.41 Favored 'General case' 0 N--CA 1.464 0.274 0 O-C-N 121.535 -0.728 . . . . 0.0 110.385 -176.895 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 13.7 tp -60.8 -34.87 75.17 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 125.665 1.586 . . . . 0.0 112.241 173.43 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.44 ' HA ' HG13 ' A' ' 66' ' ' ILE . 4.4 t -57.11 -28.82 62.99 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 124.092 0.957 . . . . 0.0 112.685 169.806 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 8.7 mptt -105.56 -23.24 12.82 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.853 1.261 . . . . 0.0 113.789 -174.949 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 58.6 mmtt -66.46 -33.69 76.26 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 124.533 1.133 . . . . 0.0 111.458 175.316 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.0 mp -119.07 5.82 11.31 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 124.831 1.252 . . . . 0.0 114.364 -175.85 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 19.1 m-80 57.84 58.12 3.82 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 126.262 1.825 . . . . 0.0 113.221 -178.733 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.44 HG13 ' HA ' ' A' ' 61' ' ' SER . 3.4 pt -134.89 168.26 23.97 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 C-N-CA 126.072 1.749 . . . . 0.0 112.49 -170.082 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 30.5 p -69.57 151.72 45.63 Favored 'General case' 0 N--CA 1.47 0.525 0 O-C-N 121.382 -0.824 . . . . 0.0 111.405 174.918 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 91.7 t -61.09 -27.06 40.92 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.861 0 C-N-CA 123.095 0.558 . . . . 0.0 111.054 171.211 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -75.6 -41.92 53.24 Favored 'General case' 0 C--O 1.235 0.323 0 O-C-N 120.96 -1.088 . . . . 0.0 110.155 -176.839 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.25 -32.01 49.47 Favored 'General case' 0 C--N 1.346 0.416 0 CA-C-N 118.311 0.505 . . . . 0.0 111.627 179.626 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -63.86 -46.75 83.59 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.797 1.239 . . . . 0.0 112.194 171.502 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 39.4 ttmt -67.94 -29.46 68.53 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 124.3 1.04 . . . . 0.0 111.334 -178.861 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -55.35 -38.94 69.44 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 122.806 0.442 . . . . 0.0 112.071 176.393 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 35.2 m-85 -65.52 -45.57 82.98 Favored 'General case' 0 C--O 1.224 -0.264 0 C-N-CA 124.699 1.2 . . . . 0.0 111.398 175.664 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 61.6 mt -65.18 -30.59 50.75 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.592 0 C-N-CA 124.115 0.966 . . . . 0.0 110.79 -178.611 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt -79.2 -36.82 39.6 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 124.713 1.205 . . . . 0.0 113.144 179.018 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 6.3 p30 . . . . . 0 C--N 1.345 0.387 0 CA-C-N 120.019 1.282 . . . . 0.0 111.737 179.682 . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 . . . . . 0 CA--C 1.544 0.726 0 CA-C-O 121.038 0.447 . . . . 0.0 111.225 . . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -149.4 71.37 1.11 Allowed 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 124.658 1.183 . . . . 0.0 110.912 -179.784 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 28.0 t -139.7 80.69 0.35 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 124.836 1.254 . . . . 0.0 110.1 177.519 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 47.5 t -163.23 -76.86 0.04 OUTLIER 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 123.935 0.894 . . . . 0.0 112.329 169.375 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 55.5 p -88.74 -29.14 20.04 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 125.028 1.331 . . . . 0.0 113.321 -176.744 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 43.9 mtt -126.61 142.41 51.55 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 126.465 1.906 . . . . 0.0 109.752 167.809 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -157.86 90.78 1.09 Allowed 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.839 1.655 . . . . 0.0 107.823 172.829 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -146.33 157.78 43.82 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 124.3 1.04 . . . . 0.0 113.273 -171.858 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 96.7 mttt . . . . . 0 N--CA 1.475 0.811 0 C-N-CA 125.907 1.683 . . . . 0.0 111.776 -174.894 . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.2 ttt . . . . . 0 N--CA 1.479 0.975 0 N-CA-C 113.388 0.884 . . . . 0.0 113.388 . . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 8.6 t0 -101.85 123.01 45.37 Favored Pre-proline 0 CA--C 1.551 1.012 0 C-N-CA 124.471 1.109 . . . . 0.0 112.156 -176.614 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 69.1 Cg_endo -82.67 -3.42 11.27 Favored 'Trans proline' 0 C--N 1.352 0.725 0 C-N-CA 123.501 2.8 . . . . 0.0 115.147 179.437 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 81.8 mt -108.24 43.58 1.21 Allowed 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.799 1.64 . . . . 0.0 112.314 -175.793 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -104.81 0.5 28.17 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 115.013 1.486 . . . . 0.0 115.013 178.633 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -120.52 -57.72 1.89 Allowed 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 124.408 1.083 . . . . 0.0 113.489 -166.751 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.1 pp -129.71 15.87 2.44 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 C-N-CA 126.249 1.819 . . . . 0.0 112.76 -172.188 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 16.9 tt -38.88 120.66 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 C-N-CA 125.825 1.65 . . . . 0.0 113.369 178.027 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 1.9 m120 -165.01 108.1 0.85 Allowed 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.584 1.154 . . . . 0.0 109.685 179.372 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 23.3 t0 -166.44 81.91 0.26 Allowed 'General case' 0 N--CA 1.466 0.353 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 -178.82 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 46.1 mm 53.0 63.21 0.21 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.831 0 CA-C-O 123.169 1.461 . . . . 0.0 111.096 -170.463 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 1.3 mmmt . . . . . 0 N--CA 1.48 1.069 0 C-N-CA 124.781 1.233 . . . . 0.0 113.968 179.595 . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 86.9 mt . . . . . 0 CA--C 1.544 0.733 0 CA-C-O 120.595 0.236 . . . . 0.0 111.294 . . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 26.8 m -72.04 169.51 15.84 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 124.32 1.048 . . . . 0.0 110.871 169.889 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -57.33 -43.54 83.44 Favored 'General case' 0 CA--C 1.545 0.773 0 O-C-N 120.427 -1.421 . . . . 0.0 113.324 -173.46 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 12.6 tt0 -74.69 -43.3 55.87 Favored 'General case' 0 N--CA 1.472 0.661 0 O-C-N 121.129 -0.982 . . . . 0.0 111.696 176.856 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 11.7 mm-40 -53.46 -45.32 69.48 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.0 1.32 . . . . 0.0 111.449 174.521 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 41.0 ttmt -60.45 -38.12 83.12 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 125.31 1.444 . . . . 0.0 111.761 176.889 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 49.9 mt -76.16 -35.81 29.17 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 CA-C-O 118.075 -0.964 . . . . 0.0 111.93 178.565 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 48.8 mt -60.51 -40.97 86.01 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.035 0 CA-C-N 120.766 1.621 . . . . 0.0 109.825 172.752 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -59.45 -52.4 65.75 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.177 0.991 . . . . 0.0 110.649 175.0 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -65.36 -49.27 70.0 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 124.419 1.088 . . . . 0.0 113.42 -177.662 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 18.8 mm-40 -62.46 -25.05 67.78 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 123.941 0.896 . . . . 0.0 113.065 -179.297 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -71.87 -54.82 8.88 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 123.367 0.667 . . . . 0.0 110.999 175.883 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 52.7 mt -59.35 -36.17 62.4 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 C-N-CA 125.134 1.374 . . . . 0.0 111.262 174.202 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -67.84 -20.86 65.2 Favored 'General case' 0 CA--C 1.546 0.791 0 N-CA-C 113.266 0.839 . . . . 0.0 113.266 176.771 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -96.41 -29.72 13.78 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.882 1.273 . . . . 0.0 113.228 178.358 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 5.3 m -123.19 -22.79 2.77 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.993 0 CA-C-N 119.791 1.178 . . . . 0.0 114.068 -173.815 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 89.92 143.51 10.43 Favored Glycine 0 CA--C 1.534 1.251 0 C-N-CA 125.531 1.539 . . . . 0.0 113.082 -172.017 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 30.6 tp -59.89 -17.19 35.12 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 126.116 1.766 . . . . 0.0 114.932 -173.377 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 37.6 mt-30 -89.55 -18.99 25.55 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 126.474 1.91 . . . . 0.0 112.923 179.753 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 57.9 m-80 -108.67 -9.11 15.3 Favored 'General case' 0 N--CA 1.472 0.648 0 N-CA-C 114.35 1.241 . . . . 0.0 114.35 -173.748 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 30.5 pt -65.62 159.49 4.14 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.471 0 C-N-CA 123.787 0.835 . . . . 0.0 111.134 162.396 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -132.43 143.14 49.6 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 125.494 1.518 . . . . 0.0 109.904 175.612 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -59.44 -26.65 65.38 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 123.826 0.851 . . . . 0.0 112.219 174.679 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 27.7 mm -66.07 -44.33 92.01 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.495 0 C-N-CA 125.286 1.434 . . . . 0.0 111.686 175.36 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 56.2 m -83.4 -38.85 21.4 Favored 'General case' 0 C--O 1.222 -0.364 0 C-N-CA 123.175 0.59 . . . . 0.0 109.461 -178.515 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 14.3 tp -62.64 -37.82 87.84 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 125.0 1.32 . . . . 0.0 111.538 175.651 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.418 ' HA ' HG13 ' A' ' 66' ' ' ILE . 53.1 p -61.26 -25.76 67.3 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 113.2 0.815 . . . . 0.0 113.2 171.747 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -99.38 -28.29 13.35 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 125.092 1.357 . . . . 0.0 114.234 -177.196 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 51.9 mmtt -64.65 -36.47 84.36 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 125.806 1.642 . . . . 0.0 111.506 175.701 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.0 mp -115.31 3.64 14.26 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 125.408 1.483 . . . . 0.0 114.054 -174.0 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 42.3 m-80 56.13 61.13 2.87 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 126.347 1.859 . . . . 0.0 113.291 -179.171 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.418 HG13 ' HA ' ' A' ' 61' ' ' SER . 0.9 OUTLIER -134.82 178.11 5.9 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.715 0 C-N-CA 127.64 2.376 . . . . 0.0 111.226 -171.979 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.3 p -80.54 159.97 25.33 Favored 'General case' 0 N--CA 1.48 1.044 0 O-C-N 120.82 -1.175 . . . . 0.0 111.656 173.175 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 84.3 t -62.3 -29.13 45.98 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 C-N-CA 123.384 0.674 . . . . 0.0 111.303 172.943 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -81.28 -36.87 29.32 Favored 'General case' 0 N--CA 1.468 0.458 0 O-C-N 120.917 -1.114 . . . . 0.0 110.433 -179.436 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 9.7 tmtt? -64.08 -45.26 89.51 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 125.129 1.372 . . . . 0.0 110.702 175.922 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -60.0 -49.69 76.67 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 125.877 1.671 . . . . 0.0 113.008 170.335 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 34.7 ttmt -71.44 -23.14 61.79 Favored 'General case' 0 N--CA 1.466 0.332 0 O-C-N 121.003 -1.061 . . . . 0.0 111.876 -174.353 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -52.9 -40.34 63.44 Favored 'General case' 0 CA--C 1.546 0.796 0 CA-C-N 118.211 0.459 . . . . 0.0 111.324 172.039 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 27.8 m-85 -68.78 -40.72 79.52 Favored 'General case' 0 C--O 1.224 -0.238 0 C-N-CA 123.781 0.832 . . . . 0.0 111.486 179.5 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 61.2 mt -69.71 -26.85 31.53 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.676 0 C-N-CA 125.471 1.509 . . . . 0.0 111.121 179.666 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 71.2 mmtt -82.03 -32.0 30.69 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 125.016 1.326 . . . . 0.0 112.78 172.843 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 38.6 m-20 . . . . . 0 C--O 1.232 0.161 0 C-N-CA 124.42 1.088 . . . . 0.0 111.082 -177.522 . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 63.5 mm-40 . . . . . 0 N--CA 1.473 0.714 0 CA-C-O 121.212 0.529 . . . . 0.0 112.247 . . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -123.09 101.53 7.46 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 125.308 1.443 . . . . 0.0 110.244 174.219 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 8.5 p -149.94 131.54 5.34 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 C-N-CA 124.982 1.313 . . . . 0.0 110.874 177.814 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 45.4 t -162.8 -64.93 0.05 OUTLIER 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 124.135 0.974 . . . . 0.0 112.247 173.697 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 11.1 t -89.31 -27.84 20.26 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 124.09 0.956 . . . . 0.0 113.336 -175.303 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 65.5 mtt -130.89 134.66 46.98 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 125.67 1.588 . . . . 0.0 110.259 173.359 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -136.5 5.26 2.93 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 125.449 1.5 . . . . 0.0 113.924 -175.364 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -114.64 159.49 20.42 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.871 1.669 . . . . 0.0 113.003 -174.595 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 9.5 mtpm? . . . . . 0 N--CA 1.477 0.896 0 C-N-CA 125.739 1.616 . . . . 0.0 110.309 179.666 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.564 0 N-CA-C 111.221 -0.752 . . . . 0.0 111.221 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 23.8 t -144.22 135.17 25.22 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 124.833 1.253 . . . . 0.0 111.111 176.316 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 27.1 t-80 -154.96 158.26 38.95 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 125.471 1.508 . . . . 0.0 111.278 179.712 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 26.7 ttt -148.24 143.56 27.06 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 124.801 1.24 . . . . 0.0 111.841 178.615 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -130.79 152.5 50.06 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.644 1.177 . . . . 0.0 112.57 171.607 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 7.8 t -157.42 167.27 30.72 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 125.757 1.623 . . . . 0.0 110.585 173.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 64.6 ttp -122.64 128.15 50.26 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 125.44 1.496 . . . . 0.0 111.247 174.537 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -141.24 159.17 62.25 Favored Pre-proline 0 CA--C 1.547 0.861 0 C-N-CA 126.181 1.792 . . . . 0.0 111.098 178.167 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -71.17 -13.07 30.91 Favored 'Trans proline' 0 C--N 1.35 0.658 0 C-N-CA 122.777 2.318 . . . . 0.0 114.624 176.556 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 97.8 mt -107.64 45.96 0.97 Allowed 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 126.186 1.795 . . . . 0.0 112.918 -173.414 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 37.3 m-20 -105.49 -0.57 25.8 Favored 'General case' 0 N--CA 1.48 1.036 0 N-CA-C 114.67 1.359 . . . . 0.0 114.67 173.421 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -126.92 -58.8 1.29 Allowed 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 124.165 0.986 . . . . 0.0 113.625 -164.99 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.6 pp -109.19 5.37 9.24 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.786 0 C-N-CA 125.767 1.627 . . . . 0.0 113.227 -175.947 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 14.1 tt -45.57 -45.62 4.39 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.085 0 N-CA-C 115.398 1.629 . . . . 0.0 115.398 -170.638 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -144.74 22.86 1.6 Allowed 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 124.874 1.27 . . . . 0.0 112.892 -168.407 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -83.05 12.72 4.68 Favored 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 115.526 1.676 . . . . 0.0 115.526 -161.441 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 12.9 tt -146.23 26.51 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.913 0 C-N-CA 125.538 1.535 . . . . 0.0 113.7 -178.715 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -129.91 -46.02 1.15 Allowed 'General case' 0 N--CA 1.476 0.871 0 N-CA-C 114.195 1.183 . . . . 0.0 114.195 177.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 36.4 mmtt -146.22 145.98 30.61 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 126.241 1.816 . . . . 0.0 111.919 -169.443 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 5.9 mp0 -126.23 150.86 48.1 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 125.157 1.383 . . . . 0.0 111.697 172.7 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -156.67 172.2 19.01 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.517 1.527 . . . . 0.0 111.831 -174.896 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 -144.52 130.97 19.82 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 124.648 1.179 . . . . 0.0 110.676 176.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 13.9 m-20 -136.63 151.22 49.07 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 125.403 1.481 . . . . 0.0 111.471 -178.543 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 71.2 p -81.72 -7.0 59.55 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 115.257 1.577 . . . . 0.0 115.257 -176.649 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -174.69 98.65 0.13 Allowed Glycine 0 CA--C 1.527 0.827 0 O-C-N 121.892 -0.505 . . . . 0.0 113.509 170.081 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 15.0 p -144.55 135.89 21.1 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 C-N-CA 125.37 1.468 . . . . 0.0 110.761 172.75 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 61.9 m 61.54 156.75 0.04 OUTLIER 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 126.883 2.073 . . . . 0.0 115.478 178.428 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -140.18 17.62 2.43 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 116.199 1.925 . . . . 0.0 116.199 -176.647 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -151.38 113.32 3.03 Favored Pre-proline 0 CA--C 1.548 0.881 0 C-N-CA 124.465 1.106 . . . . 0.0 112.818 -175.411 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -87.07 -29.75 0.37 Allowed 'Trans proline' 0 CA--C 1.542 0.912 0 C-N-CA 122.836 2.357 . . . . 0.0 113.508 176.668 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 22.4 tp -153.07 64.86 0.77 Allowed 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 125.136 1.374 . . . . 0.0 111.201 -175.743 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 49.7 m 56.22 36.52 27.6 Favored 'General case' 0 N--CA 1.478 0.949 0 N-CA-C 114.742 1.386 . . . . 0.0 114.742 174.869 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 9.5 p -154.25 144.06 15.4 Favored Pre-proline 0 N--CA 1.474 0.757 0 C-N-CA 126.242 1.817 . . . . 0.0 109.45 -173.606 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 83.2 Cg_endo -76.61 64.99 7.48 Favored 'Trans proline' 0 CA--C 1.55 1.278 0 C-N-CA 123.534 2.822 . . . . 0.0 112.803 -177.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 34.5 tptt 58.25 114.96 0.02 OUTLIER Pre-proline 0 N--CA 1.482 1.125 0 C-N-CA 129.941 3.296 . . . . 0.0 114.331 -172.409 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 96.3 Cg_endo -75.12 145.31 30.9 Favored 'Trans proline' 0 CA--C 1.538 0.703 0 C-N-CA 122.774 2.316 . . . . 0.0 111.663 -178.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 17.9 ptmt -72.35 140.22 48.34 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 124.173 0.989 . . . . 0.0 112.744 -177.935 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 14.9 tp -140.55 140.16 35.14 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.95 1.7 . . . . 0.0 110.907 -173.857 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -148.39 48.42 1.04 Allowed 'General case' 0 N--CA 1.476 0.86 0 CA-C-O 122.85 1.309 . . . . 0.0 113.081 -179.353 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 -107.37 80.88 1.46 Allowed 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.977 1.311 . . . . 0.0 113.465 -171.744 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 65.0 mt -129.69 160.42 33.41 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 126.892 2.077 . . . . 0.0 112.17 173.756 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 18.8 t -73.21 168.4 19.2 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 123.579 0.752 . . . . 0.0 110.642 170.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -57.76 -46.94 83.84 Favored 'General case' 0 N--CA 1.475 0.791 0 O-C-N 120.49 -1.381 . . . . 0.0 112.657 -175.465 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 10.4 tt0 -70.79 -42.42 70.36 Favored 'General case' 0 N--CA 1.47 0.529 0 O-C-N 121.5 -0.75 . . . . 0.0 111.105 177.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 31.1 mm-40 -57.37 -45.71 84.13 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.952 0.901 . . . . 0.0 111.095 176.297 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 41.3 ttmt -61.49 -40.59 95.12 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 124.514 1.126 . . . . 0.0 111.292 177.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 56.4 mt -66.85 -40.42 85.81 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 CA-C-O 118.103 -0.951 . . . . 0.0 111.327 175.261 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 42.7 mt -63.51 -45.29 98.18 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.98 0 CA-C-N 120.828 1.649 . . . . 0.0 110.468 177.343 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -58.75 -48.91 79.57 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.359 1.064 . . . . 0.0 110.917 176.328 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -67.21 -52.1 45.3 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.97 1.308 . . . . 0.0 112.978 -179.19 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.9 mm-40 -60.84 -27.65 68.24 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-N 119.104 0.866 . . . . 0.0 112.793 -179.247 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -68.04 -58.15 4.96 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 123.392 0.677 . . . . 0.0 110.967 175.061 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 79.7 mt -62.6 -34.11 63.36 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.453 0 C-N-CA 126.649 1.979 . . . . 0.0 111.447 178.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -70.39 -25.86 63.44 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.105 0.962 . . . . 0.0 112.791 176.808 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -89.75 -39.11 13.35 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.26 1.024 . . . . 0.0 112.214 175.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.3 m -111.12 -5.2 11.21 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.147 0 N-CA-C 114.541 1.312 . . . . 0.0 114.541 -172.02 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 86.98 26.13 32.4 Favored Glycine 0 N--CA 1.473 1.117 0 C-N-CA 124.641 1.115 . . . . 0.0 115.737 159.508 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 55.9 10.98 0.63 Allowed 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 127.42 2.288 . . . . 0.0 115.18 -175.013 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 5.2 pt20 -124.06 -3.99 8.02 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 125.338 1.455 . . . . 0.0 113.573 -170.453 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 61.9 m-80 -122.01 0.4 9.66 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.09 1.356 . . . . 0.0 113.034 174.377 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 18.8 pt -76.86 154.52 5.63 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 C-N-CA 123.219 0.608 . . . . 0.0 111.597 176.364 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -139.16 145.05 38.89 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 125.045 1.338 . . . . 0.0 109.59 179.417 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -62.01 -27.58 68.97 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 118.875 0.761 . . . . 0.0 112.049 179.35 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -65.26 -49.94 76.15 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.432 0 C-N-CA 125.241 1.416 . . . . 0.0 109.888 175.179 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 76.5 m -78.49 -43.0 28.1 Favored 'General case' 0 C--O 1.222 -0.394 0 C-N-CA 123.685 0.794 . . . . 0.0 109.967 -175.04 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 24.2 tp -61.13 -34.35 74.85 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 124.962 1.305 . . . . 0.0 112.045 174.085 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 47.0 t -56.05 -31.51 63.23 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.149 0.98 . . . . 0.0 113.179 168.368 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -101.93 -19.06 15.4 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 125.254 1.422 . . . . 0.0 114.441 -175.565 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 68.8 mmtt -66.89 -40.35 87.74 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 124.386 1.074 . . . . 0.0 110.5 171.551 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.7 mp -106.74 -2.4 21.6 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.254 1.422 . . . . 0.0 114.438 -175.159 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 50.6 m-80 54.79 49.05 18.77 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 125.521 1.528 . . . . 0.0 112.457 -172.947 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 15.3 pt -107.05 -162.01 0.15 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.662 0 C-N-CA 126.419 1.887 . . . . 0.0 110.994 -179.309 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 47.0 p -97.02 159.75 14.73 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 124.508 1.123 . . . . 0.0 111.316 167.125 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 93.5 t -62.06 -23.78 32.63 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.876 0 O-C-N 121.574 -0.704 . . . . 0.0 111.21 169.559 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 13.7 mp0 -81.43 -32.24 32.77 Favored 'General case' 0 CA--C 1.531 0.236 0 O-C-N 120.689 -1.257 . . . . 0.0 110.298 -176.654 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 41.0 mttm -66.79 -52.99 37.6 Favored 'General case' 0 C--N 1.346 0.43 0 CA-C-N 118.634 0.652 . . . . 0.0 110.256 165.044 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -57.8 -41.5 82.3 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 124.052 0.941 . . . . 0.0 112.362 -172.393 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt -73.36 -27.65 61.61 Favored 'General case' 0 N--CA 1.463 0.184 0 C-N-CA 125.489 1.516 . . . . 0.0 111.976 179.347 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -60.74 -45.37 94.57 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 118.067 0.394 . . . . 0.0 111.571 176.929 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 66.2 m-85 -59.96 -44.98 94.08 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 124.875 1.27 . . . . 0.0 111.046 179.153 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 95.3 mt -64.39 -29.58 47.75 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.709 0 C-N-CA 124.459 1.104 . . . . 0.0 111.308 -178.572 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 50.0 mmtt -83.21 -36.57 24.53 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 125.472 1.509 . . . . 0.0 113.509 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 5.7 p30 -93.75 -43.37 8.66 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 119.976 1.262 . . . . 0.0 112.004 -179.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 20.8 m -102.01 97.2 7.56 Favored 'General case' 0 C--O 1.231 0.088 0 C-N-CA 123.386 0.675 . . . . 0.0 111.27 -177.823 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 -140.49 -58.27 0.53 Allowed 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 113.461 0.912 . . . . 0.0 113.461 -174.118 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 2.2 mpt_? -79.01 -19.83 50.56 Favored 'General case' 0 N--CA 1.484 1.26 0 N-CA-C 113.453 0.908 . . . . 0.0 113.453 179.371 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 6.5 tt -60.54 -36.1 77.61 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 124.662 1.185 . . . . 0.0 111.371 174.314 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -90.57 9.01 78.9 Favored Glycine 0 CA--C 1.54 1.594 0 C-N-CA 125.026 1.298 . . . . 0.0 116.017 175.341 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 8.2 mmt85 -101.31 -88.96 0.36 Allowed 'General case' 0 N--CA 1.477 0.923 0 CA-C-N 119.253 1.526 . . . . 0.0 110.696 176.725 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 4.3 t -157.61 124.81 5.12 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 124.438 1.095 . . . . 0.0 110.709 178.507 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 6.3 p30 -150.83 15.16 0.75 Allowed 'General case' 0 CA--C 1.552 1.031 0 C-N-CA 125.708 1.603 . . . . 0.0 112.956 -176.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 47.8 t30 -99.29 44.73 1.01 Allowed 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 125.79 1.636 . . . . 0.0 112.198 -176.396 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 6.8 tp -149.89 163.71 37.32 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.164 1.385 . . . . 0.0 110.899 -177.485 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 58.6 pttt -121.8 12.43 10.57 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 126.182 1.793 . . . . 0.0 113.458 -171.373 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 14.6 t -148.85 125.76 11.25 Favored 'General case' 0 C--O 1.233 0.209 0 C-N-CA 125.043 1.337 . . . . 0.0 109.97 173.171 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -138.0 1.78 0.72 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.725 0 C-N-CA 125.86 1.664 . . . . 0.0 113.602 -177.932 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 63.22 14.82 55.23 Favored Glycine 0 CA--C 1.539 1.542 0 O-C-N 121.0 -1.063 . . . . 0.0 114.952 -172.7 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . 0.271 3.1 mt 53.89 42.27 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.991 0 C-N-CA 126.685 1.994 . . . . 0.0 111.818 175.293 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 11.4 tp 54.52 25.38 6.15 Favored 'General case' 0 CA--C 1.552 1.046 0 C-N-CA 126.4 1.88 . . . . 0.0 114.581 -179.836 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 33.3 mt-30 -133.15 23.4 4.15 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 125.628 1.571 . . . . 0.0 113.017 -167.772 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -74.66 -62.93 1.36 Allowed 'General case' 0 N--CA 1.475 0.783 0 O-C-N 120.974 -1.079 . . . . 0.0 112.404 -179.856 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 55.79 48.13 18.88 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 125.951 1.701 . . . . 0.0 114.885 -179.128 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 20.8 t -131.52 135.89 58.36 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 C-N-CA 124.929 1.292 . . . . 0.0 111.434 178.221 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 50.1 m 52.72 31.96 11.24 Favored 'General case' 0 N--CA 1.483 1.184 0 N-CA-C 116.018 1.859 . . . . 0.0 116.018 170.053 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 32.3 t -149.54 -46.44 0.14 Allowed 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 124.354 1.062 . . . . 0.0 112.614 178.812 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 62.5 mtt -127.02 51.94 1.83 Allowed 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 125.414 1.486 . . . . 0.0 111.163 179.741 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -77.96 50.87 0.91 Allowed 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 125.9 1.68 . . . . 0.0 112.488 -178.485 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -135.87 166.11 24.06 Favored 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 125.989 1.716 . . . . 0.0 112.943 -172.852 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 65.2 pttt -140.04 168.46 19.75 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 125.902 1.681 . . . . 0.0 112.589 176.297 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 9.3 t -132.48 165.12 25.05 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 125.915 1.686 . . . . 0.0 111.127 171.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 10.1 ttt -142.79 158.94 43.13 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 125.129 1.372 . . . . 0.0 112.031 -175.78 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 9.2 m -98.58 143.22 29.22 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 124.839 1.256 . . . . 0.0 111.429 176.248 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 18.7 m-90 . . . . . 0 C--O 1.252 1.22 0 C-N-CA 126.276 1.83 . . . . 0.0 111.734 171.366 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.641 0 N-CA-C 111.319 -0.712 . . . . 0.0 111.319 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 21.3 t -72.14 146.92 47.13 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.799 0.84 . . . . 0.0 112.557 179.457 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 35.3 t-80 -95.59 81.2 3.5 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 124.776 1.23 . . . . 0.0 110.929 179.082 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 59.6 ttp -146.3 133.23 20.2 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 125.075 1.35 . . . . 0.0 111.063 177.718 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -151.74 163.48 39.04 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 124.645 1.178 . . . . 0.0 112.335 174.282 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 80.2 p -142.61 135.64 28.37 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 124.698 1.199 . . . . 0.0 112.382 -175.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 58.6 ttm -159.53 129.64 5.61 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.598 1.559 . . . . 0.0 109.954 175.396 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 -136.68 153.58 75.93 Favored Pre-proline 0 CA--C 1.547 0.857 0 C-N-CA 125.049 1.34 . . . . 0.0 112.05 179.019 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 96.1 Cg_endo -79.56 -0.68 10.9 Favored 'Trans proline' 0 C--N 1.35 0.651 0 C-N-CA 123.581 2.854 . . . . 0.0 114.909 -178.718 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 89.1 mt -112.27 42.57 1.77 Allowed 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.899 1.68 . . . . 0.0 112.535 -174.584 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -112.6 0.8 15.54 Favored 'General case' 0 N--CA 1.478 0.969 0 N-CA-C 114.652 1.353 . . . . 0.0 114.652 175.761 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -117.4 -55.67 2.29 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 124.311 1.044 . . . . 0.0 113.175 -168.453 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -130.07 17.7 2.26 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.767 0 C-N-CA 126.138 1.775 . . . . 0.0 112.928 -175.301 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 9.9 tt -46.25 125.62 1.54 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 C-N-CA 124.461 1.105 . . . . 0.0 112.282 177.304 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -145.99 5.86 1.01 Allowed 'General case' 0 CA--C 1.545 0.759 0 N-CA-C 113.83 1.048 . . . . 0.0 113.83 -179.467 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -83.19 10.23 8.81 Favored 'General case' 0 CA--C 1.547 0.831 0 N-CA-C 114.553 1.316 . . . . 0.0 114.553 -172.55 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 7.1 tp -143.64 28.39 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.775 0 C-N-CA 126.607 1.963 . . . . 0.0 112.434 -177.416 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -126.8 -43.33 1.71 Allowed 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 114.523 1.305 . . . . 0.0 114.523 -178.438 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 13.5 ttpp -133.13 158.07 43.72 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 125.65 1.58 . . . . 0.0 112.659 -174.091 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -117.65 169.69 9.37 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 126.275 1.83 . . . . 0.0 111.966 176.49 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -149.35 155.06 39.9 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 126.01 1.724 . . . . 0.0 111.198 176.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 17.0 t-20 -81.98 -26.52 33.84 Favored 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 113.417 0.895 . . . . 0.0 113.417 -177.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 23.8 m-20 -138.52 142.11 39.32 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 126.429 1.892 . . . . 0.0 110.816 172.729 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 23.0 t -149.21 102.5 3.23 Favored 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 124.619 1.168 . . . . 0.0 109.86 172.309 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 128.29 -6.71 6.73 Favored Glycine 0 N--CA 1.476 1.32 0 C-N-CA 125.265 1.412 . . . . 0.0 115.821 174.676 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 7.5 p -137.58 126.55 34.31 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.6 0 C-N-CA 125.26 1.424 . . . . 0.0 110.86 178.098 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -155.64 158.66 38.69 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 124.779 1.232 . . . . 0.0 112.904 179.622 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 3.3 mp -98.93 88.37 3.97 Favored 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 126.044 1.738 . . . . 0.0 110.315 -175.46 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -150.84 105.19 3.03 Favored Pre-proline 0 CA--C 1.548 0.901 0 CA-C-N 115.513 -0.767 . . . . 0.0 112.395 -157.213 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -81.1 -37.5 0.3 Allowed 'Trans proline' 0 C--N 1.354 0.829 0 C-N-CA 122.481 2.12 . . . . 0.0 113.716 -174.399 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 18.3 mt -143.18 67.33 1.3 Allowed 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 125.67 1.588 . . . . 0.0 111.347 -175.89 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 1.4 t 56.65 35.19 25.76 Favored 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 114.253 1.205 . . . . 0.0 114.253 174.043 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 9.5 p -156.09 141.58 12.6 Favored Pre-proline 0 N--CA 1.472 0.625 0 C-N-CA 126.461 1.904 . . . . 0.0 109.393 -174.039 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -77.36 67.76 7.66 Favored 'Trans proline' 0 CA--C 1.547 1.147 0 C-N-CA 123.546 2.831 . . . . 0.0 112.099 -178.607 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 43.7 tptt 60.67 112.98 0.02 OUTLIER Pre-proline 0 N--CA 1.481 1.092 0 C-N-CA 129.472 3.109 . . . . 0.0 113.425 -172.788 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -69.55 147.66 64.72 Favored 'Trans proline' 0 CA--C 1.537 0.672 0 C-N-CA 122.617 2.211 . . . . 0.0 111.757 -175.767 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.96 139.67 57.25 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.021 0.928 . . . . 0.0 111.823 -176.897 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.6 tp -154.38 130.38 10.23 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 124.939 1.295 . . . . 0.0 111.746 176.113 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -137.23 129.41 29.44 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 126.212 1.805 . . . . 0.0 108.03 156.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -145.11 70.41 1.27 Allowed 'General case' 0 CA--C 1.54 0.57 0 CA-C-O 122.572 1.177 . . . . 0.0 110.188 -177.718 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 27.3 mt -125.28 155.64 39.85 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 126.233 1.813 . . . . 0.0 111.032 -170.279 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 19.2 t -72.0 170.52 13.66 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.29 0.636 . . . . 0.0 110.417 167.341 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -58.95 -47.37 85.32 Favored 'General case' 0 N--CA 1.473 0.678 0 O-C-N 120.479 -1.388 . . . . 0.0 112.404 -175.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 12.0 tt0 -70.06 -41.27 74.38 Favored 'General case' 0 N--CA 1.471 0.575 0 O-C-N 121.494 -0.754 . . . . 0.0 111.256 178.454 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 38.4 mm-40 -58.55 -44.23 89.57 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.831 1.252 . . . . 0.0 111.301 175.45 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 19.7 ttmm -63.14 -41.89 99.37 Favored 'General case' 0 N--CA 1.471 0.604 0 O-C-N 121.056 -1.028 . . . . 0.0 111.065 175.106 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 57.3 mt -67.61 -40.86 84.93 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 CA-C-O 117.713 -1.137 . . . . 0.0 111.879 178.583 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 34.8 mt -63.82 -43.89 98.02 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 CA-C-N 121.384 1.902 . . . . 0.0 109.954 176.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -59.39 -45.95 90.05 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.651 1.18 . . . . 0.0 110.91 177.214 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -66.45 -51.59 55.26 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.949 1.3 . . . . 0.0 112.984 176.55 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -58.18 -31.34 67.2 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 119.289 0.949 . . . . 0.0 112.752 179.716 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -66.5 -56.36 11.27 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 118.516 0.598 . . . . 0.0 110.748 177.492 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 84.1 mt -63.32 -33.26 60.12 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.417 0 C-N-CA 126.758 2.023 . . . . 0.0 111.478 177.72 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -71.54 -27.72 63.37 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 123.873 0.869 . . . . 0.0 112.552 176.825 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -87.54 -39.72 14.9 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.317 1.047 . . . . 0.0 112.206 176.47 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.4 m -108.27 -4.16 10.4 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.161 0 N-CA-C 114.221 1.193 . . . . 0.0 114.221 -173.854 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 84.47 23.03 52.41 Favored Glycine 0 N--CA 1.471 1.01 0 C-N-CA 125.134 1.35 . . . . 0.0 115.345 160.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 58.33 5.0 0.37 Allowed 'General case' 0 CA--C 1.554 1.126 0 C-N-CA 127.382 2.273 . . . . 0.0 115.104 -171.028 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 29.1 mt-30 -101.5 -16.22 16.87 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 125.66 1.584 . . . . 0.0 112.857 -172.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 42.3 m-80 -125.88 5.74 7.33 Favored 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 113.804 1.038 . . . . 0.0 113.804 -172.789 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 21.1 pt -77.61 154.09 5.36 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 O-C-N 121.776 -0.578 . . . . 0.0 111.781 174.678 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -140.02 142.74 36.21 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 124.777 1.231 . . . . 0.0 109.427 177.999 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -59.47 -26.3 65.12 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 119.252 0.933 . . . . 0.0 112.597 -179.121 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.9 mp -69.71 -42.31 80.25 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 C-N-CA 126.101 1.76 . . . . 0.0 110.864 175.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 95.9 m -80.9 -42.31 21.61 Favored 'General case' 0 C--O 1.224 -0.288 0 C-N-CA 123.472 0.709 . . . . 0.0 109.777 -179.133 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 14.5 tp -61.97 -37.96 86.73 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 125.978 1.711 . . . . 0.0 111.523 175.324 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.421 ' HA ' HG13 ' A' ' 66' ' ' ILE . 57.3 p -62.28 -23.81 66.93 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 113.363 0.875 . . . . 0.0 113.363 172.119 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 66.5 mttm -101.72 -28.48 12.45 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 125.221 1.409 . . . . 0.0 114.278 -176.432 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 10.7 mmtm -63.13 -33.23 75.02 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 125.396 1.479 . . . . 0.0 111.846 174.548 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.9 mt -118.75 0.81 11.52 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 126.531 1.932 . . . . 0.0 113.011 -169.497 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 42.5 m-80 53.69 59.07 4.56 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 126.222 1.809 . . . . 0.0 113.028 -178.288 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.421 HG13 ' HA ' ' A' ' 61' ' ' SER . 0.8 OUTLIER -131.47 175.39 11.35 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.717 0 C-N-CA 126.93 2.092 . . . . 0.0 111.693 -172.277 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -74.6 154.84 38.38 Favored 'General case' 0 N--CA 1.473 0.706 0 O-C-N 121.408 -0.807 . . . . 0.0 111.144 172.748 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 69.3 t -64.89 -27.65 42.94 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 C-N-CA 123.816 0.846 . . . . 0.0 111.565 171.406 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -79.69 -29.77 40.88 Favored 'General case' 0 N--CA 1.466 0.366 0 O-C-N 121.086 -1.008 . . . . 0.0 110.822 179.768 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 4.7 ttmm -72.82 -46.21 54.31 Favored 'General case' 0 C--N 1.341 0.201 0 C-N-CA 124.225 1.01 . . . . 0.0 110.717 171.619 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -60.49 -49.04 79.14 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 125.059 1.344 . . . . 0.0 112.621 178.355 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 18.3 ptmt -69.43 -27.03 64.91 Favored 'General case' 0 N--CA 1.469 0.475 0 O-C-N 121.165 -0.96 . . . . 0.0 111.471 -177.463 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -57.16 -36.3 70.59 Favored 'General case' 0 CA--C 1.549 0.909 0 CA-C-N 118.152 0.433 . . . . 0.0 112.135 177.539 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 29.5 m-85 -68.2 -45.17 74.1 Favored 'General case' 0 C--O 1.225 -0.19 0 C-N-CA 125.084 1.353 . . . . 0.0 110.744 175.659 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 56.1 mt -65.55 -33.6 64.73 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.562 0 C-N-CA 124.47 1.108 . . . . 0.0 111.145 -179.702 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 72.6 mmtt -75.49 -38.25 59.65 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 124.205 1.002 . . . . 0.0 112.609 -178.033 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 6.7 p30 -85.97 -44.92 11.96 Favored 'General case' 0 C--N 1.344 0.341 0 CA-C-N 119.514 1.052 . . . . 0.0 110.703 176.471 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 7.8 t -95.87 87.78 4.73 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-O 121.305 0.574 . . . . 0.0 110.408 -174.269 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -141.86 -50.99 0.41 Allowed 'General case' 0 CA--C 1.539 0.536 0 N-CA-C 113.907 1.077 . . . . 0.0 113.907 -171.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 3.2 mpt_? -80.04 -10.23 59.75 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 124.291 1.036 . . . . 0.0 113.515 -179.529 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.0 mt -76.53 -46.79 24.99 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.641 1.176 . . . . 0.0 112.675 175.701 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -88.28 105.9 3.18 Favored Glycine 0 CA--C 1.533 1.2 0 C-N-CA 123.781 0.705 . . . . 0.0 111.631 178.177 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 14.3 mmm-85 -113.69 157.45 22.16 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 125.356 1.463 . . . . 0.0 113.008 -169.183 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 6.9 t -71.42 -26.65 62.84 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 125.431 1.492 . . . . 0.0 113.526 -178.806 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 73.8 m-80 -83.17 121.82 27.57 Favored 'General case' 0 CA--C 1.541 0.624 0 O-C-N 121.559 -0.713 . . . . 0.0 112.126 -178.546 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 56.5 t30 -150.47 175.28 12.02 Favored 'General case' 0 CA--C 1.551 1.01 0 C-N-CA 126.886 2.075 . . . . 0.0 109.553 177.54 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 10.2 tp 58.87 32.57 22.37 Favored 'General case' 0 CA--C 1.551 0.985 0 C-N-CA 125.044 1.338 . . . . 0.0 113.473 178.564 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 17.2 ptmt -123.31 2.47 9.13 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 126.559 1.944 . . . . 0.0 114.244 -173.712 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 14.0 t -149.52 123.44 9.36 Favored 'General case' 0 N--CA 1.465 0.282 0 C-N-CA 125.138 1.375 . . . . 0.0 109.712 174.46 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -139.86 4.59 0.58 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.83 0 C-N-CA 126.016 1.726 . . . . 0.0 113.069 -178.078 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 69.84 5.73 53.1 Favored Glycine 0 CA--C 1.538 1.505 0 O-C-N 120.885 -1.134 . . . . 0.0 114.941 -171.042 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . 0.251 14.3 mm 53.81 31.57 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.139 0 C-N-CA 126.741 2.016 . . . . 0.0 112.117 176.061 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 11.9 tp 52.65 29.96 8.06 Favored 'General case' 0 CA--C 1.554 1.114 0 C-N-CA 126.415 1.886 . . . . 0.0 114.578 -178.896 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 7.2 pt20 -130.65 29.34 4.8 Favored 'General case' 0 N--CA 1.476 0.831 0 N-CA-C 114.358 1.244 . . . . 0.0 114.358 -173.608 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -128.11 142.24 51.26 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 124.707 1.203 . . . . 0.0 112.528 -175.748 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -82.73 60.28 5.2 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 125.78 1.632 . . . . 0.0 112.72 -174.304 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 88.8 t -137.64 148.24 25.81 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 C-N-CA 125.838 1.655 . . . . 0.0 110.524 -178.792 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 10.7 t 65.44 -54.65 0.34 Allowed 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 128.061 2.544 . . . . 0.0 115.735 179.03 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 50.0 m -65.56 -33.08 75.07 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 124.159 0.984 . . . . 0.0 112.316 176.629 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 22.4 mmt -138.6 143.67 39.45 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 126.759 2.024 . . . . 0.0 109.419 165.003 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 15.1 tt0 -146.55 3.37 0.86 Allowed 'General case' 0 CA--C 1.551 1.001 0 N-CA-C 113.573 0.953 . . . . 0.0 113.573 -179.332 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -81.96 153.24 26.36 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 124.767 1.227 . . . . 0.0 113.044 -177.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 75.8 mmtt -121.91 5.7 9.89 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 125.816 1.646 . . . . 0.0 113.99 179.551 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 42.0 p -81.95 159.01 23.69 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 125.463 1.505 . . . . 0.0 113.211 179.005 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 1.3 mpt? -86.19 151.68 23.45 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.796 1.238 . . . . 0.0 112.323 178.054 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 7.0 t -86.37 166.95 15.18 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 124.418 1.087 . . . . 0.0 112.229 168.637 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 48.4 t-105 . . . . . 0 C--O 1.253 1.255 0 C-N-CA 125.727 1.611 . . . . 0.0 112.671 -173.251 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.692 0 N-CA-C 112.09 -0.404 . . . . 0.0 112.09 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 35.9 t -143.41 -61.11 0.41 Allowed 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 124.357 1.063 . . . . 0.0 112.049 177.451 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 53.5 t60 -147.74 93.53 2.22 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.734 1.214 . . . . 0.0 110.371 175.348 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 16.7 ptp -145.45 37.97 1.13 Allowed 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 124.874 1.27 . . . . 0.0 113.332 -173.732 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -147.94 168.49 22.13 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.035 0.934 . . . . 0.0 113.406 -175.357 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 99.7 p -132.97 161.26 34.78 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 126.246 1.818 . . . . 0.0 111.98 -177.283 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 52.0 ttm -121.2 105.04 10.21 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 125.277 1.431 . . . . 0.0 109.98 -178.559 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -152.17 138.49 11.85 Favored Pre-proline 0 CA--C 1.551 1.002 0 C-N-CA 124.645 1.178 . . . . 0.0 111.749 -173.42 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 81.6 Cg_endo -82.8 -2.57 10.95 Favored 'Trans proline' 0 C--N 1.352 0.732 0 C-N-CA 123.287 2.658 . . . . 0.0 115.919 -176.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 67.3 mt -109.54 38.99 2.19 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 125.366 1.466 . . . . 0.0 113.227 -174.066 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -104.68 -0.49 27.44 Favored 'General case' 0 N--CA 1.48 1.035 0 N-CA-C 115.387 1.625 . . . . 0.0 115.387 175.454 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -115.68 -56.28 2.35 Favored 'General case' 0 N--CA 1.484 1.231 0 N-CA-C 113.598 0.962 . . . . 0.0 113.598 -167.534 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.9 pp -129.3 12.68 2.59 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.896 0 C-N-CA 126.005 1.722 . . . . 0.0 112.963 -171.599 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 12.9 tt -40.95 123.84 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.947 0 C-N-CA 125.646 1.579 . . . . 0.0 113.902 -177.419 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -153.67 120.85 5.76 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.452 1.501 . . . . 0.0 108.787 172.473 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 30.1 t0 -161.96 70.7 0.33 Allowed 'General case' 0 N--CA 1.469 0.51 0 CA-C-O 122.352 1.072 . . . . 0.0 109.148 -178.81 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 54.7 mt 53.41 63.01 0.21 Allowed 'Isoleucine or valine' 0 CA--C 1.548 0.867 0 C-N-CA 125.699 1.6 . . . . 0.0 110.414 -169.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 4.0 tmmm? -151.51 -44.98 0.11 Allowed 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.882 1.273 . . . . 0.0 112.325 176.245 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 62.0 mttm -109.04 164.93 11.98 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 126.104 1.762 . . . . 0.0 112.547 174.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -132.8 149.02 52.31 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 126.193 1.797 . . . . 0.0 110.91 -177.567 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -142.03 153.69 44.42 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.813 1.245 . . . . 0.0 112.677 -177.914 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 7.7 t30 -79.16 -32.64 44.36 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 123.704 0.801 . . . . 0.0 113.033 -178.09 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 -139.42 98.9 3.6 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 125.585 1.554 . . . . 0.0 110.181 -177.77 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 80.7 p -132.88 -5.78 3.15 Favored 'General case' 0 N--CA 1.479 1.023 0 N-CA-C 115.776 1.769 . . . . 0.0 115.776 -173.492 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -176.51 41.21 0.1 Allowed Glycine 0 CA--C 1.53 0.997 0 O-C-N 121.716 -0.615 . . . . 0.0 114.292 177.281 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 12.0 p -141.78 17.13 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.017 0 C-N-CA 125.319 1.448 . . . . 0.0 112.528 -165.355 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -117.88 166.99 11.82 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 125.503 1.521 . . . . 0.0 112.056 -172.074 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 17.7 mt -81.05 28.09 0.37 Allowed 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 127.202 2.201 . . . . 0.0 114.133 -166.785 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -153.4 116.25 2.72 Favored Pre-proline 0 CA--C 1.548 0.894 0 C-N-CA 124.926 1.29 . . . . 0.0 112.286 -163.356 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_endo -84.42 -29.12 0.9 Allowed 'Trans proline' 0 CA--C 1.541 0.846 0 C-N-CA 122.653 2.236 . . . . 0.0 113.898 -178.771 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 17.6 tp -150.71 58.92 0.93 Allowed 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 124.517 1.127 . . . . 0.0 111.962 -173.207 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 1.9 t 56.95 36.92 28.42 Favored 'General case' 0 N--CA 1.48 1.029 0 N-CA-C 114.255 1.205 . . . . 0.0 114.255 179.647 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 7.4 p -155.3 141.26 12.86 Favored Pre-proline 0 N--CA 1.472 0.63 0 C-N-CA 126.215 1.806 . . . . 0.0 109.186 -175.502 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 93.0 Cg_endo -78.3 64.13 8.42 Favored 'Trans proline' 0 CA--C 1.549 1.256 0 C-N-CA 123.496 2.797 . . . . 0.0 112.716 -175.497 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 25.1 tptp 58.55 114.87 0.02 OUTLIER Pre-proline 0 N--CA 1.484 1.274 0 C-N-CA 129.392 3.077 . . . . 0.0 113.022 -168.535 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_endo -74.21 147.49 37.73 Favored 'Trans proline' 0 CA--C 1.538 0.681 0 C-N-CA 122.287 1.991 . . . . 0.0 111.977 -177.434 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 26.8 mmmt -61.8 143.36 56.41 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 124.763 1.225 . . . . 0.0 111.28 175.204 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.405 HD21 HD21 ' A' ' 73' ' ' ASN . 14.0 tp -138.8 137.26 36.48 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.988 1.315 . . . . 0.0 111.044 -177.913 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -139.54 114.97 9.87 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 125.48 1.512 . . . . 0.0 108.878 167.431 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -146.59 40.55 1.1 Allowed 'General case' 0 N--CA 1.476 0.855 0 CA-C-O 122.986 1.374 . . . . 0.0 114.148 -176.331 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 70.5 mt -106.69 149.91 26.79 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 125.28 1.432 . . . . 0.0 112.705 -173.113 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 28.1 m -73.43 166.94 22.28 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 124.2 1.0 . . . . 0.0 110.332 170.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -54.37 -43.63 71.52 Favored 'General case' 0 N--CA 1.474 0.765 0 O-C-N 121.132 -0.98 . . . . 0.0 113.052 -175.246 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 8.3 pt20 -75.06 -35.46 61.85 Favored 'General case' 0 N--CA 1.471 0.621 0 O-C-N 121.472 -0.767 . . . . 0.0 112.532 176.603 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 15.6 mm-40 -66.73 -41.09 88.44 Favored 'General case' 0 CA--C 1.537 0.445 0 O-C-N 121.686 -0.634 . . . . 0.0 110.487 179.789 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 15.3 ttmm -59.5 -41.68 90.46 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 123.867 0.867 . . . . 0.0 111.114 174.116 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 56.8 mt -68.41 -39.5 80.89 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.656 0 CA-C-O 117.856 -1.069 . . . . 0.0 111.388 176.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 27.5 mt -66.58 -42.42 89.91 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.976 0 CA-C-N 121.254 1.843 . . . . 0.0 110.629 178.003 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -55.47 -48.57 74.33 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 124.092 0.957 . . . . 0.0 110.017 175.004 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -67.55 -52.28 40.67 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.763 1.225 . . . . 0.0 113.659 178.649 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 52.8 mt-10 -60.15 -29.06 68.41 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-N 119.077 0.853 . . . . 0.0 112.889 -179.048 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -69.11 -54.04 17.08 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 118.613 0.642 . . . . 0.0 111.216 177.149 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 46.5 mt -61.01 -33.92 57.77 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.537 0 C-N-CA 125.281 1.432 . . . . 0.0 111.342 174.281 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -70.21 -22.83 62.88 Favored 'General case' 0 CA--C 1.546 0.816 0 O-C-N 121.211 -0.931 . . . . 0.0 113.064 175.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -93.03 -32.78 14.37 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.794 1.237 . . . . 0.0 112.916 178.644 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 4.7 m -121.9 -19.09 4.61 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.953 0 CA-C-N 119.595 1.089 . . . . 0.0 113.832 -174.006 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 86.18 142.19 6.59 Favored Glycine 0 CA--C 1.532 1.154 0 C-N-CA 125.247 1.404 . . . . 0.0 112.7 -171.787 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 46.4 tp -57.84 -19.75 31.19 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 125.484 1.514 . . . . 0.0 114.406 -177.432 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 35.9 mt-30 -80.75 -17.01 52.36 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 126.911 2.084 . . . . 0.0 113.033 -179.884 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 68.9 m-80 -115.81 -8.68 11.96 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 114.837 1.421 . . . . 0.0 114.837 -173.402 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 20.9 pt -68.21 156.8 6.75 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.546 0 C-N-CA 123.388 0.675 . . . . 0.0 111.736 169.871 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -131.25 149.61 52.5 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 124.269 1.027 . . . . 0.0 111.175 177.028 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -64.3 -27.07 68.78 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 123.645 0.778 . . . . 0.0 111.939 178.442 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -66.57 -50.21 68.5 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.399 0 C-N-CA 124.6 1.16 . . . . 0.0 109.13 173.882 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 82.9 m -73.01 -43.2 62.41 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 123.373 0.669 . . . . 0.0 110.868 -176.743 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 20.2 tp -63.95 -34.92 79.07 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.14 1.376 . . . . 0.0 111.862 176.101 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.452 ' HA ' HG13 ' A' ' 66' ' ' ILE . 25.7 t -55.8 -30.21 60.98 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 124.836 1.255 . . . . 0.0 112.727 169.629 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 11.8 mptt -100.52 -28.7 12.76 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 125.373 1.469 . . . . 0.0 113.51 -175.531 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 15.9 mmtm -64.46 -38.13 89.96 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.932 1.293 . . . . 0.0 111.373 177.868 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.3 mp -111.37 7.72 21.03 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 125.013 1.325 . . . . 0.0 113.823 -178.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 17.0 t30 55.01 57.01 5.96 Favored 'General case' 0 CA--C 1.552 1.052 0 CA-C-O 122.393 1.092 . . . . 0.0 111.605 177.185 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.452 HG13 ' HA ' ' A' ' 61' ' ' SER . 3.4 pt -127.57 -168.8 0.58 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.772 0 C-N-CA 126.617 1.967 . . . . 0.0 110.424 -173.627 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 41.7 p -89.25 160.63 16.83 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 123.935 0.894 . . . . 0.0 111.594 171.446 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 64.7 t -64.5 -23.67 33.92 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.944 0 O-C-N 121.658 -0.651 . . . . 0.0 111.209 168.406 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 26.3 mm-40 -78.61 -35.06 46.19 Favored 'General case' 0 N--CA 1.464 0.267 0 O-C-N 120.815 -1.178 . . . . 0.0 110.387 -177.481 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 35.2 mttm -65.05 -54.18 34.18 Favored 'General case' 0 C--N 1.346 0.432 0 CA-C-N 118.446 0.566 . . . . 0.0 110.587 166.836 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -56.75 -45.19 82.18 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.931 1.292 . . . . 0.0 112.311 -173.022 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 22.5 ttmm -68.65 -32.34 72.11 Favored 'General case' 0 CA--C 1.519 -0.228 0 C-N-CA 124.537 1.135 . . . . 0.0 111.203 178.459 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . 0.405 HD21 HD21 ' A' ' 32' ' ' LEU . 0.0 OUTLIER -63.34 -37.97 89.33 Favored 'General case' 0 CA--C 1.546 0.806 0 CA-C-O 118.793 -0.622 . . . . 0.0 112.578 179.575 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 79.5 m-85 -62.9 -42.91 99.95 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.52 1.128 . . . . 0.0 110.749 174.648 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 87.4 mt -71.03 -22.66 22.91 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.755 0 C-N-CA 125.057 1.343 . . . . 0.0 111.24 179.36 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 75.7 tttt -89.65 -32.96 16.83 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 125.572 1.549 . . . . 0.0 112.721 -177.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 8.9 p30 -86.92 -39.39 15.8 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 118.938 0.79 . . . . 0.0 111.617 170.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -109.55 102.57 11.41 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-O 121.398 0.618 . . . . 0.0 111.097 -174.196 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -154.75 143.78 21.0 Favored 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 112.517 0.562 . . . . 0.0 112.517 -178.098 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 39.5 mmt-85 53.31 8.27 0.11 Allowed 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 126.698 1.999 . . . . 0.0 115.928 -176.14 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 34.3 tp -132.41 -39.42 1.02 Allowed 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 125.676 1.59 . . . . 0.0 113.165 -167.118 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -78.37 76.78 1.79 Allowed Glycine 0 CA--C 1.536 1.367 0 C-N-CA 123.367 0.508 . . . . 0.0 113.431 -179.651 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 56.4 mmt-85 -87.38 157.81 19.16 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 125.06 1.344 . . . . 0.0 110.758 175.315 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 10.2 t -65.29 107.14 1.52 Allowed 'General case' 0 N--CA 1.472 0.634 0 CA-C-O 122.169 0.985 . . . . 0.0 111.872 178.051 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 38.9 m-80 -133.77 146.57 50.84 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.961 1.704 . . . . 0.0 110.849 176.723 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 8.4 t30 -149.95 -53.25 0.15 Allowed 'General case' 0 N--CA 1.474 0.75 0 N-CA-C 113.521 0.934 . . . . 0.0 113.521 175.198 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 6.6 mt -152.17 169.54 22.18 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 127.554 2.341 . . . . 0.0 110.624 -179.587 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 56.5 pttt -125.97 14.34 7.93 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 126.303 1.841 . . . . 0.0 113.513 -178.058 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 14.7 t -150.42 130.23 13.28 Favored 'General case' 0 C--O 1.234 0.257 0 C-N-CA 125.578 1.551 . . . . 0.0 109.628 175.365 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -137.49 3.93 0.77 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.764 0 C-N-CA 126.023 1.729 . . . . 0.0 113.72 -175.386 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 69.29 7.08 56.68 Favored Glycine 0 CA--C 1.538 1.494 0 O-C-N 120.768 -1.208 . . . . 0.0 115.049 -173.195 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . 0.275 42.3 mm 58.72 26.3 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.029 0 C-N-CA 125.977 1.711 . . . . 0.0 112.608 173.489 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 10.6 tp 58.55 21.42 8.6 Favored 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 126.551 1.94 . . . . 0.0 114.844 -177.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 35.7 mt-30 -96.23 58.97 1.87 Allowed 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 125.555 1.542 . . . . 0.0 112.061 -176.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 22.1 mm-40 -81.09 -45.71 16.07 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 123.976 0.911 . . . . 0.0 113.051 -177.423 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . 0.256 35.9 mt-10 52.65 38.96 27.41 Favored 'General case' 0 N--CA 1.48 1.062 0 N-CA-C 116.868 2.173 . . . . 0.0 116.868 172.139 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 33.1 t -81.7 146.82 6.74 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.327 0 C-N-CA 124.841 1.257 . . . . 0.0 111.671 -176.253 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 50.8 m 57.44 26.63 12.82 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 126.694 1.997 . . . . 0.0 115.252 177.721 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 23.2 t -149.65 -41.82 0.14 Allowed 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.559 1.144 . . . . 0.0 112.79 176.337 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 30.3 tpp -123.95 37.32 4.43 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 125.298 1.439 . . . . 0.0 111.889 -179.536 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -76.54 75.23 3.26 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 125.339 1.455 . . . . 0.0 111.504 -176.584 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -144.44 162.86 35.45 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 126.342 1.857 . . . . 0.0 111.979 -178.187 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 67.3 mttm -107.78 142.22 38.15 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 125.643 1.577 . . . . 0.0 111.53 178.292 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 80.5 p -153.86 165.17 36.9 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 125.433 1.493 . . . . 0.0 112.319 -178.479 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 99.1 mtp -137.96 159.87 40.87 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 125.64 1.576 . . . . 0.0 111.897 179.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 10.9 t -106.99 166.53 10.54 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 125.49 1.516 . . . . 0.0 111.864 170.663 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 29.8 t-105 . . . . . 0 C--O 1.253 1.239 0 C-N-CA 125.624 1.57 . . . . 0.0 112.827 -171.581 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.575 0 N-CA-C 111.576 -0.609 . . . . 0.0 111.576 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 50.0 m -113.74 137.68 51.29 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 124.855 1.262 . . . . 0.0 112.317 -176.202 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 90.4 m-70 -135.6 -35.47 0.8 Allowed 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 124.828 1.251 . . . . 0.0 113.745 179.462 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 9.2 tpt -145.13 130.7 18.86 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 124.797 1.239 . . . . 0.0 110.894 178.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -152.91 168.79 24.64 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 124.384 1.073 . . . . 0.0 112.849 -176.438 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 5.3 t -114.11 167.99 10.2 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.683 1.593 . . . . 0.0 111.907 174.095 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.8 ttt -116.98 123.19 46.31 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 125.511 1.524 . . . . 0.0 111.018 -177.555 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 -141.24 147.02 45.29 Favored Pre-proline 0 CA--C 1.549 0.916 0 C-N-CA 125.241 1.417 . . . . 0.0 112.277 -175.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_endo -79.79 -22.42 7.66 Favored 'Trans proline' 0 C--N 1.35 0.641 0 C-N-CA 123.303 2.669 . . . . 0.0 115.199 -175.762 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 96.9 mt -113.17 42.43 1.92 Allowed 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.981 1.713 . . . . 0.0 112.084 -173.566 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -109.13 0.28 19.73 Favored 'General case' 0 N--CA 1.474 0.728 0 N-CA-C 114.661 1.356 . . . . 0.0 114.661 -177.927 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -126.26 -56.1 1.43 Allowed 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 124.574 1.149 . . . . 0.0 113.423 -164.308 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.9 pp -124.39 13.05 4.78 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 C-N-CA 126.223 1.809 . . . . 0.0 112.772 -173.478 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 11.4 tt -44.23 109.87 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.48 1.068 0 C-N-CA 125.693 1.597 . . . . 0.0 113.345 -177.602 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -150.95 14.95 0.73 Allowed 'General case' 0 N--CA 1.476 0.84 0 N-CA-C 115.173 1.546 . . . . 0.0 115.173 -177.373 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -86.3 8.84 19.77 Favored 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 115.15 1.537 . . . . 0.0 115.15 -170.346 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 6.8 tp -143.45 22.35 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.96 0 C-N-CA 125.547 1.539 . . . . 0.0 114.26 -173.153 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 50.1 mtmt -118.67 -44.17 2.65 Favored 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 114.508 1.299 . . . . 0.0 114.508 179.333 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 63.2 mttp 46.0 36.99 3.32 Favored 'General case' 0 N--CA 1.488 1.442 0 C-N-CA 125.91 1.684 . . . . 0.0 114.208 -175.538 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 55.43 93.84 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 127.086 2.154 . . . . 0.0 113.304 -169.329 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -146.44 156.85 43.6 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 125.069 1.347 . . . . 0.0 112.081 179.288 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -84.4 51.65 2.15 Favored 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 125.041 1.337 . . . . 0.0 112.037 -177.937 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -136.59 132.46 35.16 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 125.66 1.584 . . . . 0.0 111.408 -178.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 66.0 m -137.45 94.0 2.87 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 125.155 1.382 . . . . 0.0 110.593 -177.31 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 84.72 104.93 0.62 Allowed Glycine 0 CA--C 1.534 1.231 0 C-N-CA 125.198 1.38 . . . . 0.0 112.558 -178.021 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 61.2 t -108.36 -1.56 9.94 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.219 0 C-N-CA 125.46 1.504 . . . . 0.0 113.07 -175.222 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -137.57 168.81 18.91 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 125.017 1.327 . . . . 0.0 113.017 -166.917 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 17.4 mt -79.01 16.79 0.84 Allowed 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 126.756 2.022 . . . . 0.0 115.018 -168.189 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -156.73 102.03 1.98 Allowed Pre-proline 0 CA--C 1.547 0.828 0 C-N-CA 125.312 1.445 . . . . 0.0 111.478 -163.301 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_endo -79.44 -39.68 0.3 Allowed 'Trans proline' 0 CA--C 1.539 0.756 0 C-N-CA 122.422 2.081 . . . . 0.0 112.774 -179.226 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 15.3 mt -145.56 84.16 1.68 Allowed 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 126.003 1.721 . . . . 0.0 110.697 178.239 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . 0.253 54.8 p 52.59 28.92 6.57 Favored 'General case' 0 N--CA 1.477 0.876 0 N-CA-C 116.602 2.075 . . . . 0.0 116.602 167.974 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 4.6 p -155.0 145.91 16.4 Favored Pre-proline 0 N--CA 1.475 0.789 0 C-N-CA 126.612 1.965 . . . . 0.0 109.891 -174.084 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_endo -74.73 70.13 5.15 Favored 'Trans proline' 0 CA--C 1.547 1.152 0 C-N-CA 123.575 2.85 . . . . 0.0 112.484 178.882 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 34.8 tptt 60.2 110.48 0.02 OUTLIER Pre-proline 0 N--CA 1.482 1.133 0 C-N-CA 129.823 3.249 . . . . 0.0 114.096 -175.577 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_endo -73.46 150.74 46.76 Favored 'Trans proline' 0 C--N 1.352 0.735 0 C-N-CA 122.906 2.404 . . . . 0.0 111.928 -178.069 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -70.72 140.67 51.47 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 123.989 0.915 . . . . 0.0 111.788 -178.758 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 13.1 tp -142.67 138.82 30.9 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 125.683 1.593 . . . . 0.0 110.59 -177.134 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -147.57 39.3 0.97 Allowed 'General case' 0 N--CA 1.478 0.959 0 CA-C-O 123.105 1.431 . . . . 0.0 113.951 179.162 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 29.6 mt-10 -92.3 80.4 4.98 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 125.562 1.545 . . . . 0.0 112.081 -173.684 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.8 mt -124.96 158.76 32.82 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 127.293 2.237 . . . . 0.0 110.517 -178.234 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 26.0 p -68.98 169.76 11.1 Favored 'General case' 0 N--CA 1.478 0.969 0 O-C-N 121.82 -0.55 . . . . 0.0 111.159 167.713 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -56.85 -44.36 82.05 Favored 'General case' 0 N--CA 1.473 0.71 0 O-C-N 120.909 -1.12 . . . . 0.0 111.766 176.377 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 9.3 tt0 -70.89 -44.91 65.32 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 123.587 0.755 . . . . 0.0 111.44 177.53 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 90.6 mt-30 -63.79 -37.19 86.43 Favored 'General case' 0 CA--C 1.534 0.363 0 O-C-N 121.722 -0.612 . . . . 0.0 111.777 179.433 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 23.6 ttmm -62.21 -43.5 98.68 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 123.805 0.842 . . . . 0.0 111.105 174.053 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 51.5 mt -65.24 -44.81 95.05 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 CA-C-N 119.021 0.828 . . . . 0.0 111.176 176.722 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 49.3 mt -64.81 -45.26 95.56 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 CA-C-N 120.095 1.316 . . . . 0.0 110.352 -179.711 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -57.09 -49.03 77.13 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 124.783 1.233 . . . . 0.0 110.357 176.838 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -65.94 -52.62 48.2 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 124.436 1.094 . . . . 0.0 112.601 179.116 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 18.7 mm-40 -60.96 -26.04 67.26 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 119.161 0.891 . . . . 0.0 113.089 -179.375 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -70.99 -59.12 2.96 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 123.979 0.912 . . . . 0.0 111.228 175.075 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 54.2 mt -60.12 -34.48 57.0 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 C-N-CA 126.229 1.812 . . . . 0.0 111.984 177.051 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -69.68 -24.82 63.65 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 123.953 0.901 . . . . 0.0 112.775 176.899 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -92.87 -29.41 15.95 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.497 1.119 . . . . 0.0 113.184 179.182 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 5.1 m -123.74 -22.82 2.6 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.981 0 N-CA-C 114.202 1.186 . . . . 0.0 114.202 -174.597 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 86.86 144.34 8.39 Favored Glycine 0 CA--C 1.534 1.275 0 C-N-CA 125.183 1.373 . . . . 0.0 113.373 -172.851 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -69.41 -5.37 23.2 Favored 'General case' 0 N--CA 1.478 0.967 0 N-CA-C 114.706 1.372 . . . . 0.0 114.706 -166.588 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 3.0 pm0 -101.54 -6.06 24.38 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 125.415 1.486 . . . . 0.0 114.087 173.63 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 76.4 m-20 -107.5 -12.08 15.36 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 124.57 1.148 . . . . 0.0 113.759 175.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 40.5 pt -68.07 157.49 6.28 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 C-N-CA 123.949 0.899 . . . . 0.0 111.27 164.691 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.3 p -124.54 144.24 50.24 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 125.002 1.321 . . . . 0.0 110.292 174.299 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -61.81 -30.77 71.05 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 124.182 0.993 . . . . 0.0 111.103 175.892 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -61.42 -58.33 8.06 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.256 0 C-N-CA 124.772 1.229 . . . . 0.0 108.565 174.811 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 46.7 m -69.91 -41.35 74.81 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 123.255 0.622 . . . . 0.0 110.649 -174.413 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 24.4 tp -60.94 -36.38 79.21 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 123.631 0.772 . . . . 0.0 112.032 174.197 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.425 ' HA ' HG13 ' A' ' 66' ' ' ILE . 10.8 p -62.21 -19.63 63.34 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 113.859 1.059 . . . . 0.0 113.859 173.667 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -105.21 -25.19 12.56 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 125.244 1.418 . . . . 0.0 114.665 176.299 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 22.1 mmtt -62.35 -35.8 80.24 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-N 119.778 1.172 . . . . 0.0 110.951 172.404 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 85.8 mt -113.8 -1.33 13.94 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 125.92 1.688 . . . . 0.0 114.029 -171.324 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 32.2 m-80 56.7 61.51 2.62 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 126.066 1.746 . . . . 0.0 113.386 -177.089 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.425 HG13 ' HA ' ' A' ' 61' ' ' SER . 0.5 OUTLIER -135.97 176.64 7.84 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.907 0 C-N-CA 126.486 1.915 . . . . 0.0 112.118 -171.0 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -71.22 154.19 41.86 Favored 'General case' 0 N--CA 1.476 0.829 0 O-C-N 121.307 -0.871 . . . . 0.0 111.535 173.007 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 86.3 t -65.13 -24.47 35.38 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 C-N-CA 124.084 0.954 . . . . 0.0 111.839 175.35 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 75.4 mm-40 -85.97 -35.36 20.47 Favored 'General case' 0 N--CA 1.469 0.484 0 O-C-N 120.907 -1.12 . . . . 0.0 110.67 176.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 45.3 tttt -65.01 -42.52 94.36 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 123.521 0.728 . . . . 0.0 111.117 177.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -58.56 -40.31 82.73 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 125.095 1.358 . . . . 0.0 112.296 170.617 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 23.0 ttpt -70.0 -32.17 70.22 Favored 'General case' 0 C--O 1.224 -0.261 0 C-N-CA 124.672 1.189 . . . . 0.0 111.29 -178.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -57.53 -37.69 73.48 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 123.168 0.587 . . . . 0.0 112.511 179.921 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 63.5 m-85 -66.25 -44.26 84.2 Favored 'General case' 0 N--CA 1.464 0.227 0 C-N-CA 125.088 1.355 . . . . 0.0 110.424 178.151 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 74.6 mt -64.62 -45.86 94.19 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.437 0 C-N-CA 124.751 1.22 . . . . 0.0 109.51 178.371 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 22.7 mmmt -65.72 -32.47 74.04 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 125.449 1.5 . . . . 0.0 112.712 -175.746 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 6.5 p30 -91.38 -39.02 12.24 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 119.259 0.936 . . . . 0.0 111.763 176.539 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 2.3 t -95.37 -9.17 33.6 Favored 'General case' 0 N--CA 1.474 0.745 0 N-CA-C 115.56 1.689 . . . . 0.0 115.56 -163.66 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 7.1 p30 -61.36 143.84 55.06 Favored 'General case' 0 CA--C 1.55 0.971 0 O-C-N 120.362 -1.461 . . . . 0.0 114.065 -176.401 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 1.9 mpp_? 54.33 17.55 1.57 Allowed 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 127.935 2.494 . . . . 0.0 116.224 -169.353 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.8 tt -136.87 -42.02 0.59 Allowed 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.066 0.946 . . . . 0.0 113.069 -177.977 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -77.31 71.44 2.27 Favored Glycine 0 CA--C 1.534 1.279 0 C-N-CA 124.115 0.864 . . . . 0.0 114.681 -176.553 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 48.4 mtp85 -130.48 -79.11 0.54 Allowed 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 125.038 1.335 . . . . 0.0 111.904 173.129 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 3.1 t -159.29 132.55 7.12 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 124.804 1.242 . . . . 0.0 110.67 -179.903 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 63.2 m-80 -137.93 -0.56 2.08 Favored 'General case' 0 CA--C 1.551 0.996 0 C-N-CA 124.741 1.216 . . . . 0.0 113.633 -175.906 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 2.4 p-10 -100.99 15.75 27.64 Favored 'General case' 0 CA--C 1.549 0.927 0 N-CA-C 115.303 1.594 . . . . 0.0 115.303 -165.056 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -105.99 -1.73 23.64 Favored 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 114.988 1.477 . . . . 0.0 114.988 -170.377 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -131.35 14.33 5.06 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 126.131 1.772 . . . . 0.0 114.08 178.739 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 15.4 t -154.73 117.54 4.37 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 125.539 1.536 . . . . 0.0 109.525 178.351 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -141.43 2.23 0.47 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.808 0 N-CA-C 114.202 1.186 . . . . 0.0 114.202 -174.875 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 67.28 5.14 33.43 Favored Glycine 0 CA--C 1.54 1.653 0 O-C-N 120.841 -1.162 . . . . 0.0 115.138 -173.014 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . 0.281 2.9 mp 48.5 37.65 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.549 0.932 0 C-N-CA 127.52 2.328 . . . . 0.0 111.99 -179.9 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 11.3 tp 53.18 25.76 4.54 Favored 'General case' 0 CA--C 1.553 1.059 0 C-N-CA 126.988 2.115 . . . . 0.0 115.272 178.62 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -132.88 64.9 1.6 Allowed 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 125.24 1.416 . . . . 0.0 112.012 -168.091 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 63.2 mm-40 -84.44 -39.24 19.2 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 124.116 0.966 . . . . 0.0 113.165 176.733 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 42.6 59.44 2.76 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 127.082 2.153 . . . . 0.0 115.09 175.46 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 12.3 t -77.23 61.04 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 C-N-CA 126.385 1.874 . . . . 0.0 112.277 -172.017 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 27.5 t -165.39 -42.73 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 125.375 1.47 . . . . 0.0 112.112 176.809 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 46.3 m -126.01 -22.71 4.07 Favored 'General case' 0 N--CA 1.479 0.999 0 N-CA-C 115.055 1.502 . . . . 0.0 115.055 -173.066 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 60.9 mtt -137.53 40.16 2.42 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 124.798 1.239 . . . . 0.0 111.72 -176.244 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 28.5 tt0 -77.2 70.39 3.59 Favored 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 126.168 1.787 . . . . 0.0 112.001 -176.202 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -143.84 149.78 37.48 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.153 1.381 . . . . 0.0 112.706 -178.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -133.95 -26.14 1.55 Allowed 'General case' 0 N--CA 1.483 1.189 0 N-CA-C 114.943 1.461 . . . . 0.0 114.943 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 78.8 p -149.17 160.96 42.9 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 125.201 1.4 . . . . 0.0 112.373 -177.793 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 97.9 mtp -140.21 154.16 46.81 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 125.501 1.52 . . . . 0.0 111.898 -178.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 9.1 t -88.42 167.65 13.3 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 124.5 1.12 . . . . 0.0 112.046 168.648 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 19.4 t-105 . . . . . 0 C--O 1.253 1.243 0 C-N-CA 125.414 1.486 . . . . 0.0 113.104 -170.907 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.543 0 N-CA-C 112.238 -0.345 . . . . 0.0 112.238 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 79.5 p -139.55 160.14 40.55 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 125.802 1.641 . . . . 0.0 111.821 178.181 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 47.7 t60 -146.29 147.56 31.51 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 124.402 1.081 . . . . 0.0 112.188 -176.155 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 11.7 tpt 47.57 59.49 4.1 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 126.346 1.858 . . . . 0.0 114.024 176.311 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -140.78 148.52 40.77 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.315 1.046 . . . . 0.0 113.383 -177.89 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 58.4 m -147.31 134.2 20.19 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 126.251 1.82 . . . . 0.0 110.817 -174.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 95.2 mtp -144.76 137.14 26.26 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 125.359 1.464 . . . . 0.0 110.815 177.444 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 17.6 m-20 -143.3 119.77 6.64 Favored Pre-proline 0 CA--C 1.549 0.924 0 C-N-CA 124.813 1.245 . . . . 0.0 111.405 178.252 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_endo -84.47 -12.1 7.92 Favored 'Trans proline' 0 C--N 1.351 0.661 0 C-N-CA 123.417 2.745 . . . . 0.0 115.173 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -107.9 29.66 7.06 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 125.549 1.539 . . . . 0.0 114.387 -166.601 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -104.66 -6.72 20.17 Favored 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 116.149 1.907 . . . . 0.0 116.149 -173.124 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.14 -28.55 1.71 Allowed 'General case' 0 N--CA 1.481 1.088 0 N-CA-C 117.059 2.244 . . . . 0.0 117.059 -169.482 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.3 pp -134.63 14.14 1.18 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.338 0 C-N-CA 125.545 1.538 . . . . 0.0 113.682 -178.036 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -56.1 114.02 0.59 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.848 0 C-N-CA 124.987 1.315 . . . . 0.0 111.792 -173.213 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -146.91 0.26 0.73 Allowed 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 113.862 1.06 . . . . 0.0 113.862 179.692 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -81.37 2.85 26.58 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 115.372 1.619 . . . . 0.0 115.372 -163.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 13.1 tt -145.31 24.71 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 C-N-CA 125.907 1.683 . . . . 0.0 113.637 -176.804 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 41.4 ttmt -112.72 -54.36 2.63 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 123.835 0.854 . . . . 0.0 113.125 174.158 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 18.4 tptm -163.23 130.95 3.61 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 125.079 1.352 . . . . 0.0 111.663 -172.488 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -155.26 107.38 2.67 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.786 1.234 . . . . 0.0 109.973 170.916 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -155.39 164.68 38.41 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.911 1.284 . . . . 0.0 112.168 178.913 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 69.2 m-80 -93.38 47.53 1.26 Allowed 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 125.504 1.522 . . . . 0.0 112.71 -179.269 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 21.2 t70 56.18 38.07 29.48 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 125.793 1.637 . . . . 0.0 114.713 175.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 24.0 m -77.3 102.03 6.54 Favored 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 113.305 0.854 . . . . 0.0 113.305 -169.451 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 63.75 38.87 96.82 Favored Glycine 0 CA--C 1.533 1.167 0 C-N-CA 124.707 1.146 . . . . 0.0 115.635 167.771 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 14.9 p -133.14 35.31 0.83 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.983 0 C-N-CA 124.958 1.303 . . . . 0.0 112.469 -163.561 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -136.89 169.97 16.88 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 124.771 1.229 . . . . 0.0 113.756 -173.014 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 20.3 mt -87.05 32.36 0.69 Allowed 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 127.697 2.399 . . . . 0.0 113.408 -166.69 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -158.11 141.01 10.74 Favored Pre-proline 0 CA--C 1.548 0.875 0 C-N-CA 125.507 1.523 . . . . 0.0 111.141 -167.583 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -78.68 -29.86 3.35 Favored 'Trans proline' 0 CA--C 1.54 0.794 0 C-N-CA 122.729 2.286 . . . . 0.0 113.364 -177.92 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -157.86 -168.78 2.63 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 126.445 1.898 . . . . 0.0 109.369 179.942 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 8.0 t -75.33 63.02 1.36 Allowed 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 125.105 1.362 . . . . 0.0 111.464 171.257 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 14.1 p -155.24 142.21 13.57 Favored Pre-proline 0 N--CA 1.471 0.615 0 C-N-CA 126.733 2.013 . . . . 0.0 109.75 -172.625 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_endo -77.01 73.38 5.46 Favored 'Trans proline' 0 CA--C 1.539 0.74 0 C-N-CA 122.857 2.371 . . . . 0.0 111.193 173.425 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 36.87 93.41 0.05 OUTLIER Pre-proline 0 CA--C 1.548 0.87 0 C-N-CA 128.757 2.823 . . . . 0.0 115.948 171.398 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -63.92 163.61 24.67 Favored 'Trans proline' 0 CA--C 1.539 0.769 0 C-N-CA 122.117 1.878 . . . . 0.0 112.119 170.572 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 35.8 mmtt -44.08 124.38 3.85 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 125.726 1.61 . . . . 0.0 112.084 177.728 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.8 tt -124.92 125.41 43.9 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.926 1.29 . . . . 0.0 111.609 -170.245 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -131.91 59.22 1.71 Allowed 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.897 1.279 . . . . 0.0 111.685 -168.288 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -118.32 78.37 1.25 Allowed 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 125.691 1.596 . . . . 0.0 110.856 -174.766 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 5.0 mt -132.01 151.51 51.7 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 127.166 2.186 . . . . 0.0 110.136 -177.586 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 73.4 m -72.95 164.02 27.29 Favored 'General case' 0 N--CA 1.479 1.009 0 O-C-N 121.869 -0.519 . . . . 0.0 110.514 170.162 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -55.42 -44.06 75.89 Favored 'General case' 0 N--CA 1.48 1.027 0 O-C-N 120.674 -1.266 . . . . 0.0 113.347 -172.832 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 6.1 pt20 -74.67 -36.75 62.81 Favored 'General case' 0 N--CA 1.47 0.565 0 O-C-N 121.482 -0.761 . . . . 0.0 112.486 174.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 89.7 mt-30 -63.81 -38.7 92.07 Favored 'General case' 0 N--CA 1.466 0.353 0 O-C-N 121.609 -0.682 . . . . 0.0 111.329 177.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 40.8 ttmt -61.91 -42.44 99.09 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 124.29 1.036 . . . . 0.0 111.063 176.763 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 44.5 mt -69.34 -42.44 81.23 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 CA-C-O 118.378 -0.82 . . . . 0.0 111.064 176.868 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 45.6 mt -63.6 -45.5 97.42 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.002 0 CA-C-N 120.278 1.399 . . . . 0.0 110.069 178.32 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -58.51 -48.65 80.11 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 125.301 1.44 . . . . 0.0 110.753 178.099 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -64.05 -52.63 58.51 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 124.461 1.104 . . . . 0.0 112.822 176.156 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.6 mm-40 -60.48 -32.15 71.14 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 118.964 0.802 . . . . 0.0 112.52 -179.456 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.5 t80 -65.71 -55.86 15.12 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 118.716 0.689 . . . . 0.0 110.642 176.939 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 66.6 mt -64.21 -34.59 69.97 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.251 0 C-N-CA 126.786 2.035 . . . . 0.0 111.739 179.205 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -68.82 -38.64 80.0 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 123.486 0.714 . . . . 0.0 111.336 175.705 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -77.42 -38.55 49.45 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.506 0.722 . . . . 0.0 112.548 179.525 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.3 m -108.64 -6.14 10.86 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.162 0 N-CA-C 114.25 1.204 . . . . 0.0 114.25 -174.206 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 86.75 26.02 33.42 Favored Glycine 0 N--CA 1.473 1.161 0 C-N-CA 124.775 1.179 . . . . 0.0 115.316 161.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 54.49 11.22 0.4 Allowed 'General case' 0 CA--C 1.554 1.115 0 C-N-CA 127.602 2.361 . . . . 0.0 115.32 -173.118 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 4.7 pt20 -121.47 -2.34 9.48 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 125.237 1.415 . . . . 0.0 113.546 -170.956 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 53.8 m-80 -125.59 2.73 7.58 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.03 1.332 . . . . 0.0 113.21 174.753 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 18.1 pt -75.16 152.19 6.55 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 CA-C-N 118.443 0.565 . . . . 0.0 111.459 175.214 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -138.81 145.06 39.64 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 124.327 1.051 . . . . 0.0 109.724 178.481 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -60.6 -26.66 67.14 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 119.259 0.936 . . . . 0.0 112.38 -179.296 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -70.27 -41.35 78.67 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.463 0 C-N-CA 126.086 1.754 . . . . 0.0 110.745 175.869 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 73.7 m -81.14 -44.57 17.71 Favored 'General case' 0 C--O 1.222 -0.365 0 O-C-N 121.81 -0.556 . . . . 0.0 109.53 -178.591 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 14.2 tp -61.15 -37.25 82.18 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.76 1.624 . . . . 0.0 111.682 176.214 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.405 ' HA ' HG13 ' A' ' 66' ' ' ILE . 59.7 p -61.42 -24.04 66.25 Favored 'General case' 0 N--CA 1.477 0.879 0 N-CA-C 113.488 0.922 . . . . 0.0 113.488 171.645 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -104.04 -26.54 12.56 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 125.489 1.515 . . . . 0.0 114.236 -175.149 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 60.0 mmtt -64.66 -35.04 79.75 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 125.336 1.454 . . . . 0.0 111.48 173.305 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 6.9 mt -116.39 -2.07 12.15 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 126.274 1.83 . . . . 0.0 112.908 -166.702 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 26.4 m-80 56.11 61.75 2.63 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 126.744 2.018 . . . . 0.0 113.282 -176.547 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.405 HG13 ' HA ' ' A' ' 61' ' ' SER . 0.6 OUTLIER -134.11 176.3 9.21 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 C-N-CA 126.875 2.07 . . . . 0.0 111.441 -173.137 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.4 p -78.72 158.78 28.22 Favored 'General case' 0 N--CA 1.479 1.007 0 O-C-N 121.069 -1.019 . . . . 0.0 111.231 172.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 92.0 t -63.88 -28.56 45.2 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.045 0 O-C-N 121.509 -0.744 . . . . 0.0 111.416 172.863 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -78.74 -38.76 38.01 Favored 'General case' 0 N--CA 1.469 0.497 0 O-C-N 120.923 -1.11 . . . . 0.0 109.722 -177.644 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 5.0 tmtm? -66.54 -47.28 73.38 Favored 'General case' 0 N--CA 1.463 0.213 0 C-N-CA 125.737 1.615 . . . . 0.0 110.615 175.245 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -58.24 -47.71 82.68 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.072 1.349 . . . . 0.0 112.9 172.514 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 35.0 ttmt -69.54 -25.35 63.97 Favored 'General case' 0 N--CA 1.464 0.252 0 O-C-N 120.993 -1.067 . . . . 0.0 111.473 -176.866 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -55.21 -41.44 72.04 Favored 'General case' 0 CA--C 1.545 0.753 0 CA-C-N 118.097 0.408 . . . . 0.0 111.576 173.886 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 53.4 m-85 -65.18 -45.61 84.18 Favored 'General case' 0 C--O 1.221 -0.408 0 C-N-CA 124.68 1.192 . . . . 0.0 111.03 176.089 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 65.3 mt -65.27 -24.87 35.94 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.7 0 C-N-CA 124.128 0.971 . . . . 0.0 111.363 -178.706 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 72.8 mmtt -87.57 -24.87 23.88 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 125.404 1.482 . . . . 0.0 114.547 179.637 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 10.6 p30 -95.28 -42.58 8.46 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 120.463 1.483 . . . . 0.0 112.103 169.087 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 65.0 m -99.64 105.15 16.97 Favored 'General case' 0 C--O 1.231 0.118 0 C-N-CA 124.063 0.945 . . . . 0.0 110.531 179.543 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 -145.5 -75.88 0.21 Allowed 'General case' 0 CA--C 1.539 0.545 0 N-CA-C 113.577 0.954 . . . . 0.0 113.577 -174.866 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 39.7 mmt-85 -86.31 -18.95 30.62 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 124.493 1.117 . . . . 0.0 113.777 -177.434 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 6.7 tt -75.7 -38.38 58.68 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.382 1.473 . . . . 0.0 112.227 -176.805 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 73.46 -158.7 52.78 Favored Glycine 0 CA--C 1.536 1.385 0 C-N-CA 123.907 0.765 . . . . 0.0 113.379 -175.186 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 19.7 mtp85 -150.07 150.78 32.22 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 126.298 1.839 . . . . 0.0 110.43 161.624 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 8.9 t -65.82 121.59 15.39 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 123.564 0.746 . . . . 0.0 110.963 167.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 46.7 m-80 -133.72 -77.38 0.47 Allowed 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.492 1.117 . . . . 0.0 111.799 178.196 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 31.8 t-20 53.63 -166.34 0.08 Allowed 'General case' 0 CA--C 1.559 1.291 0 C-N-CA 125.693 1.597 . . . . 0.0 113.193 -175.208 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 8.7 mp 56.11 36.84 28.11 Favored 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 126.476 1.911 . . . . 0.0 112.912 177.093 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 60.7 pttt -115.97 -5.34 11.99 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 126.097 1.759 . . . . 0.0 114.109 -172.509 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 14.7 t -149.4 124.65 10.16 Favored 'General case' 0 C--O 1.234 0.254 0 C-N-CA 125.208 1.403 . . . . 0.0 109.806 172.387 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -140.09 5.84 0.56 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.779 0 C-N-CA 125.988 1.715 . . . . 0.0 113.11 -177.029 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 67.9 6.87 46.92 Favored Glycine 0 CA--C 1.539 1.567 0 O-C-N 120.835 -1.166 . . . . 0.0 114.733 -171.137 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . 0.259 3.5 mp 51.2 39.19 0.32 Allowed 'Isoleucine or valine' 0 CA--C 1.549 0.938 0 C-N-CA 126.863 2.065 . . . . 0.0 111.536 178.697 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 12.6 tp 51.14 26.89 3.08 Favored 'General case' 0 CA--C 1.553 1.069 0 C-N-CA 127.076 2.15 . . . . 0.0 114.614 -176.757 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -127.38 52.16 1.84 Allowed 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 126.526 1.93 . . . . 0.0 110.895 -172.412 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -132.84 158.72 41.79 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 126.297 1.839 . . . . 0.0 111.706 175.371 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -135.3 113.7 11.52 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 124.844 1.258 . . . . 0.0 110.43 -179.017 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 7.7 t -142.64 151.46 17.81 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 C-N-CA 125.621 1.568 . . . . 0.0 109.95 -174.301 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 38.4 t -138.13 -64.06 0.54 Allowed 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 124.1 0.96 . . . . 0.0 112.456 176.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 15.8 t -65.85 -31.94 73.18 Favored 'General case' 0 N--CA 1.478 0.96 0 O-C-N 121.455 -0.778 . . . . 0.0 113.009 -177.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 98.4 mmm -107.25 18.43 21.66 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.891 1.676 . . . . 0.0 113.106 179.003 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 24.3 tt0 -79.79 53.46 1.64 Allowed 'General case' 0 CA--C 1.553 1.063 0 C-N-CA 124.757 1.223 . . . . 0.0 112.373 -176.144 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 56.32 -179.4 0.04 OUTLIER 'General case' 0 CA--C 1.552 1.05 0 C-N-CA 127.0 2.12 . . . . 0.0 114.713 -170.867 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -149.0 161.25 42.29 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 125.757 1.623 . . . . 0.0 112.081 177.495 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 50.1 p -147.47 -85.23 0.1 Allowed 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.574 1.15 . . . . 0.0 111.881 177.149 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 18.2 ttt -155.59 146.17 22.05 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 125.699 1.6 . . . . 0.0 111.381 179.673 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 9.9 m -81.22 142.1 33.51 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.876 0.871 . . . . 0.0 111.009 171.44 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 28.1 t-105 . . . . . 0 C--O 1.254 1.314 0 C-N-CA 125.646 1.579 . . . . 0.0 113.06 -175.9 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.653 0 N-CA-C 111.893 -0.483 . . . . 0.0 111.893 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 24.4 m -79.31 58.08 2.49 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 125.655 1.582 . . . . 0.0 114.059 -170.783 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 9.5 m170 -77.19 115.08 16.67 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 124.4 1.08 . . . . 0.0 111.024 177.675 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 59.4 ttp -152.17 143.76 23.5 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 125.662 1.585 . . . . 0.0 110.619 176.456 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -141.88 162.29 35.86 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.05 0.94 . . . . 0.0 113.463 -177.364 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 96.1 p -145.87 150.63 36.49 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 125.713 1.605 . . . . 0.0 112.019 -175.805 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 95.8 mtp -144.16 89.02 1.99 Allowed 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 125.154 1.382 . . . . 0.0 110.151 -175.082 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 -142.51 149.41 50.76 Favored Pre-proline 0 CA--C 1.549 0.905 0 C-N-CA 124.772 1.229 . . . . 0.0 112.422 -174.241 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -78.48 -2.93 12.92 Favored 'Trans proline' 0 C--N 1.353 0.766 0 C-N-CA 124.05 3.167 . . . . 0.0 114.61 178.048 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 94.7 mt -107.86 44.16 1.13 Allowed 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 126.218 1.807 . . . . 0.0 111.526 179.787 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -101.56 -19.04 15.65 Favored 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 114.648 1.351 . . . . 0.0 114.648 176.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.7 -32.37 5.18 Favored 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 115.94 1.83 . . . . 0.0 115.94 -166.267 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.2 pp -132.88 12.06 1.5 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.237 0 C-N-CA 125.011 1.324 . . . . 0.0 113.979 -176.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 14.9 tt -51.44 125.79 5.59 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 C-N-CA 124.805 1.242 . . . . 0.0 112.773 -173.717 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -146.52 -1.71 0.7 Allowed 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 114.154 1.168 . . . . 0.0 114.154 -179.399 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -88.06 9.98 20.69 Favored 'General case' 0 CA--C 1.544 0.715 0 N-CA-C 114.754 1.39 . . . . 0.0 114.754 -169.34 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 14.2 tt -144.08 23.2 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 C-N-CA 126.428 1.891 . . . . 0.0 113.065 -175.181 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 38.1 ttpt -122.93 -39.73 2.48 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 115.108 1.521 . . . . 0.0 115.108 -173.287 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 58.7 tttm -146.7 120.0 8.95 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 125.006 1.322 . . . . 0.0 111.876 -175.461 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -141.81 129.46 21.53 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 125.691 1.597 . . . . 0.0 110.605 179.56 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -153.64 6.44 0.34 Allowed 'General case' 0 CA--C 1.549 0.935 0 N-CA-C 115.229 1.566 . . . . 0.0 115.229 -169.557 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 48.6 t30 -111.59 90.48 3.35 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 124.557 1.143 . . . . 0.0 112.243 -169.676 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 5.8 t0 -152.36 161.87 41.99 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 125.228 1.411 . . . . 0.0 111.123 171.207 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 71.1 m -124.46 81.17 1.91 Allowed 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 125.665 1.586 . . . . 0.0 111.368 -173.589 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 88.3 102.09 0.95 Allowed Glycine 0 CA--C 1.531 1.078 0 C-N-CA 125.341 1.448 . . . . 0.0 112.415 179.757 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 45.0 t -117.05 129.27 73.88 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.919 0 C-N-CA 125.347 1.459 . . . . 0.0 110.609 -179.174 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 54.0 -157.77 0.18 Allowed 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 125.822 1.649 . . . . 0.0 113.073 -178.747 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 42.4 mt -116.71 26.13 10.07 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 126.333 1.853 . . . . 0.0 112.669 -171.091 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -151.12 104.12 2.98 Favored Pre-proline 0 CA--C 1.549 0.941 0 C-N-CA 125.612 1.565 . . . . 0.0 110.575 -166.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_endo -78.95 -18.38 11.53 Favored 'Trans proline' 0 CA--C 1.541 0.873 0 C-N-CA 123.222 2.615 . . . . 0.0 113.304 -177.92 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 8.2 tp -148.26 -159.16 0.99 Allowed 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 127.297 2.239 . . . . 0.0 108.285 178.301 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 5.2 t -77.08 52.82 0.92 Allowed 'General case' 0 N--CA 1.479 0.977 0 O-C-N 120.867 -1.146 . . . . 0.0 112.382 174.101 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 8.9 p -157.27 140.53 11.09 Favored Pre-proline 0 CA--C 1.543 0.682 0 C-N-CA 126.387 1.875 . . . . 0.0 110.462 -174.538 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 71.4 Cg_endo -78.76 65.43 8.73 Favored 'Trans proline' 0 CA--C 1.545 1.06 0 C-N-CA 123.738 2.959 . . . . 0.0 111.334 175.799 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 48.1 tptt 62.42 117.59 0.02 OUTLIER Pre-proline 0 N--CA 1.482 1.175 0 C-N-CA 129.048 2.939 . . . . 0.0 114.009 -173.38 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_endo -75.84 148.23 31.87 Favored 'Trans proline' 0 CA--C 1.54 0.782 0 C-N-CA 122.853 2.369 . . . . 0.0 112.041 -178.836 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 55.3 mtmt -68.89 142.33 54.8 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 124.526 1.13 . . . . 0.0 112.781 -176.918 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 51.8 tp -131.03 145.32 52.0 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 126.008 1.723 . . . . 0.0 111.136 -175.255 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -138.23 69.54 1.39 Allowed 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 125.666 1.586 . . . . 0.0 110.381 179.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -134.85 84.93 2.14 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 124.871 1.268 . . . . 0.0 112.063 -176.261 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.1 mt -131.55 152.27 50.9 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 127.543 2.337 . . . . 0.0 109.466 170.658 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 71.1 m -73.38 165.13 25.63 Favored 'General case' 0 N--CA 1.48 1.059 0 O-C-N 121.883 -0.511 . . . . 0.0 110.644 169.879 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -55.77 -43.48 76.79 Favored 'General case' 0 N--CA 1.48 1.058 0 O-C-N 120.588 -1.32 . . . . 0.0 113.382 -174.586 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 12.7 tt0 -73.64 -41.44 62.75 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 123.374 0.67 . . . . 0.0 111.464 175.111 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 85.8 mt-30 -62.78 -37.89 88.47 Favored 'General case' 0 CA--C 1.535 0.37 0 O-C-N 121.648 -0.658 . . . . 0.0 111.967 179.334 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 19.8 ttmm -59.4 -41.47 89.5 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 124.355 1.062 . . . . 0.0 110.978 174.348 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 43.3 mt -70.01 -42.37 79.5 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.561 0 CA-C-O 118.234 -0.889 . . . . 0.0 111.099 177.715 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 42.6 mt -64.71 -43.88 96.56 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.891 0 CA-C-N 120.467 1.485 . . . . 0.0 110.35 177.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -57.24 -49.18 76.85 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.955 1.302 . . . . 0.0 110.254 177.386 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -65.45 -52.22 54.66 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 124.256 1.022 . . . . 0.0 112.854 177.272 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.0 mm-40 -60.58 -27.56 67.8 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 119.165 0.893 . . . . 0.0 113.038 -178.91 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -70.89 -57.4 4.63 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 123.714 0.806 . . . . 0.0 111.153 176.186 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 75.6 mt -60.3 -34.26 56.81 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.49 0 C-N-CA 126.657 1.983 . . . . 0.0 111.338 176.744 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -70.69 -24.42 62.67 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 124.12 0.968 . . . . 0.0 113.111 176.032 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -91.25 -32.41 15.76 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.396 1.078 . . . . 0.0 112.621 178.375 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 5.3 m -121.0 -19.81 4.66 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.981 0 N-CA-C 113.992 1.108 . . . . 0.0 113.992 -173.3 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 83.58 141.47 4.58 Favored Glycine 0 CA--C 1.531 1.085 0 C-N-CA 125.034 1.302 . . . . 0.0 112.205 -171.092 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -65.06 -12.82 54.87 Favored 'General case' 0 N--CA 1.477 0.921 0 CA-C-O 122.986 1.374 . . . . 0.0 113.859 -172.611 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 35.3 mt-30 -78.98 -15.78 57.81 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 126.01 1.724 . . . . 0.0 112.976 175.229 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 60.6 m-80 -116.22 -6.16 11.86 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 114.713 1.375 . . . . 0.0 114.713 -173.061 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 15.5 pt -72.82 160.72 5.2 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 C-N-CA 123.753 0.821 . . . . 0.0 111.644 167.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -133.38 146.89 51.67 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 125.025 1.33 . . . . 0.0 110.577 176.004 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -63.05 -28.22 69.94 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.806 0.843 . . . . 0.0 112.135 177.672 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -64.04 -48.8 84.35 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.513 0 C-N-CA 125.275 1.43 . . . . 0.0 109.689 174.574 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 99.3 m -77.68 -40.02 42.91 Favored 'General case' 0 C--O 1.224 -0.277 0 C-N-CA 123.77 0.828 . . . . 0.0 110.721 -176.765 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 17.3 tp -63.44 -37.07 85.89 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.632 1.173 . . . . 0.0 111.774 173.611 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 40.1 t -55.2 -29.56 58.17 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.849 1.259 . . . . 0.0 112.753 169.341 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 59.5 mttm -95.41 -36.33 11.39 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 125.007 1.323 . . . . 0.0 113.569 -178.036 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 10.3 mmtm -61.94 -35.66 79.1 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 125.486 1.514 . . . . 0.0 112.193 -178.856 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.2 mp -115.53 6.67 14.72 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 114.113 1.153 . . . . 0.0 114.113 -176.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 13.9 m-80 57.21 59.11 3.53 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 126.431 1.893 . . . . 0.0 113.214 -179.327 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -125.67 -168.06 0.53 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.789 0 C-N-CA 126.755 2.022 . . . . 0.0 110.982 -172.427 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.5 p -96.35 160.11 14.59 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.311 1.044 . . . . 0.0 110.85 171.052 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 63.9 t -63.66 -28.75 45.63 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.893 0 O-C-N 121.748 -0.595 . . . . 0.0 111.417 173.801 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 44.4 mm-40 -78.55 -39.57 37.39 Favored 'General case' 0 N--CA 1.468 0.431 0 O-C-N 121.046 -1.034 . . . . 0.0 110.123 -179.16 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 5.4 tmtm? -64.38 -47.19 80.18 Favored 'General case' 0 N--CA 1.463 0.181 0 C-N-CA 125.245 1.418 . . . . 0.0 110.604 176.271 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -58.68 -48.14 82.11 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 125.687 1.595 . . . . 0.0 113.233 172.264 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 20.0 ttmm -68.34 -27.64 66.45 Favored 'General case' 0 N--CA 1.466 0.348 0 O-C-N 120.941 -1.1 . . . . 0.0 111.251 -177.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -56.96 -38.75 73.4 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 122.898 0.479 . . . . 0.0 112.152 176.403 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 68.1 m-85 -64.42 -45.43 87.61 Favored 'General case' 0 N--CA 1.464 0.272 0 C-N-CA 125.215 1.406 . . . . 0.0 110.956 175.091 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 81.5 mt -69.53 -26.81 31.92 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.649 0 C-N-CA 125.205 1.402 . . . . 0.0 111.468 -177.319 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 53.9 mtmt -79.56 -37.64 35.94 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.595 1.158 . . . . 0.0 113.21 177.168 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 5.9 p30 -87.67 -41.1 13.61 Favored 'General case' 0 C--N 1.342 0.275 0 CA-C-N 119.431 1.014 . . . . 0.0 111.915 177.642 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 10.7 t -109.94 116.62 31.95 Favored 'General case' 0 C--N 1.339 0.13 0 O-C-N 123.648 0.593 . . . . 0.0 111.499 178.271 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 8.5 t-20 -150.13 -48.71 0.13 Allowed 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 113.525 0.935 . . . . 0.0 113.525 -165.332 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 1.4 mpp_? -111.65 17.34 20.03 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 125.901 1.68 . . . . 0.0 113.328 175.744 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.8 tt -126.01 -61.62 1.22 Allowed 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 125.647 1.579 . . . . 0.0 111.648 -175.199 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 64.32 -108.54 2.32 Favored Glycine 0 CA--C 1.538 1.471 0 CA-C-N 118.553 0.615 . . . . 0.0 112.737 -171.531 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 76.7 mtp85 -112.09 -85.5 0.57 Allowed 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 125.887 1.675 . . . . 0.0 111.916 178.168 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 2.7 t -155.14 107.47 2.71 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 125.278 1.431 . . . . 0.0 109.687 176.616 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 11.3 p30 -155.81 -14.98 0.11 Allowed 'General case' 0 CA--C 1.548 0.902 0 N-CA-C 114.659 1.355 . . . . 0.0 114.659 -171.91 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 60.4 t30 -84.65 159.28 20.61 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.447 1.099 . . . . 0.0 111.907 179.163 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 1.2 tp 63.99 169.45 0.17 Allowed 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 126.061 1.744 . . . . 0.0 113.384 -173.341 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 56.8 pttt -107.25 4.72 26.92 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 126.177 1.791 . . . . 0.0 112.677 -178.245 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 13.7 t -150.74 123.18 8.43 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 126.174 1.79 . . . . 0.0 109.227 172.82 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -140.12 3.11 0.56 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.755 0 C-N-CA 125.048 1.339 . . . . 0.0 113.68 -177.007 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 68.06 9.54 57.21 Favored Glycine 0 CA--C 1.539 1.578 0 O-C-N 120.762 -1.211 . . . . 0.0 114.652 -170.585 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . 0.257 3.5 mp 50.23 41.34 0.35 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.886 0 C-N-CA 127.111 2.164 . . . . 0.0 111.861 176.345 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 11.4 tp 51.99 26.67 3.87 Favored 'General case' 0 CA--C 1.552 1.049 0 C-N-CA 126.729 2.011 . . . . 0.0 114.608 -179.498 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 29.9 mt-30 -122.56 55.78 1.15 Allowed 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 125.98 1.712 . . . . 0.0 111.561 -170.065 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -73.24 151.93 41.22 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 124.881 1.272 . . . . 0.0 111.608 171.677 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -108.03 109.61 21.1 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 124.885 1.274 . . . . 0.0 111.563 -176.643 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 53.4 t -127.86 91.41 1.7 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 C-N-CA 125.671 1.589 . . . . 0.0 109.099 174.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 38.0 t -169.77 -36.54 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 124.777 1.231 . . . . 0.0 111.949 176.658 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 28.1 t -139.82 130.22 25.46 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 125.142 1.377 . . . . 0.0 111.247 177.211 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 76.3 mtm 51.64 46.06 27.13 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 126.438 1.895 . . . . 0.0 113.835 173.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -85.51 4.92 33.64 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 126.328 1.851 . . . . 0.0 114.431 -177.809 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -74.3 163.22 28.07 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 125.529 1.532 . . . . 0.0 114.078 -177.333 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 62.3 mtpt -113.18 154.14 27.17 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 126.344 1.858 . . . . 0.0 112.041 177.202 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 24.9 p -79.67 -51.1 9.67 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.785 1.234 . . . . 0.0 113.188 -179.434 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 74.3 mtm 53.6 -166.25 0.08 Allowed 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 126.41 1.884 . . . . 0.0 113.877 -176.593 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 8.0 t -142.87 162.64 34.93 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 125.122 1.369 . . . . 0.0 112.358 179.378 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 21.1 m-90 . . . . . 0 C--O 1.252 1.216 0 C-N-CA 127.184 2.194 . . . . 0.0 112.167 -175.903 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.552 0 N-CA-C 111.803 -0.519 . . . . 0.0 111.803 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 20.0 m -89.33 -3.8 58.34 Favored 'General case' 0 N--CA 1.479 0.979 0 N-CA-C 115.077 1.51 . . . . 0.0 115.077 -171.551 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 39.6 t60 -75.5 107.91 7.95 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.175 0.99 . . . . 0.0 112.054 -175.784 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 26.8 ptt? -155.21 162.09 41.01 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 125.842 1.657 . . . . 0.0 111.771 176.923 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -136.61 138.85 41.62 Favored 'General case' 0 CA--C 1.539 0.546 0 N-CA-C 112.99 0.737 . . . . 0.0 112.99 172.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 45.1 m -150.81 147.69 27.58 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 126.905 2.082 . . . . 0.0 110.292 -176.483 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 52.0 tpp -142.2 59.01 1.47 Allowed 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 124.614 1.166 . . . . 0.0 111.073 -179.124 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -136.61 149.67 67.95 Favored Pre-proline 0 CA--C 1.547 0.861 0 C-N-CA 125.282 1.433 . . . . 0.0 112.023 -176.428 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_endo -81.84 -12.22 11.02 Favored 'Trans proline' 0 C--N 1.351 0.669 0 C-N-CA 123.297 2.665 . . . . 0.0 114.827 178.326 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 89.0 mt -101.01 47.01 0.92 Allowed 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.748 1.619 . . . . 0.0 113.285 -170.248 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 -105.51 -3.1 22.83 Favored 'General case' 0 N--CA 1.479 1.017 0 N-CA-C 114.795 1.406 . . . . 0.0 114.795 172.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -130.54 -57.32 1.06 Allowed 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 124.339 1.055 . . . . 0.0 113.356 -165.773 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.9 pp -109.1 12.16 8.82 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 C-N-CA 125.923 1.689 . . . . 0.0 112.837 -176.617 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 15.7 tt -46.96 130.09 3.33 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.777 0 C-N-CA 124.817 1.247 . . . . 0.0 112.314 176.113 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -148.79 49.33 1.0 Allowed 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.533 1.133 . . . . 0.0 111.756 -170.895 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 -106.06 11.12 31.84 Favored 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 114.005 1.113 . . . . 0.0 114.005 -175.303 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 7.2 tp -148.98 32.57 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.919 0 C-N-CA 125.589 1.556 . . . . 0.0 113.458 -172.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 3.1 tmtm? -132.35 -53.71 0.96 Allowed 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 123.854 0.861 . . . . 0.0 113.042 -179.449 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 5.0 mptp? 54.88 126.66 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.484 0 C-N-CA 128.225 2.61 . . . . 0.0 113.786 -161.734 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 -138.22 158.66 43.86 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 124.988 1.315 . . . . 0.0 112.857 -179.403 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -91.85 167.31 12.23 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 125.26 1.424 . . . . 0.0 113.146 174.546 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 65.9 m-20 -112.51 157.97 20.47 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.881 1.672 . . . . 0.0 112.436 -179.34 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 27.5 m-20 -80.45 151.2 29.42 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 124.599 1.159 . . . . 0.0 112.378 173.106 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 76.5 p -96.26 -0.08 50.24 Favored 'General case' 0 N--CA 1.477 0.912 0 N-CA-C 115.469 1.655 . . . . 0.0 115.469 -175.692 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -170.29 102.71 0.18 Allowed Glycine 0 CA--C 1.529 0.956 0 O-C-N 121.704 -0.622 . . . . 0.0 112.246 171.392 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 8.2 p -142.76 14.81 0.39 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.148 0 C-N-CA 124.587 1.155 . . . . 0.0 113.671 -172.664 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 2.2 m -133.65 150.52 51.56 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 124.273 1.029 . . . . 0.0 112.933 -166.117 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -100.97 31.37 3.62 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 126.659 1.984 . . . . 0.0 115.314 -175.082 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -108.71 133.49 20.63 Favored Pre-proline 0 CA--C 1.548 0.874 0 C-N-CA 125.615 1.566 . . . . 0.0 111.468 -178.127 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -75.23 -39.24 1.19 Allowed 'Trans proline' 0 CA--C 1.542 0.898 0 C-N-CA 122.094 1.863 . . . . 0.0 113.449 -179.145 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 2.1 tt -154.2 72.82 0.9 Allowed 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 124.872 1.269 . . . . 0.0 110.541 179.471 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 33.1 m 53.69 37.3 25.84 Favored 'General case' 0 N--CA 1.48 1.069 0 N-CA-C 114.985 1.476 . . . . 0.0 114.985 174.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 9.4 p -153.36 145.28 16.82 Favored Pre-proline 0 N--CA 1.474 0.756 0 C-N-CA 125.72 1.608 . . . . 0.0 110.236 -172.847 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 93.7 Cg_endo -77.02 64.96 7.82 Favored 'Trans proline' 0 CA--C 1.548 1.187 0 C-N-CA 123.506 2.804 . . . . 0.0 112.242 177.073 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 39.0 tptt 59.45 113.18 0.02 OUTLIER Pre-proline 0 N--CA 1.483 1.204 0 C-N-CA 129.561 3.145 . . . . 0.0 114.175 -175.919 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 82.6 Cg_endo -76.45 145.42 26.64 Favored 'Trans proline' 0 C--N 1.352 0.713 0 C-N-CA 122.862 2.374 . . . . 0.0 111.568 -176.902 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 64.5 mttp -66.89 135.48 53.92 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 124.128 0.971 . . . . 0.0 111.485 -177.278 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 14.3 tp -137.33 136.67 38.18 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.887 1.675 . . . . 0.0 110.676 -173.214 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -130.78 67.72 1.49 Allowed 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 125.091 1.356 . . . . 0.0 110.837 178.627 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -122.72 86.27 2.55 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.134 1.374 . . . . 0.0 111.889 -173.908 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.2 mt -135.66 151.58 50.35 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 127.225 2.21 . . . . 0.0 109.726 176.465 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 22.8 t -71.48 164.71 25.29 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 123.006 0.523 . . . . 0.0 110.805 170.655 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -56.74 -44.53 81.78 Favored 'General case' 0 N--CA 1.477 0.906 0 O-C-N 120.388 -1.445 . . . . 0.0 113.155 -174.04 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 7.5 pt20 -76.64 -34.72 58.3 Favored 'General case' 0 N--CA 1.47 0.568 0 O-C-N 121.626 -0.671 . . . . 0.0 112.251 174.59 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 89.2 mt-30 -66.0 -39.44 90.3 Favored 'General case' 0 CA--C 1.53 0.207 0 O-C-N 121.693 -0.629 . . . . 0.0 111.535 -179.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 40.8 ttmt -59.6 -42.27 92.23 Favored 'General case' 0 N--CA 1.464 0.248 0 C-N-CA 124.749 1.22 . . . . 0.0 110.621 176.034 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 48.0 mt -68.56 -42.3 83.46 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.481 0 CA-C-O 118.256 -0.878 . . . . 0.0 111.06 177.286 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 40.2 mt -64.47 -44.36 96.97 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 CA-C-N 120.601 1.546 . . . . 0.0 110.335 178.668 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -60.61 -48.78 80.27 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 125.114 1.366 . . . . 0.0 111.128 177.366 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -64.27 -51.36 63.96 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 124.794 1.237 . . . . 0.0 112.49 177.27 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 17.0 mm-40 -61.17 -28.82 69.4 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-N 118.991 0.814 . . . . 0.0 112.545 179.246 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -65.3 -58.55 5.65 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-N 118.944 0.793 . . . . 0.0 110.47 174.434 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.3 mt -62.37 -35.58 70.28 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.363 0 C-N-CA 126.796 2.038 . . . . 0.0 111.796 179.394 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -72.08 -28.04 63.05 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.021 0.928 . . . . 0.0 112.389 178.551 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -86.71 -38.08 17.32 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.146 0.978 . . . . 0.0 112.555 175.429 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.5 m -108.5 -7.06 10.95 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.15 0 N-CA-C 114.664 1.357 . . . . 0.0 114.664 -173.197 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 86.21 27.77 29.84 Favored Glycine 0 CA--C 1.531 1.09 0 C-N-CA 124.732 1.158 . . . . 0.0 115.336 162.488 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 55.38 14.18 1.06 Allowed 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 127.224 2.21 . . . . 0.0 114.895 -176.165 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 5.1 pt20 -124.12 -6.94 7.73 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 125.147 1.379 . . . . 0.0 113.969 -170.449 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 57.2 m-80 -118.74 0.53 11.47 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 124.766 1.226 . . . . 0.0 113.264 174.414 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 23.0 pt -75.96 152.37 6.15 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 C-N-CA 123.271 0.628 . . . . 0.0 112.012 177.519 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -141.48 146.53 36.57 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 125.524 1.529 . . . . 0.0 109.354 176.442 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -62.94 -28.23 69.93 Favored 'General case' 0 C--O 1.222 -0.36 0 C-N-CA 123.743 0.817 . . . . 0.0 112.025 178.455 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -63.55 -43.38 98.25 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.471 0 C-N-CA 125.193 1.397 . . . . 0.0 109.864 174.15 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 81.9 m -83.53 -43.0 16.2 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 123.867 0.867 . . . . 0.0 110.296 -174.18 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 6.2 mt -59.13 -37.19 76.65 Favored 'General case' 0 CA--C 1.539 0.532 0 O-C-N 121.447 -0.783 . . . . 0.0 111.977 169.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.44 ' HA ' HG13 ' A' ' 66' ' ' ILE . 28.7 t -52.31 -33.82 44.09 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 124.055 0.942 . . . . 0.0 111.938 173.179 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -99.2 -29.53 12.78 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 124.729 1.212 . . . . 0.0 113.986 -174.774 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 18.7 mmmt -62.49 -29.13 70.32 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 125.108 1.363 . . . . 0.0 112.817 177.593 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.9 mp -127.34 14.62 7.18 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 124.865 1.266 . . . . 0.0 113.901 -177.51 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . 0.278 8.1 p30 47.12 51.18 13.36 Favored 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 126.211 1.805 . . . . 0.0 113.712 -176.257 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.44 HG13 ' HA ' ' A' ' 61' ' ' SER . 2.7 pt -110.46 -174.88 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 C-N-CA 126.905 2.082 . . . . 0.0 111.253 -177.168 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -84.96 158.55 20.49 Favored 'General case' 0 N--CA 1.477 0.912 0 O-C-N 121.227 -0.92 . . . . 0.0 110.999 170.881 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 95.5 t -63.67 -31.05 51.56 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 O-C-N 121.809 -0.557 . . . . 0.0 111.199 170.901 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -74.94 -35.31 62.16 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 119.783 1.174 . . . . 0.0 110.367 178.511 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 22.2 tttt -65.56 -48.9 70.83 Favored 'General case' 0 C--N 1.342 0.257 0 C-N-CA 123.279 0.631 . . . . 0.0 110.833 175.489 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -58.28 -41.46 84.42 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.917 1.687 . . . . 0.0 113.087 175.942 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 37.2 ttmt -74.13 -30.4 62.28 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 125.472 1.509 . . . . 0.0 111.6 -178.714 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -56.54 -42.92 79.31 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 122.85 0.46 . . . . 0.0 111.772 177.242 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 53.5 m-85 -64.53 -42.57 95.66 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 125.006 1.323 . . . . 0.0 111.004 178.495 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 74.0 mt -65.56 -38.98 83.69 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.477 0 C-N-CA 124.05 0.94 . . . . 0.0 110.672 178.817 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 71.3 mmtt -72.6 -40.72 66.32 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 124.761 1.224 . . . . 0.0 112.969 -177.403 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 4.7 p30 -87.53 -38.73 15.76 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 118.636 0.653 . . . . 0.0 111.208 -178.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -93.37 26.42 2.97 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 114.964 1.468 . . . . 0.0 114.964 -166.852 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -81.84 -36.85 27.84 Favored 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 114.139 1.162 . . . . 0.0 114.139 -169.106 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 2.5 mpt_? -73.58 -10.7 59.98 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 124.857 1.263 . . . . 0.0 113.323 -178.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 9.5 tt -68.6 -31.85 71.33 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 125.177 1.391 . . . . 0.0 111.86 169.269 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -91.05 -120.57 2.37 Favored Glycine 0 CA--C 1.535 1.317 0 C-N-CA 125.338 1.447 . . . . 0.0 112.817 175.52 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -117.45 -89.26 0.59 Allowed 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 125.639 1.576 . . . . 0.0 111.413 -177.739 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 4.5 t -159.86 98.23 1.33 Allowed 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 125.075 1.35 . . . . 0.0 110.49 176.756 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 64.8 m-80 -144.67 49.1 1.31 Allowed 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 125.591 1.557 . . . . 0.0 111.974 -171.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 35.2 t-20 -127.58 -178.18 4.37 Favored 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 125.727 1.611 . . . . 0.0 110.573 175.023 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 5.8 tp 60.86 25.73 15.63 Favored 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 126.663 1.985 . . . . 0.0 114.13 179.549 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 65.4 pttt -129.57 8.48 5.4 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 126.527 1.931 . . . . 0.0 114.496 -178.388 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 11.5 t -154.9 129.69 9.33 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 125.549 1.54 . . . . 0.0 109.703 173.566 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -137.67 2.02 0.75 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.688 0 C-N-CA 125.799 1.639 . . . . 0.0 113.722 179.628 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 68.82 10.22 60.81 Favored Glycine 0 CA--C 1.539 1.586 0 O-C-N 120.884 -1.135 . . . . 0.0 114.465 -171.811 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . 0.262 3.2 mp 50.4 40.7 0.35 Allowed 'Isoleucine or valine' 0 CA--C 1.549 0.917 0 C-N-CA 127.111 2.164 . . . . 0.0 111.995 176.44 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 11.4 tp 54.03 23.22 3.89 Favored 'General case' 0 CA--C 1.553 1.058 0 C-N-CA 126.55 1.94 . . . . 0.0 114.54 -177.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 36.2 mt-30 -134.91 46.49 2.44 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 127.193 2.197 . . . . 0.0 110.388 -170.298 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -140.92 107.34 5.28 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.17 1.788 . . . . 0.0 109.386 -176.098 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -146.23 31.47 1.01 Allowed 'General case' 0 N--CA 1.479 0.984 0 N-CA-C 115.503 1.668 . . . . 0.0 115.503 -166.593 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 52.6 t -135.65 117.9 21.43 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 C-N-CA 123.684 0.794 . . . . 0.0 111.937 -175.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 37.8 t -160.54 -72.69 0.07 Allowed 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 123.931 0.892 . . . . 0.0 112.618 176.605 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 25.5 m -73.0 -21.63 60.8 Favored 'General case' 0 N--CA 1.48 1.058 0 N-CA-C 113.806 1.039 . . . . 0.0 113.806 -176.422 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -132.61 136.62 46.64 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 125.957 1.703 . . . . 0.0 110.109 168.257 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -147.47 100.83 3.3 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.791 1.636 . . . . 0.0 108.463 175.814 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -137.59 149.91 47.03 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.757 1.223 . . . . 0.0 112.15 179.569 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -124.56 108.77 12.43 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 125.694 1.598 . . . . 0.0 109.732 175.52 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 10.8 t -151.62 158.25 43.23 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 125.641 1.576 . . . . 0.0 110.794 -178.887 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 74.6 mmm -113.25 163.67 14.5 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 125.169 1.388 . . . . 0.0 113.353 -176.645 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 9.5 t -146.09 153.5 40.77 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 125.998 1.719 . . . . 0.0 111.403 -173.495 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 7.4 t-105 . . . . . 0 C--O 1.254 1.29 0 C-N-CA 127.979 2.512 . . . . 0.0 114.19 179.639 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.498 0 N-CA-C 111.287 -0.725 . . . . 0.0 111.287 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 74.4 p -140.67 159.14 42.85 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 125.993 1.717 . . . . 0.0 111.686 178.477 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 24.9 m170 -92.5 -52.41 4.67 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 123.653 0.781 . . . . 0.0 112.526 -177.126 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 12.8 tpt -156.83 152.47 26.89 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 125.587 1.555 . . . . 0.0 111.464 177.717 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -138.75 159.6 41.72 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.709 1.204 . . . . 0.0 112.359 175.032 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 22.7 t -142.09 128.64 20.22 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 124.975 1.31 . . . . 0.0 110.708 176.584 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 10.4 tpt -155.79 88.81 1.13 Allowed 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 124.518 1.127 . . . . 0.0 110.852 -173.037 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 48.2 m-20 -95.84 148.87 35.24 Favored Pre-proline 0 CA--C 1.549 0.911 0 C-N-CA 124.329 1.051 . . . . 0.0 113.097 -179.745 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 65.4 Cg_endo -84.39 -5.97 10.1 Favored 'Trans proline' 0 C--N 1.351 0.703 0 C-N-CA 123.872 3.048 . . . . 0.0 114.516 174.58 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 97.8 mt -97.72 44.66 1.04 Allowed 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.153 1.381 . . . . 0.0 113.437 -172.414 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -111.33 -1.67 15.94 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 124.729 1.212 . . . . 0.0 114.235 171.298 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.67 -56.21 1.14 Allowed 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 124.489 1.116 . . . . 0.0 113.191 -165.211 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.7 pp -110.74 10.04 8.67 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.784 0 C-N-CA 125.848 1.659 . . . . 0.0 112.914 -178.134 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 13.3 tt -50.32 133.73 10.24 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 C-N-CA 124.189 0.996 . . . . 0.0 112.392 176.424 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 6.5 t30 -140.17 12.39 2.4 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 124.99 1.316 . . . . 0.0 113.195 -176.732 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -79.57 10.17 4.2 Favored 'General case' 0 CA--C 1.546 0.805 0 N-CA-C 115.029 1.492 . . . . 0.0 115.029 -169.468 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 13.9 tt -139.68 20.57 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 C-N-CA 127.247 2.219 . . . . 0.0 112.579 176.672 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 1.5 tmtp? -117.96 -42.23 2.84 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 124.367 1.067 . . . . 0.0 113.603 -176.112 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 41.7 tptt -135.88 114.18 11.56 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 125.104 1.362 . . . . 0.0 110.976 -179.438 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 14.6 pt-20 -159.7 169.78 22.97 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 125.974 1.71 . . . . 0.0 111.577 -173.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -73.42 161.19 30.71 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 123.589 0.755 . . . . 0.0 112.766 174.338 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 53.3 t-20 -143.39 120.98 11.77 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 124.47 1.108 . . . . 0.0 111.34 -177.71 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 20.3 m-20 -135.06 25.11 3.58 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 125.668 1.587 . . . . 0.0 112.17 176.172 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 35.6 m -79.1 -0.61 32.28 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 115.234 1.568 . . . . 0.0 115.234 -169.642 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -168.58 105.02 0.22 Allowed Glycine 0 CA--C 1.533 1.167 0 C-N-CA 124.119 0.866 . . . . 0.0 111.906 166.863 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 5.1 p -125.35 7.98 4.31 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.295 0 C-N-CA 125.196 1.398 . . . . 0.0 113.919 -174.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 3.9 m -112.73 139.02 48.69 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 124.164 0.986 . . . . 0.0 112.55 -163.378 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -71.86 38.6 0.07 Allowed 'General case' 0 CA--C 1.551 1.007 0 C-N-CA 126.593 1.957 . . . . 0.0 115.196 178.766 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -137.28 151.35 71.38 Favored Pre-proline 0 CA--C 1.549 0.912 0 C-N-CA 125.768 1.627 . . . . 0.0 112.62 -171.626 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_endo -75.34 -24.57 12.18 Favored 'Trans proline' 0 CA--C 1.542 0.891 0 C-N-CA 123.29 2.66 . . . . 0.0 113.515 -179.348 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 8.3 tp -150.65 -165.67 2.33 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 127.137 2.175 . . . . 0.0 108.358 177.464 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 3.7 t -78.12 45.87 0.56 Allowed 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.892 1.277 . . . . 0.0 113.192 177.851 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 7.4 p -157.64 138.92 9.67 Favored Pre-proline 0 N--CA 1.472 0.636 0 C-N-CA 126.694 1.997 . . . . 0.0 109.844 -177.11 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_endo -76.69 71.05 6.2 Favored 'Trans proline' 0 CA--C 1.545 1.071 0 C-N-CA 123.615 2.877 . . . . 0.0 112.183 -176.564 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 53.1 tptt 61.07 108.97 0.03 OUTLIER Pre-proline 0 N--CA 1.481 1.106 0 C-N-CA 129.267 3.027 . . . . 0.0 112.733 -172.753 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 98.7 Cg_endo -72.09 146.36 46.43 Favored 'Trans proline' 0 C--N 1.351 0.691 0 C-N-CA 122.567 2.178 . . . . 0.0 111.55 -177.364 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 9.6 ptmm? -67.11 142.68 57.01 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 112.734 0.642 . . . . 0.0 112.734 -175.231 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 39.2 tp -137.07 136.6 38.51 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 126.075 1.75 . . . . 0.0 109.638 -178.005 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -145.42 50.86 1.21 Allowed 'General case' 0 N--CA 1.471 0.609 0 CA-C-O 123.149 1.452 . . . . 0.0 111.681 -176.3 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -112.4 84.01 1.9 Allowed 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 126.517 1.927 . . . . 0.0 111.154 -173.198 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 2.1 mt -130.28 153.92 48.14 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 127.129 2.172 . . . . 0.0 110.085 176.54 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 15.5 m -72.18 166.66 21.93 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.397 0.679 . . . . 0.0 111.707 176.257 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -57.04 -36.44 70.49 Favored 'General case' 0 N--CA 1.477 0.887 0 N-CA-C 113.951 1.093 . . . . 0.0 113.951 -172.697 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 11.3 tt0 -87.23 -40.9 14.13 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 123.857 0.863 . . . . 0.0 112.253 173.7 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 24.7 mm-40 -53.75 -44.3 69.86 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 124.322 1.049 . . . . 0.0 111.475 176.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 13.7 ptmt -66.0 -32.67 74.29 Favored 'General case' 0 N--CA 1.469 0.507 0 O-C-N 121.561 -0.712 . . . . 0.0 111.926 -179.262 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 49.3 mt -72.82 -43.71 59.93 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 CA-C-N 119.124 0.874 . . . . 0.0 110.864 175.907 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 50.2 mt -60.47 -43.36 94.03 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.978 0 CA-C-N 119.706 1.139 . . . . 0.0 110.362 176.737 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -61.6 -48.54 80.47 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 124.966 1.306 . . . . 0.0 110.958 175.278 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -67.47 -48.84 65.99 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 124.081 0.952 . . . . 0.0 113.033 -178.218 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -61.79 -23.68 66.36 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.707 0.803 . . . . 0.0 113.061 -179.032 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -73.09 -58.72 3.11 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 123.971 0.909 . . . . 0.0 111.141 174.564 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 67.6 mt -57.96 -35.41 51.88 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 C-N-CA 126.869 2.068 . . . . 0.0 111.476 176.267 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -70.21 -22.56 62.91 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 124.256 1.022 . . . . 0.0 113.317 176.644 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -93.72 -31.86 14.26 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.689 1.196 . . . . 0.0 112.719 178.22 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 6.3 m -121.72 -20.65 4.01 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 N-CA-C 113.971 1.101 . . . . 0.0 113.971 -172.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 84.42 142.89 5.69 Favored Glycine 0 CA--C 1.531 1.059 0 C-N-CA 125.047 1.308 . . . . 0.0 112.24 -171.341 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -67.22 -5.89 15.81 Favored 'General case' 0 N--CA 1.479 0.999 0 CA-C-O 122.688 1.232 . . . . 0.0 114.24 -171.207 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 38.8 mt-30 -90.3 -16.25 29.63 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 126.476 1.91 . . . . 0.0 112.753 176.512 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 58.5 m-80 -111.06 -6.03 14.7 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.831 1.252 . . . . 0.0 114.119 -176.336 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 15.5 pt -73.3 161.26 4.97 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 C-N-CA 124.07 0.948 . . . . 0.0 111.42 166.189 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.1 p -131.75 145.49 51.64 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 125.162 1.385 . . . . 0.0 110.495 175.953 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -61.65 -29.88 70.35 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 123.976 0.91 . . . . 0.0 111.844 177.748 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -63.0 -49.07 85.02 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.499 0 C-N-CA 125.316 1.446 . . . . 0.0 109.977 175.261 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 58.5 m -78.48 -42.98 28.2 Favored 'General case' 0 C--O 1.222 -0.357 0 C-N-CA 123.711 0.804 . . . . 0.0 109.854 -175.275 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 20.2 tp -61.5 -36.43 80.5 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.435 1.094 . . . . 0.0 112.17 174.874 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.407 ' HA ' HG13 ' A' ' 66' ' ' ILE . 38.4 t -54.03 -30.72 48.85 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 124.765 1.226 . . . . 0.0 112.725 169.041 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -102.21 -23.98 13.96 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.435 1.494 . . . . 0.0 114.373 -174.724 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 69.9 mmtt -61.5 -39.4 90.84 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 124.582 1.153 . . . . 0.0 110.993 170.429 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 9.2 mt -115.03 4.34 14.68 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 126.666 1.986 . . . . 0.0 113.209 -166.665 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . 0.292 7.4 p30 46.29 57.95 4.92 Favored 'General case' 0 CA--C 1.55 0.943 0 C-N-CA 126.803 2.041 . . . . 0.0 114.085 -175.266 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.407 HG13 ' HA ' ' A' ' 61' ' ' SER . 0.9 OUTLIER -120.83 -168.23 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 C-N-CA 127.386 2.274 . . . . 0.0 111.359 -175.756 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -88.68 156.88 18.75 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.131 0.972 . . . . 0.0 110.867 169.5 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 87.6 t -62.6 -31.58 52.53 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 123.209 0.604 . . . . 0.0 111.345 173.27 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 10.7 mp0 -79.53 -34.41 41.12 Favored 'General case' 0 CA--C 1.532 0.27 0 O-C-N 120.744 -1.222 . . . . 0.0 110.037 -178.317 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 12.2 tmtt? -68.67 -41.82 78.74 Favored 'General case' 0 C--N 1.343 0.304 0 C-N-CA 123.375 0.67 . . . . 0.0 111.306 177.239 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -58.71 -43.53 90.12 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.39 1.476 . . . . 0.0 112.661 169.188 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 37.6 ttpt -69.26 -27.52 65.51 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 125.004 1.322 . . . . 0.0 111.951 -179.346 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -61.47 -34.36 75.32 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 123.321 0.648 . . . . 0.0 112.462 177.661 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 55.9 m-85 -67.18 -45.71 76.13 Favored 'General case' 0 N--CA 1.466 0.348 0 C-N-CA 124.369 1.067 . . . . 0.0 110.528 171.057 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 73.9 mt -65.17 -24.84 36.04 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.834 0 O-C-N 121.135 -0.978 . . . . 0.0 111.675 -179.859 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.412 ' HA ' ' HE3' ' A' ' 76' ' ' LYS . 0.0 OUTLIER -81.78 -37.51 27.04 Favored 'General case' 0 N--CA 1.472 0.655 0 O-C-N 120.248 -1.533 . . . . 0.0 113.291 175.983 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 3.7 p30 -94.77 -39.56 10.22 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 119.807 1.185 . . . . 0.0 112.509 -176.776 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 9.2 m -89.36 -9.31 50.88 Favored 'General case' 0 CA--C 1.538 0.516 0 N-CA-C 114.236 1.198 . . . . 0.0 114.236 -164.376 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 12.7 p30 -65.5 144.47 57.0 Favored 'General case' 0 CA--C 1.546 0.801 0 O-C-N 121.258 -0.901 . . . . 0.0 113.216 -169.228 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 3.7 mpt_? 53.76 23.43 3.74 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 126.379 1.872 . . . . 0.0 115.125 -172.565 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 62.1 tp -143.72 -41.91 0.28 Allowed 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 125.0 1.32 . . . . 0.0 113.739 178.304 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 78.19 -80.89 1.35 Allowed Glycine 0 CA--C 1.532 1.117 0 O-C-N 121.72 -0.613 . . . . 0.0 112.562 -172.568 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 82.0 mtm-85 -136.87 -71.28 0.45 Allowed 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 125.497 1.519 . . . . 0.0 112.702 -175.648 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 4.9 t -164.74 83.85 0.4 Allowed 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 124.733 1.213 . . . . 0.0 109.768 179.499 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 69.1 m-80 -139.8 139.94 36.51 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.633 1.173 . . . . 0.0 111.302 -174.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 45.5 t30 -146.48 148.82 32.63 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 125.458 1.503 . . . . 0.0 111.103 179.496 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 9.3 tp 58.21 21.26 7.91 Favored 'General case' 0 CA--C 1.554 1.113 0 C-N-CA 126.205 1.802 . . . . 0.0 114.625 -179.077 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 18.6 ptmt -144.58 10.03 1.4 Allowed 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 126.102 1.761 . . . . 0.0 114.357 -173.5 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 12.3 t -156.68 129.68 7.87 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 125.932 1.693 . . . . 0.0 109.434 -179.361 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -137.81 0.89 0.74 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.75 0 C-N-CA 125.46 1.504 . . . . 0.0 114.176 -176.997 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 82.73 -8.13 63.48 Favored Glycine 0 N--CA 1.477 1.367 0 O-C-N 120.867 -1.146 . . . . 0.0 114.903 -167.764 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 4.5 mp 54.75 80.23 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 C-N-CA 126.953 2.101 . . . . 0.0 110.319 -174.47 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 8.7 mp -53.07 101.39 0.04 OUTLIER 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 126.555 1.942 . . . . 0.0 111.619 -169.39 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 6.5 pt20 -127.6 -8.64 5.66 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 125.856 1.663 . . . . 0.0 114.08 -177.861 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -68.85 146.9 52.45 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 125.364 1.466 . . . . 0.0 112.726 -177.895 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -99.4 105.56 17.53 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 124.595 1.158 . . . . 0.0 110.493 177.397 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 57.3 t -133.9 100.62 3.42 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.574 0 C-N-CA 125.199 1.4 . . . . 0.0 109.526 174.134 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 43.1 t -166.54 -73.1 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.428 1.091 . . . . 0.0 111.834 171.779 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 18.1 t -84.94 -32.69 22.94 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 124.095 0.958 . . . . 0.0 112.838 -176.502 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -126.06 125.46 42.65 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 125.836 1.654 . . . . 0.0 110.274 175.807 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -152.64 105.91 3.03 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 125.653 1.581 . . . . 0.0 108.254 173.47 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -144.78 -41.49 0.25 Allowed 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 116.009 1.855 . . . . 0.0 116.009 179.388 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 46.8 mmtm -140.58 35.42 1.83 Allowed 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 126.611 1.964 . . . . 0.0 113.204 -173.443 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 58.3 p -92.69 -0.73 57.25 Favored 'General case' 0 N--CA 1.478 0.956 0 N-CA-C 115.002 1.482 . . . . 0.0 115.002 -177.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 64.5 mtt -70.83 157.27 38.39 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.802 1.241 . . . . 0.0 113.501 179.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 10.9 t -108.4 166.8 10.5 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 125.547 1.539 . . . . 0.0 111.711 169.677 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 33.8 t-105 . . . . . 0 C--O 1.254 1.307 0 C-N-CA 125.676 1.59 . . . . 0.0 112.902 -171.523 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.587 0 N-CA-C 112.062 -0.415 . . . . 0.0 112.062 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 51.1 p -135.55 -73.95 0.45 Allowed 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 124.705 1.202 . . . . 0.0 112.727 -178.154 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 13.7 t-80 -149.02 59.92 1.05 Allowed 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 125.138 1.375 . . . . 0.0 111.832 -176.854 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 62.7 ttp -144.2 139.06 28.5 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 125.127 1.371 . . . . 0.0 111.563 178.911 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -145.89 153.69 41.13 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.454 1.102 . . . . 0.0 112.978 175.723 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 58.5 m -146.8 151.57 37.35 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 126.627 1.971 . . . . 0.0 110.919 -175.571 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -142.79 114.94 8.34 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 124.211 1.005 . . . . 0.0 110.635 177.467 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 58.7 m-20 38.11 55.61 4.47 Favored Pre-proline 0 CA--C 1.555 1.154 0 C-N-CA 127.721 2.409 . . . . 0.0 115.183 -177.711 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_endo -80.42 -7.5 13.82 Favored 'Trans proline' 0 C--N 1.351 0.683 0 C-N-CA 123.034 2.489 . . . . 0.0 114.907 -170.53 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -133.65 23.62 3.99 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 125.307 1.443 . . . . 0.0 114.594 -173.633 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -111.27 0.3 16.67 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 114.59 1.33 . . . . 0.0 114.59 -168.92 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -136.69 -30.13 0.91 Allowed 'General case' 0 N--CA 1.477 0.886 0 N-CA-C 116.442 2.016 . . . . 0.0 116.442 -164.726 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.2 pp -136.93 11.78 0.83 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.29 0 C-N-CA 125.427 1.491 . . . . 0.0 113.848 -177.833 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 19.0 tt -45.89 107.39 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.926 0 C-N-CA 126.246 1.818 . . . . 0.0 114.654 -163.596 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 21.7 t-20 -161.58 104.48 1.23 Allowed 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 125.683 1.593 . . . . 0.0 110.537 175.793 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -149.4 9.56 0.74 Allowed 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 114.477 1.288 . . . . 0.0 114.477 175.786 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 12.7 tt -151.06 27.65 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.164 0 C-N-CA 124.548 1.139 . . . . 0.0 113.83 -169.827 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 58.1 tttp -141.09 -40.37 0.4 Allowed 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 124.353 1.061 . . . . 0.0 113.362 -177.467 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 52.9 mttp -137.31 157.51 46.46 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 127.29 2.236 . . . . 0.0 112.151 174.779 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -148.39 149.16 31.27 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 126.503 1.921 . . . . 0.0 110.058 175.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -138.53 173.53 11.5 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.875 1.27 . . . . 0.0 112.554 177.32 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 68.5 m-80 -129.86 159.28 37.05 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 126.091 1.757 . . . . 0.0 111.755 -176.447 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -140.95 162.23 35.97 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 124.947 1.299 . . . . 0.0 112.106 171.388 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 61.5 p -128.98 33.1 4.65 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 125.627 1.571 . . . . 0.0 112.999 -178.451 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 77.56 46.06 10.28 Favored Glycine 0 CA--C 1.531 1.091 0 C-N-CA 123.81 0.719 . . . . 0.0 113.497 -179.763 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 2.6 p -108.64 106.31 20.45 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 C-N-CA 126.474 1.91 . . . . 0.0 110.651 -174.761 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -155.93 167.86 29.07 Favored 'General case' 0 N--CA 1.476 0.863 0 CA-C-O 122.141 0.972 . . . . 0.0 113.454 -178.881 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 5.2 mt -98.65 33.89 2.17 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 126.741 2.017 . . . . 0.0 111.918 -167.037 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -160.95 161.69 23.76 Favored Pre-proline 0 CA--C 1.551 0.987 0 C-N-CA 125.588 1.555 . . . . 0.0 111.727 -162.352 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -68.16 48.25 0.4 Allowed 'Trans proline' 0 CA--C 1.553 1.437 1 C-N-CA 125.771 4.314 . . . . 0.0 115.047 173.988 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 28.5 tp -86.49 104.26 15.79 Favored 'General case' 0 CA--C 1.538 0.488 0 O-C-N 120.375 -1.453 . . . . 0.0 109.787 174.698 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 1.4 t 55.39 34.16 22.36 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 125.251 1.421 . . . . 0.0 114.255 -175.077 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 8.0 p -155.93 143.67 14.1 Favored Pre-proline 0 N--CA 1.471 0.597 0 C-N-CA 125.943 1.697 . . . . 0.0 109.619 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 94.3 Cg_endo -76.43 60.99 6.64 Favored 'Trans proline' 0 CA--C 1.545 1.064 0 C-N-CA 123.701 2.934 . . . . 0.0 112.047 177.661 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 63.06 129.25 0.02 OUTLIER Pre-proline 0 N--CA 1.481 1.108 0 C-N-CA 128.954 2.902 . . . . 0.0 113.924 -175.602 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -77.93 163.37 28.56 Favored 'Trans proline' 0 CA--C 1.54 0.806 0 C-N-CA 123.051 2.501 . . . . 0.0 112.46 172.94 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -114.55 109.89 18.96 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 125.503 1.521 . . . . 0.0 110.278 174.449 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -146.83 143.54 28.67 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.691 1.196 . . . . 0.0 113.943 -178.72 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 17.0 mm-40 -137.14 57.95 1.73 Allowed 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 126.766 2.027 . . . . 0.0 109.573 179.218 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -130.03 98.09 4.66 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 124.948 1.299 . . . . 0.0 111.595 -174.545 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.2 mp -120.09 162.05 19.94 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 127.246 2.218 . . . . 0.0 110.909 173.429 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 19.3 t -70.04 165.4 21.95 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 122.781 0.432 . . . . 0.0 110.472 170.547 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -56.45 -46.09 80.5 Favored 'General case' 0 N--CA 1.476 0.84 0 O-C-N 120.388 -1.445 . . . . 0.0 112.933 -173.188 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 9.2 tt0 -72.93 -43.0 62.9 Favored 'General case' 0 CA--C 1.539 0.523 0 O-C-N 121.41 -0.806 . . . . 0.0 111.418 177.686 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 36.7 mm-40 -55.1 -44.44 74.94 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.659 1.184 . . . . 0.0 111.233 175.664 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 42.0 ttmt -62.95 -44.0 97.26 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 125.171 1.388 . . . . 0.0 111.58 177.53 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 54.0 mt -65.95 -41.97 90.9 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 CA-C-N 119.12 0.873 . . . . 0.0 111.134 178.031 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 37.9 mt -66.67 -42.26 89.38 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.885 0 CA-C-N 120.291 1.405 . . . . 0.0 110.512 179.001 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -60.11 -47.26 86.64 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.033 0.933 . . . . 0.0 110.898 175.614 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -68.01 -49.85 59.08 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 124.819 1.248 . . . . 0.0 112.217 -179.931 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -64.27 -23.49 67.32 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 119.209 0.913 . . . . 0.0 112.976 -176.953 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -71.31 -59.68 2.64 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.388 1.075 . . . . 0.0 110.792 173.226 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 62.9 mt -62.5 -34.68 66.09 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.256 0 C-N-CA 127.417 2.287 . . . . 0.0 111.953 -179.625 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -68.58 -33.46 74.1 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 123.784 0.834 . . . . 0.0 111.989 176.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -85.36 -38.18 19.04 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.696 0.799 . . . . 0.0 112.3 179.068 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.0 m -108.39 -5.45 10.68 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.126 0 N-CA-C 114.013 1.116 . . . . 0.0 114.013 -173.909 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 87.79 24.63 34.83 Favored Glycine 0 N--CA 1.472 1.09 0 C-N-CA 125.047 1.308 . . . . 0.0 115.73 159.639 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 56.23 10.67 0.66 Allowed 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 127.146 2.178 . . . . 0.0 114.848 -174.014 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 5.2 pt20 -124.87 -5.91 7.41 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 125.564 1.546 . . . . 0.0 113.573 -169.873 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 59.4 m-80 -121.38 2.33 10.24 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.34 1.456 . . . . 0.0 112.577 173.294 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 23.2 pt -74.97 154.19 6.44 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.583 0 C-N-CA 123.048 0.539 . . . . 0.0 111.147 173.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -136.77 142.58 42.99 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 124.972 1.309 . . . . 0.0 109.177 177.465 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -61.57 -26.88 68.24 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 118.958 0.799 . . . . 0.0 112.494 -179.766 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -65.36 -47.69 86.06 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.559 0 C-N-CA 125.313 1.445 . . . . 0.0 109.989 174.3 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 72.5 m -77.75 -43.11 31.84 Favored 'General case' 0 C--O 1.221 -0.402 0 N-CA-C 109.411 -0.589 . . . . 0.0 109.411 -176.814 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 16.5 tp -60.71 -37.55 82.07 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 125.105 1.362 . . . . 0.0 112.155 175.143 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.411 ' HA ' HG13 ' A' ' 66' ' ' ILE . 24.3 p -63.11 -20.39 65.32 Favored 'General case' 0 N--CA 1.475 0.797 0 N-CA-C 113.567 0.951 . . . . 0.0 113.567 172.095 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 24.0 mtpp -106.89 -23.36 12.39 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 126.108 1.763 . . . . 0.0 114.474 -176.127 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 65.7 mmtt -66.48 -35.27 79.86 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 125.33 1.452 . . . . 0.0 111.125 170.381 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 14.3 mt -117.65 1.47 12.22 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 126.917 2.087 . . . . 0.0 113.099 -168.621 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 18.6 t30 55.08 61.99 2.7 Favored 'General case' 0 CA--C 1.553 1.066 0 C-N-CA 124.701 1.2 . . . . 0.0 112.296 176.655 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.411 HG13 ' HA ' ' A' ' 61' ' ' SER . 0.6 OUTLIER -137.91 178.08 4.81 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.782 0 C-N-CA 127.304 2.241 . . . . 0.0 111.302 -171.378 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 2.6 p -78.09 157.55 29.47 Favored 'General case' 0 N--CA 1.48 1.045 0 O-C-N 120.98 -1.075 . . . . 0.0 111.447 171.806 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 99.3 t -63.38 -29.67 47.84 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 C-N-CA 123.264 0.626 . . . . 0.0 111.365 173.54 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -78.89 -38.72 36.86 Favored 'General case' 0 N--CA 1.468 0.452 0 O-C-N 120.988 -1.07 . . . . 0.0 110.078 -177.794 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 4.1 tmtm? -66.27 -44.91 82.29 Favored 'General case' 0 C--N 1.339 0.137 0 C-N-CA 124.808 1.243 . . . . 0.0 110.856 176.399 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -59.21 -48.8 80.28 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 124.863 1.265 . . . . 0.0 112.738 171.195 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 36.6 ttmt -69.32 -27.42 65.36 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 124.403 1.081 . . . . 0.0 111.4 -175.225 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -53.01 -43.83 66.82 Favored 'General case' 0 CA--C 1.543 0.705 0 CA-C-N 118.154 0.434 . . . . 0.0 111.459 174.227 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 24.8 m-85 -63.05 -42.0 99.61 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 123.432 0.693 . . . . 0.0 111.458 177.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 13.7 mt -66.59 -26.26 37.0 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.651 0 C-N-CA 124.477 1.111 . . . . 0.0 110.996 177.859 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 68.9 mmtt -83.33 -25.63 31.3 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 125.774 1.629 . . . . 0.0 114.711 178.249 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 25.7 p30 -113.5 -41.89 3.56 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-N 120.131 1.332 . . . . 0.0 113.513 -178.521 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 2.3 t -80.41 -7.66 59.21 Favored 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 114.676 1.362 . . . . 0.0 114.676 -173.575 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 17.3 p30 -62.57 -10.01 10.69 Favored 'General case' 0 CA--C 1.549 0.919 0 N-CA-C 115.837 1.791 . . . . 0.0 115.837 -176.683 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 8.1 mpt_? -75.04 -23.87 58.21 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 124.931 1.292 . . . . 0.0 113.68 172.611 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 4.1 mt -84.76 -53.46 5.34 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 113.774 1.027 . . . . 0.0 113.774 -171.672 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -79.97 133.1 11.94 Favored Glycine 0 CA--C 1.535 1.295 0 O-C-N 122.092 -0.38 . . . . 0.0 112.877 -175.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 31.9 mmm180 -133.96 -97.11 0.27 Allowed 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 125.386 1.474 . . . . 0.0 112.462 -177.403 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 13.1 t -154.19 55.69 0.71 Allowed 'General case' 0 N--CA 1.481 1.084 0 CA-C-O 123.015 1.388 . . . . 0.0 111.839 -169.658 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 70.6 m-80 -113.86 12.4 18.16 Favored 'General case' 0 CA--C 1.549 0.928 0 N-CA-C 114.453 1.279 . . . . 0.0 114.453 -170.325 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 5.1 t30 -107.31 92.97 4.3 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 125.207 1.403 . . . . 0.0 110.692 178.795 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -139.44 165.49 27.07 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 127.096 2.158 . . . . 0.0 110.109 -175.502 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 58.5 pttt -131.83 13.29 4.84 Favored 'General case' 0 N--CA 1.481 1.116 0 N-CA-C 115.102 1.519 . . . . 0.0 115.102 -166.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 7.0 t -129.11 42.5 3.3 Favored 'General case' 0 N--CA 1.481 1.075 0 CA-C-O 123.47 1.605 . . . . 0.0 112.743 -172.759 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . 0.476 ' H ' HD11 ' A' ' 90' ' ' ILE . 0.2 OUTLIER -90.61 2.67 7.27 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 N-CA-C 114.351 1.241 . . . . 0.0 114.351 -167.446 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 68.08 4.78 37.27 Favored Glycine 0 CA--C 1.535 1.307 0 C-N-CA 124.068 0.842 . . . . 0.0 114.188 -171.107 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . 0.275 20.1 mm 53.96 32.18 0.18 Allowed 'Isoleucine or valine' 0 CA--C 1.552 1.024 0 C-N-CA 126.736 2.014 . . . . 0.0 111.63 175.655 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 12.2 tp 51.15 29.84 5.13 Favored 'General case' 0 CA--C 1.554 1.116 0 C-N-CA 126.674 1.989 . . . . 0.0 114.657 -177.113 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -130.76 21.22 5.03 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.914 1.286 . . . . 0.0 114.317 -175.172 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -74.14 151.33 40.09 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 124.136 0.974 . . . . 0.0 112.976 177.851 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -134.01 110.29 9.56 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 125.115 1.366 . . . . 0.0 110.354 174.275 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 48.6 t -141.69 127.24 18.32 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 C-N-CA 125.038 1.335 . . . . 0.0 110.229 178.291 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 9.7 t -98.94 83.38 2.9 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 124.792 1.237 . . . . 0.0 111.355 175.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 49.2 m 48.87 73.65 0.22 Allowed 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 126.456 1.902 . . . . 0.0 114.569 173.918 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 20.4 mmt 56.35 56.19 5.96 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 125.244 1.417 . . . . 0.0 112.296 -173.066 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 75.0 tt0 -72.42 96.3 1.88 Allowed 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 125.558 1.543 . . . . 0.0 110.284 174.106 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -139.49 159.47 42.1 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 125.309 1.444 . . . . 0.0 112.382 -174.838 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 14.0 mmmm -124.82 104.18 8.48 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 125.65 1.58 . . . . 0.0 110.826 -177.446 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 25.3 t -151.99 123.95 8.06 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 125.563 1.545 . . . . 0.0 110.129 172.698 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 13.1 ttt -158.75 147.03 18.27 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 125.095 1.358 . . . . 0.0 111.288 -176.528 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 11.1 m -71.32 142.95 50.42 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 123.481 0.712 . . . . 0.0 110.58 168.27 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 25.1 t-105 . . . . . 0 C--O 1.253 1.27 0 C-N-CA 125.284 1.434 . . . . 0.0 113.046 -172.049 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.48 0 N-CA-C 110.842 -0.903 . . . . 0.0 110.842 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 45.8 m -140.79 158.82 43.42 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 125.401 1.48 . . . . 0.0 111.774 -175.287 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 38.3 m80 -127.83 144.32 51.09 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 124.997 1.319 . . . . 0.0 111.531 -179.826 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 78.3 mtp 52.75 36.56 21.51 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 125.447 1.499 . . . . 0.0 114.145 179.464 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -151.62 171.79 17.07 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 113.847 1.054 . . . . 0.0 113.847 -170.341 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 88.6 p -138.1 163.83 30.64 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 126.321 1.848 . . . . 0.0 112.383 -176.241 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 76.6 mtm -130.45 133.43 46.31 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 125.651 1.58 . . . . 0.0 110.535 175.473 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -147.12 136.47 11.64 Favored Pre-proline 0 CA--C 1.552 1.032 0 C-N-CA 124.897 1.279 . . . . 0.0 111.838 -176.596 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -81.49 -7.91 12.66 Favored 'Trans proline' 0 C--N 1.352 0.714 0 C-N-CA 123.388 2.725 . . . . 0.0 115.688 -177.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 83.3 mt -102.2 39.21 1.52 Allowed 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.303 1.441 . . . . 0.0 113.276 -173.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 12.6 m-20 -101.93 -3.16 28.29 Favored 'General case' 0 N--CA 1.478 0.962 0 N-CA-C 114.705 1.372 . . . . 0.0 114.705 168.335 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.74 -58.61 1.23 Allowed 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 124.297 1.039 . . . . 0.0 113.445 -164.82 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.8 pp -107.33 9.1 9.42 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 C-N-CA 125.495 1.518 . . . . 0.0 112.906 -177.748 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 10.5 tt -52.42 126.44 8.15 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.727 0 C-N-CA 123.825 0.85 . . . . 0.0 112.13 177.151 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -146.93 -1.25 0.68 Allowed 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 124.386 1.075 . . . . 0.0 113.497 -178.279 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -88.63 12.41 14.78 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 114.818 1.414 . . . . 0.0 114.818 -162.297 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 7.1 tp -143.89 21.95 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 125.62 1.568 . . . . 0.0 113.891 -171.337 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 29.4 mtpp -122.97 -38.51 2.6 Favored 'General case' 0 N--CA 1.479 1.005 0 N-CA-C 115.396 1.628 . . . . 0.0 115.396 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 50.6 tptt 47.96 48.68 17.81 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 125.566 1.546 . . . . 0.0 112.479 -175.342 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 27.1 tt0 -114.64 63.59 0.67 Allowed 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 125.311 1.444 . . . . 0.0 111.271 -169.294 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -142.12 165.19 28.12 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.392 1.477 . . . . 0.0 112.732 -178.893 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -122.92 55.82 1.18 Allowed 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 125.796 1.639 . . . . 0.0 110.923 -175.53 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -134.98 143.92 47.1 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 125.493 1.517 . . . . 0.0 111.452 -178.31 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 2.5 t -134.54 32.56 3.32 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.85 1.26 . . . . 0.0 113.051 -179.762 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 74.98 57.87 4.25 Favored Glycine 0 CA--C 1.531 1.032 0 C-N-CA 124.789 1.185 . . . . 0.0 113.985 174.634 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 7.7 p -97.23 2.62 10.26 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.104 0 C-N-CA 126.188 1.795 . . . . 0.0 113.951 -175.023 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -86.61 160.49 18.9 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 125.746 1.618 . . . . 0.0 113.633 -168.863 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 1.3 pt? -114.37 33.64 5.18 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 126.708 2.003 . . . . 0.0 114.509 -174.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -128.56 133.31 25.03 Favored Pre-proline 0 CA--C 1.547 0.852 0 C-N-CA 125.702 1.601 . . . . 0.0 111.422 -175.517 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -77.19 -36.92 1.19 Allowed 'Trans proline' 0 CA--C 1.541 0.842 0 C-N-CA 122.254 1.97 . . . . 0.0 113.549 -178.113 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 22.5 tp -154.88 69.19 0.72 Allowed 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.931 1.292 . . . . 0.0 111.123 -179.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 50.3 m 55.52 37.59 29.08 Favored 'General case' 0 N--CA 1.48 1.043 0 N-CA-C 114.64 1.348 . . . . 0.0 114.64 175.521 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 7.7 p -153.18 145.28 16.93 Favored Pre-proline 0 N--CA 1.473 0.696 0 C-N-CA 125.931 1.693 . . . . 0.0 110.105 -171.685 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 97.8 Cg_endo -77.37 62.26 7.58 Favored 'Trans proline' 0 CA--C 1.549 1.23 0 C-N-CA 123.511 2.808 . . . . 0.0 112.389 178.095 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 26.2 tptt 59.42 111.19 0.02 OUTLIER Pre-proline 0 N--CA 1.484 1.263 0 C-N-CA 129.397 3.079 . . . . 0.0 113.817 -176.267 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 94.0 Cg_endo -74.54 143.36 30.61 Favored 'Trans proline' 0 CA--C 1.537 0.648 0 C-N-CA 122.61 2.206 . . . . 0.0 111.636 -173.597 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 25.4 pttm -67.55 128.78 37.73 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 123.258 0.623 . . . . 0.0 111.971 -179.408 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 2.6 pp -143.77 152.11 40.83 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 113.868 1.062 . . . . 0.0 113.868 -173.098 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 22.6 mm-40 -141.11 102.04 4.16 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 126.71 2.004 . . . . 0.0 108.815 173.719 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -139.1 78.62 1.68 Allowed 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 124.598 1.159 . . . . 0.0 110.243 -178.256 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 5.2 mt -129.91 155.15 46.51 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 126.989 2.116 . . . . 0.0 110.397 -177.332 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 19.8 t -71.77 166.96 20.93 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 122.759 0.424 . . . . 0.0 110.388 167.271 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -57.0 -45.88 82.71 Favored 'General case' 0 N--CA 1.475 0.796 0 O-C-N 120.571 -1.331 . . . . 0.0 112.589 -175.213 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 10.2 tt0 -72.51 -42.42 64.83 Favored 'General case' 0 N--CA 1.469 0.517 0 O-C-N 121.528 -0.732 . . . . 0.0 111.341 177.416 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 34.7 mm-40 -57.03 -43.11 81.57 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 124.082 0.953 . . . . 0.0 111.109 176.782 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 21.8 ttmm -61.65 -43.0 99.68 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.626 1.17 . . . . 0.0 111.288 177.12 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 49.7 mt -67.37 -40.4 84.65 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 CA-C-O 118.197 -0.906 . . . . 0.0 111.097 177.601 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 35.0 mt -65.46 -44.19 94.33 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.956 0 CA-C-N 120.652 1.569 . . . . 0.0 110.721 177.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -56.56 -48.35 77.54 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.27 1.028 . . . . 0.0 110.544 174.589 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -66.97 -51.9 49.42 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.454 1.101 . . . . 0.0 112.926 -179.7 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -59.12 -27.26 65.44 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 119.25 0.932 . . . . 0.0 113.118 179.849 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -70.95 -58.74 3.28 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 123.415 0.686 . . . . 0.0 111.26 176.469 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 55.5 mt -59.24 -34.54 54.12 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.61 0 C-N-CA 126.26 1.824 . . . . 0.0 111.314 176.481 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -70.19 -22.44 62.94 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 124.209 1.003 . . . . 0.0 113.256 176.146 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -96.14 -29.91 13.81 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.591 1.157 . . . . 0.0 113.097 178.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 7.8 m -121.96 -19.13 4.57 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.002 0 N-CA-C 114.121 1.156 . . . . 0.0 114.121 -175.487 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 82.36 142.06 4.04 Favored Glycine 0 CA--C 1.532 1.146 0 C-N-CA 124.77 1.176 . . . . 0.0 112.199 -171.171 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -65.76 -12.1 51.19 Favored 'General case' 0 N--CA 1.479 0.99 0 O-C-N 121.059 -1.259 . . . . 0.0 113.898 -171.709 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 35.9 mt-30 -77.68 -16.85 58.22 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 126.257 1.823 . . . . 0.0 112.969 174.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 67.0 m-80 -114.37 -6.5 12.92 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 114.642 1.349 . . . . 0.0 114.642 -173.058 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 13.8 pt -74.93 159.63 5.45 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.656 0 C-N-CA 124.09 0.956 . . . . 0.0 111.869 170.097 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.4 p -135.16 145.07 47.43 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 125.248 1.419 . . . . 0.0 110.142 175.284 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -60.47 -30.2 69.53 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 124.044 0.938 . . . . 0.0 112.176 179.041 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -61.95 -42.32 94.31 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.513 0 C-N-CA 125.352 1.461 . . . . 0.0 110.264 175.105 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 86.8 m -88.1 -40.84 13.47 Favored 'General case' 0 C--O 1.223 -0.336 0 C-N-CA 125.152 1.381 . . . . 0.0 109.699 -172.351 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 24.7 tp -60.57 -36.97 79.79 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.915 1.286 . . . . 0.0 111.543 170.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 40.8 t -53.99 -34.09 58.85 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 124.865 1.266 . . . . 0.0 113.154 168.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -97.52 -27.05 14.6 Favored 'General case' 0 C--N 1.329 -0.326 0 C-N-CA 124.578 1.151 . . . . 0.0 113.743 -174.205 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 19.8 mttp -69.36 -33.4 73.02 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 124.219 1.007 . . . . 0.0 112.448 174.374 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 4.5 mp -108.02 -0.85 21.0 Favored 'General case' 0 CA--C 1.541 0.596 0 N-CA-C 114.385 1.254 . . . . 0.0 114.385 -178.641 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 33.8 m-80 54.92 43.91 29.16 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 125.336 1.455 . . . . 0.0 112.587 -173.58 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 9.9 pt -103.16 -171.89 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.674 0 C-N-CA 126.218 1.807 . . . . 0.0 111.246 -178.644 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 43.9 p -85.62 159.44 19.85 Favored 'General case' 0 N--CA 1.471 0.625 0 O-C-N 121.473 -0.767 . . . . 0.0 111.057 165.711 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 58.0 t -60.6 -27.31 40.18 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.978 0 O-C-N 121.407 -0.808 . . . . 0.0 111.398 169.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 4.9 tm-20 -80.57 -40.78 25.23 Favored 'General case' 0 CA--C 1.531 0.249 0 O-C-N 120.609 -1.307 . . . . 0.0 110.168 -173.86 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . 0.367 0.0 OUTLIER -86.94 7.79 25.94 Favored 'General case' 0 C--N 1.348 0.502 0 N-CA-C 113.175 0.806 . . . . 0.0 113.175 173.589 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -94.61 -45.12 7.52 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.827 1.251 . . . . 0.0 111.557 158.071 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt -74.47 -27.86 60.77 Favored 'General case' 0 CA--C 1.519 -0.234 0 C-N-CA 124.86 1.264 . . . . 0.0 111.84 -172.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 31.2 p-10 -56.21 -37.85 70.21 Favored 'General case' 0 CA--C 1.545 0.765 0 N-CA-C 112.906 0.706 . . . . 0.0 112.906 175.813 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 28.7 m-85 -65.86 -48.97 69.79 Favored 'General case' 0 C--O 1.222 -0.372 0 C-N-CA 126.791 2.036 . . . . 0.0 109.889 176.449 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 76.7 mt -64.2 -38.72 83.23 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 C-N-CA 123.859 0.864 . . . . 0.0 110.374 -179.619 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 28.4 mmtm -63.41 -31.41 72.55 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 125.668 1.587 . . . . 0.0 113.448 177.509 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 8.9 p30 -95.53 -35.76 11.55 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 119.817 1.19 . . . . 0.0 112.463 174.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 69.6 m -87.04 -13.04 45.52 Favored 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 116.007 1.854 . . . . 0.0 116.007 -170.57 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 10.5 p30 -57.41 145.46 32.63 Favored 'General case' 0 CA--C 1.549 0.926 0 CA-C-N 119.686 1.13 . . . . 0.0 113.868 -175.282 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 1.9 mpt_? 59.71 -31.69 0.05 Allowed 'General case' 0 N--CA 1.493 1.679 0 C-N-CA 129.091 2.956 . . . . 0.0 115.999 -169.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -84.53 -45.8 12.24 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 126.793 2.037 . . . . 0.0 112.236 -172.89 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -80.79 127.26 7.81 Favored Glycine 0 CA--C 1.534 1.259 0 C-N-CA 123.218 0.437 . . . . 0.0 112.787 -178.241 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 91.8 mtt180 -140.23 177.76 7.76 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 125.559 1.544 . . . . 0.0 112.767 -171.586 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 7.3 t -118.77 21.76 12.32 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 126.028 1.731 . . . . 0.0 114.24 -162.345 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 66.4 m-80 -89.72 125.53 35.31 Favored 'General case' 0 CA--C 1.544 0.737 0 O-C-N 120.542 -1.349 . . . . 0.0 112.031 -179.717 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -153.88 65.07 0.72 Allowed 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 125.136 1.374 . . . . 0.0 110.848 -178.267 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 3.6 mp -127.68 162.81 25.67 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.18 1.392 . . . . 0.0 112.19 -173.593 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 8.7 ptmm? -131.19 14.1 5.13 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 126.456 1.902 . . . . 0.0 114.697 -168.81 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 10.7 t -131.42 41.43 3.31 Favored 'General case' 0 N--CA 1.482 1.137 0 CA-C-O 123.461 1.6 . . . . 0.0 112.727 -170.535 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . 0.465 ' H ' HD11 ' A' ' 90' ' ' ILE . 0.2 OUTLIER -90.84 1.6 8.11 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 N-CA-C 114.792 1.404 . . . . 0.0 114.792 -167.735 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 67.2 5.98 37.21 Favored Glycine 0 CA--C 1.538 1.506 0 O-C-N 121.162 -0.961 . . . . 0.0 114.104 -170.891 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . 0.29 3.3 mp 48.92 39.18 0.32 Allowed 'Isoleucine or valine' 0 CA--C 1.548 0.896 0 C-N-CA 127.188 2.195 . . . . 0.0 111.498 179.79 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 10.2 tp 55.22 20.65 3.54 Favored 'General case' 0 CA--C 1.552 1.033 0 C-N-CA 127.569 2.348 . . . . 0.0 115.711 179.606 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 35.2 mt-30 -137.95 51.63 1.88 Allowed 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 125.497 1.519 . . . . 0.0 112.295 -165.868 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -93.23 7.01 46.07 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 125.203 1.401 . . . . 0.0 113.722 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -103.51 53.05 0.76 Allowed 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 125.648 1.579 . . . . 0.0 113.084 -169.19 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 59.5 t -139.1 140.72 37.72 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 C-N-CA 125.502 1.521 . . . . 0.0 110.491 -179.825 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 21.9 t -130.41 -62.8 0.91 Allowed 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 124.461 1.104 . . . . 0.0 113.157 178.185 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 75.0 m -138.7 102.28 4.54 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 124.5 1.12 . . . . 0.0 111.429 -176.764 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 69.4 mtm 51.37 31.06 6.7 Favored 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 125.869 1.668 . . . . 0.0 113.933 -177.457 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -96.69 -2.29 44.84 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.242 1.417 . . . . 0.0 113.244 -168.093 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -75.27 160.12 30.72 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.246 1.419 . . . . 0.0 112.893 178.758 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 44.7 mmtm -104.01 122.39 45.15 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 125.171 1.388 . . . . 0.0 110.431 173.314 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 78.9 p -154.33 164.78 38.06 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 125.699 1.599 . . . . 0.0 111.84 -177.378 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 66.2 mtt -136.39 171.22 14.8 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 125.537 1.535 . . . . 0.0 112.198 -177.202 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 12.8 t -131.16 164.12 26.21 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 125.714 1.606 . . . . 0.0 111.804 175.765 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 25.1 m-90 . . . . . 0 C--O 1.253 1.264 0 C-N-CA 126.222 1.809 . . . . 0.0 112.564 -172.329 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.617 0 N-CA-C 111.451 -0.66 . . . . 0.0 111.451 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 1.9 t -127.36 15.41 7.17 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 124.979 1.312 . . . . 0.0 113.41 -177.282 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 76.3 m80 -95.78 154.06 17.42 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 125.62 1.568 . . . . 0.0 112.48 -177.958 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 28.0 ttt -143.14 118.52 10.27 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 125.276 1.43 . . . . 0.0 110.537 179.072 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -153.76 160.38 42.25 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 124.87 1.268 . . . . 0.0 112.497 178.958 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 58.7 m -141.72 125.78 17.29 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 125.35 1.46 . . . . 0.0 111.415 -174.359 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 62.7 mtt -144.01 138.01 28.08 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 125.912 1.685 . . . . 0.0 110.111 172.825 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -132.91 57.4 27.92 Favored Pre-proline 0 CA--C 1.555 1.169 0 C-N-CA 124.54 1.136 . . . . 0.0 113.432 -174.909 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_endo -78.12 -4.92 14.78 Favored 'Trans proline' 0 C--N 1.353 0.803 0 C-N-CA 123.391 2.727 . . . . 0.0 115.285 -176.105 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -132.77 35.68 3.56 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.839 1.656 . . . . 0.0 114.018 -175.022 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -104.6 -1.21 26.76 Favored 'General case' 0 N--CA 1.478 0.945 0 N-CA-C 114.547 1.314 . . . . 0.0 114.547 176.302 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -130.07 -58.56 1.07 Allowed 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 124.369 1.068 . . . . 0.0 113.515 -164.124 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.8 pp -107.77 10.2 9.17 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.786 0 C-N-CA 125.631 1.572 . . . . 0.0 113.033 -178.07 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 17.7 tt -47.97 125.5 2.32 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 C-N-CA 124.775 1.23 . . . . 0.0 113.18 179.507 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 21.3 t30 -147.43 0.34 0.68 Allowed 'General case' 0 CA--C 1.543 0.693 0 N-CA-C 114.511 1.3 . . . . 0.0 114.511 -179.788 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -85.31 10.85 11.43 Favored 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 115.02 1.489 . . . . 0.0 115.02 -167.792 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 16.0 tt -144.19 34.59 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 C-N-CA 126.543 1.937 . . . . 0.0 112.049 -177.612 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 33.3 ttmt -123.83 -50.08 1.84 Allowed 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 114.522 1.304 . . . . 0.0 114.522 -173.817 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 68.5 tttt 44.21 52.85 6.94 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 126.328 1.851 . . . . 0.0 113.392 -173.589 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 26.4 tt0 -141.98 155.51 45.45 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 124.511 1.125 . . . . 0.0 112.176 -176.828 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -79.48 -174.68 4.36 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 125.069 1.348 . . . . 0.0 113.876 -179.305 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 50.8 p-10 -126.99 169.59 13.17 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 126.331 1.852 . . . . 0.0 113.2 -176.994 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 20.4 m-20 -131.44 39.74 3.49 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 125.587 1.555 . . . . 0.0 112.748 -173.589 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 71.2 p -81.34 29.45 0.36 Allowed 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 115.645 1.72 . . . . 0.0 115.645 -176.692 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -95.17 -97.67 1.71 Allowed Glycine 0 CA--C 1.534 1.251 0 C-N-CA 125.167 1.365 . . . . 0.0 113.259 175.629 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 84.0 t 59.02 117.97 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.943 0 C-N-CA 129.154 2.982 . . . . 0.0 114.369 -173.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' THR . . . . . 0.461 HG23 ' H ' ' A' ' 22' ' ' LEU . 0.8 OUTLIER 57.12 -157.59 0.28 Allowed 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 125.158 1.383 . . . . 0.0 111.788 178.176 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.461 ' H ' HG23 ' A' ' 21' ' ' THR . 1.0 OUTLIER -123.36 33.11 5.45 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 125.633 1.573 . . . . 0.0 112.655 174.557 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -106.56 139.56 20.47 Favored Pre-proline 0 CA--C 1.548 0.885 0 C-N-CA 126.041 1.737 . . . . 0.0 111.218 -179.645 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -73.74 -34.3 5.59 Favored 'Trans proline' 0 CA--C 1.539 0.752 0 C-N-CA 122.493 2.129 . . . . 0.0 113.272 -178.717 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 15.6 tp -151.03 56.29 0.89 Allowed 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 124.145 0.978 . . . . 0.0 112.418 178.954 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.3 t 56.31 37.48 28.87 Favored 'General case' 0 N--CA 1.479 1.008 0 N-CA-C 114.302 1.223 . . . . 0.0 114.302 178.388 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 8.8 p -154.24 144.24 15.54 Favored Pre-proline 0 N--CA 1.472 0.67 0 C-N-CA 126.281 1.832 . . . . 0.0 109.745 -172.807 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 79.5 Cg_endo -74.25 74.02 3.71 Favored 'Trans proline' 0 CA--C 1.545 1.026 0 C-N-CA 123.306 2.671 . . . . 0.0 112.658 -177.98 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 51.3 tptt 54.65 91.7 0.07 OUTLIER Pre-proline 0 N--CA 1.483 1.224 0 C-N-CA 129.127 2.971 . . . . 0.0 113.542 173.192 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -81.02 154.05 19.35 Favored 'Trans proline' 0 CA--C 1.537 0.67 0 C-N-CA 123.344 2.696 . . . . 0.0 112.694 -167.21 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 36.6 pttt -51.14 132.12 27.9 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 126.365 1.866 . . . . 0.0 112.841 179.463 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 49.5 tp -142.84 141.61 31.63 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 124.908 1.283 . . . . 0.0 112.004 -164.353 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -139.21 113.47 8.86 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 125.152 1.381 . . . . 0.0 109.585 173.938 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -150.64 52.35 0.88 Allowed 'General case' 0 N--CA 1.474 0.773 0 CA-C-O 123.078 1.418 . . . . 0.0 113.606 -176.148 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 5.9 mt -110.68 151.83 27.25 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 126.003 1.721 . . . . 0.0 111.607 -174.444 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 22.7 t -72.16 166.28 22.67 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 123.31 0.644 . . . . 0.0 110.545 167.074 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -55.57 -43.71 76.19 Favored 'General case' 0 N--CA 1.476 0.831 0 O-C-N 120.83 -1.169 . . . . 0.0 112.495 -177.809 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 13.1 tt0 -73.49 -41.76 62.71 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 123.561 0.744 . . . . 0.0 111.315 176.22 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 84.4 mt-30 -63.07 -38.35 90.84 Favored 'General case' 0 N--CA 1.466 0.335 0 O-C-N 121.698 -0.626 . . . . 0.0 111.94 179.58 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 20.9 ttmm -59.3 -42.19 90.74 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 123.975 0.91 . . . . 0.0 110.748 174.171 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 46.2 mt -69.61 -42.12 80.45 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 CA-C-O 118.036 -0.983 . . . . 0.0 111.361 178.129 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 40.4 mt -64.47 -43.84 96.95 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 CA-C-N 120.644 1.565 . . . . 0.0 110.174 177.997 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -57.98 -47.51 82.76 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.886 1.275 . . . . 0.0 110.336 177.281 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -67.22 -52.19 44.14 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.645 1.178 . . . . 0.0 113.429 177.574 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.7 mm-40 -61.18 -26.42 67.7 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-N 119.1 0.864 . . . . 0.0 113.101 -177.947 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -71.93 -55.71 6.99 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 123.981 0.912 . . . . 0.0 111.21 175.492 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 55.8 mt -58.5 -35.82 56.31 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.589 0 C-N-CA 125.387 1.475 . . . . 0.0 111.168 174.436 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -68.02 -20.78 65.03 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 124.104 0.962 . . . . 0.0 113.326 177.078 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -96.33 -28.15 14.62 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.812 1.245 . . . . 0.0 113.231 178.437 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 9.2 m -126.36 -21.61 2.16 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 N-CA-C 114.376 1.25 . . . . 0.0 114.376 -174.038 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 88.84 141.69 8.17 Favored Glycine 0 CA--C 1.534 1.242 0 C-N-CA 125.633 1.587 . . . . 0.0 112.788 -172.205 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 62.5 tp -60.74 -16.58 41.45 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 125.497 1.519 . . . . 0.0 114.561 -175.395 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -82.83 -18.68 39.56 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.763 1.625 . . . . 0.0 113.079 177.095 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 63.6 m-20 -114.58 -7.69 12.77 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 114.651 1.352 . . . . 0.0 114.651 -170.066 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 26.6 pt -67.32 158.52 5.41 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.42 0 C-N-CA 123.675 0.79 . . . . 0.0 111.265 167.099 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -126.01 146.22 49.98 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 125.086 1.354 . . . . 0.0 111.444 174.916 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -61.68 -27.46 68.7 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.025 0.93 . . . . 0.0 111.975 172.927 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 29.9 mm -63.85 -52.58 55.09 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.444 0 C-N-CA 124.797 1.239 . . . . 0.0 110.567 174.556 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 54.1 m -75.18 -39.33 60.32 Favored 'General case' 0 C--O 1.223 -0.334 0 C-N-CA 123.264 0.625 . . . . 0.0 110.088 -177.749 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 18.1 tp -63.18 -37.04 85.66 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.437 1.095 . . . . 0.0 111.854 175.402 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.401 ' HA ' HG13 ' A' ' 66' ' ' ILE . 44.1 t -53.87 -32.57 53.64 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.951 1.3 . . . . 0.0 112.25 169.411 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -96.98 -31.89 12.3 Favored 'General case' 0 CA--C 1.534 0.351 0 N-CA-C 113.881 1.067 . . . . 0.0 113.881 -176.015 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 47.6 mmtt -60.17 -39.54 86.79 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 125.703 1.601 . . . . 0.0 111.839 178.407 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.3 mp -114.07 15.7 18.3 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 124.753 1.221 . . . . 0.0 113.631 -177.374 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . 0.278 7.5 p30 46.56 55.5 7.52 Favored 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 126.536 1.934 . . . . 0.0 114.037 -177.706 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.401 HG13 ' HA ' ' A' ' 61' ' ' SER . 1.8 pt -119.4 -165.5 0.37 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.761 0 C-N-CA 127.156 2.182 . . . . 0.0 110.958 -174.249 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 5.7 p -98.64 160.38 14.31 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 124.661 1.184 . . . . 0.0 110.901 171.583 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 71.4 t -62.72 -29.66 47.53 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 C-N-CA 123.085 0.554 . . . . 0.0 110.952 173.68 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 58.4 mp0 -77.28 -39.91 46.41 Favored 'General case' 0 CA--C 1.53 0.195 0 O-C-N 121.017 -1.052 . . . . 0.0 109.928 -178.685 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 10.8 tmtt? -66.92 -44.38 80.83 Favored 'General case' 0 C--N 1.341 0.236 0 C-N-CA 124.952 1.301 . . . . 0.0 110.941 178.866 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -58.98 -50.24 74.84 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 126.064 1.746 . . . . 0.0 113.357 170.204 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 21.2 ttmm -69.01 -25.33 64.44 Favored 'General case' 0 N--CA 1.468 0.46 0 O-C-N 120.839 -1.163 . . . . 0.0 111.327 -177.333 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -59.04 -31.7 69.08 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 123.529 0.731 . . . . 0.0 112.608 174.065 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 58.6 m-85 -69.78 -50.21 45.42 Favored 'General case' 0 C--O 1.221 -0.438 0 C-N-CA 124.527 1.131 . . . . 0.0 110.538 170.199 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 84.5 mt -64.15 -25.24 37.61 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.839 0 C-N-CA 124.201 1.0 . . . . 0.0 111.73 -175.589 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 69.0 mmtt -81.54 -25.36 35.94 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 125.461 1.504 . . . . 0.0 114.408 177.741 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 8.6 p30 -97.63 -47.51 5.6 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 119.994 1.27 . . . . 0.0 111.958 170.136 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 65.6 m -93.66 99.65 12.03 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 124.178 0.991 . . . . 0.0 109.339 -178.763 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 4.9 t-20 -143.4 -61.83 0.41 Allowed 'General case' 0 CA--C 1.537 0.477 0 N-CA-C 113.19 0.811 . . . . 0.0 113.19 -172.799 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 37.3 mmt-85 -95.03 -16.07 22.99 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 125.026 1.33 . . . . 0.0 113.246 176.7 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 7.1 tt -82.69 -35.61 26.62 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 124.883 1.273 . . . . 0.0 112.828 -173.095 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 79.1 -174.2 55.3 Favored Glycine 0 CA--C 1.537 1.412 0 CA-C-N 118.373 0.533 . . . . 0.0 112.751 -168.496 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 11.1 mmm-85 -137.32 126.87 25.15 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 125.136 1.374 . . . . 0.0 109.965 175.71 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . 0.301 7.1 t 45.62 39.25 4.75 Favored 'General case' 0 N--CA 1.485 1.291 0 C-N-CA 126.619 1.968 . . . . 0.0 115.025 175.906 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 20.6 m-80 -139.67 152.25 46.57 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.874 1.669 . . . . 0.0 111.818 -177.954 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 3.2 t30 -139.67 102.4 4.43 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.166 1.387 . . . . 0.0 110.269 172.57 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 9.6 tp -144.2 18.46 1.74 Allowed 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 124.762 1.225 . . . . 0.0 112.898 179.766 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 16.6 ptpt -107.55 -12.54 15.26 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 126.399 1.88 . . . . 0.0 113.39 -176.242 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 15.0 t -152.91 120.84 6.12 Favored 'General case' 0 C--O 1.235 0.325 0 C-N-CA 126.072 1.749 . . . . 0.0 109.257 -176.61 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -140.33 9.04 0.54 Allowed 'Isoleucine or valine' 0 CA--C 1.548 0.888 0 C-N-CA 125.318 1.447 . . . . 0.0 112.774 -177.875 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 75.82 -13.85 6.52 Favored Glycine 0 CA--C 1.535 1.298 0 C-N-CA 124.967 1.27 . . . . 0.0 114.838 -167.423 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 4.9 mp 53.48 95.48 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.595 0 C-N-CA 127.376 2.271 . . . . 0.0 109.855 -161.858 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 24.4 tp -70.17 67.46 0.3 Allowed 'General case' 0 CA--C 1.551 1.001 0 C-N-CA 126.239 1.816 . . . . 0.0 113.531 -170.354 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 36.2 mt-30 -139.62 48.62 1.82 Allowed 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 126.107 1.763 . . . . 0.0 112.029 -176.647 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -119.96 72.9 0.95 Allowed 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 125.056 1.342 . . . . 0.0 111.852 -176.459 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -145.91 115.96 7.39 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.463 1.105 . . . . 0.0 110.888 179.449 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 59.9 t -141.12 132.02 27.47 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 C-N-CA 125.199 1.4 . . . . 0.0 110.55 179.027 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 55.1 m -96.77 -50.39 4.69 Favored 'General case' 0 N--CA 1.48 1.06 0 N-CA-C 113.463 0.912 . . . . 0.0 113.463 179.732 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 35.8 t -159.73 -50.38 0.05 Allowed 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 124.708 1.203 . . . . 0.0 112.332 179.982 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 6.0 tpt -121.09 15.74 11.55 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 125.165 1.386 . . . . 0.0 113.068 -174.3 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -83.31 48.75 1.44 Allowed 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 124.867 1.267 . . . . 0.0 112.4 -174.254 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -142.41 155.02 45.08 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.737 1.615 . . . . 0.0 112.268 -175.813 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 4.7 mmpt? -83.48 133.6 34.89 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 124.542 1.137 . . . . 0.0 111.934 178.911 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 77.7 p -152.26 152.59 32.36 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 126.282 1.833 . . . . 0.0 110.287 169.338 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 11.0 ttt -155.72 -62.94 0.11 Allowed 'General case' 0 N--CA 1.474 0.77 0 CA-C-O 121.491 0.662 . . . . 0.0 112.456 -178.569 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 12.4 t -165.35 -177.62 4.59 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 127.787 2.435 . . . . 0.0 109.195 -174.205 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 7.0 t-105 . . . . . 0 C--O 1.252 1.225 0 C-N-CA 125.823 1.649 . . . . 0.0 112.634 -173.81 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.565 0 N-CA-C 111.153 -0.779 . . . . 0.0 111.153 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 2.2 t -139.45 26.4 2.36 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 124.821 1.248 . . . . 0.0 112.528 -179.046 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 71.3 m80 -138.16 144.3 40.68 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 125.441 1.496 . . . . 0.0 111.947 -170.798 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 58.8 ttp -149.7 136.68 19.58 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 125.1 1.36 . . . . 0.0 110.766 172.6 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -146.68 169.4 19.1 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 124.865 1.266 . . . . 0.0 112.06 179.903 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 23.3 t -136.79 143.7 43.33 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 125.123 1.369 . . . . 0.0 111.152 176.008 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.7 mpt? -132.68 108.69 9.2 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 125.217 1.407 . . . . 0.0 110.068 -175.439 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 44.1 m-20 43.9 63.27 8.42 Favored Pre-proline 0 CA--C 1.555 1.162 0 C-N-CA 126.5 1.92 . . . . 0.0 114.778 176.798 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_endo -72.6 -1.78 10.82 Favored 'Trans proline' 0 C--N 1.351 0.664 0 C-N-CA 123.762 2.975 . . . . 0.0 115.266 -175.714 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 88.7 mt -106.82 38.94 1.96 Allowed 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.902 1.681 . . . . 0.0 112.671 -178.983 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -110.53 1.48 18.19 Favored 'General case' 0 N--CA 1.478 0.959 0 N-CA-C 114.574 1.324 . . . . 0.0 114.574 178.589 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.23 -56.74 1.89 Allowed 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 124.632 1.173 . . . . 0.0 113.269 -165.851 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.0 pp -129.13 13.86 2.66 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.862 0 C-N-CA 126.163 1.785 . . . . 0.0 112.9 -173.523 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 10.7 tt -41.77 126.44 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.02 0 C-N-CA 125.423 1.489 . . . . 0.0 113.402 179.322 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -145.0 16.84 1.57 Allowed 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.816 1.247 . . . . 0.0 112.942 179.981 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -82.95 11.21 6.42 Favored 'General case' 0 CA--C 1.545 0.771 0 N-CA-C 114.534 1.309 . . . . 0.0 114.534 -171.737 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 14.0 tt -141.46 24.38 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 126.473 1.909 . . . . 0.0 113.145 -176.503 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 88.9 tttt -132.1 -44.12 0.95 Allowed 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.285 1.034 . . . . 0.0 113.567 179.043 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 9.1 mtmp? 48.37 -151.29 0.13 Allowed 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 126.039 1.735 . . . . 0.0 112.495 -173.499 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -132.68 166.01 23.17 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 126.296 1.838 . . . . 0.0 111.19 172.66 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -134.53 167.83 20.07 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 125.247 1.419 . . . . 0.0 112.955 -177.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 20.2 t30 -143.98 146.88 33.21 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 125.699 1.6 . . . . 0.0 111.636 -178.401 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -145.9 144.34 30.13 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.24 1.416 . . . . 0.0 111.052 174.467 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 25.6 m -112.74 9.18 19.12 Favored 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 115.057 1.503 . . . . 0.0 115.057 -173.287 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 166.8 87.94 0.07 OUTLIER Glycine 0 CA--C 1.531 1.083 0 O-C-N 121.348 -0.845 . . . . 0.0 112.878 173.717 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 7.3 p -82.5 119.15 31.49 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.757 0 C-N-CA 124.064 0.946 . . . . 0.0 111.88 -179.76 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -157.09 171.24 20.81 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 124.307 1.043 . . . . 0.0 112.527 172.722 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 16.9 mt -82.03 31.73 0.38 Allowed 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 127.293 2.237 . . . . 0.0 113.492 -170.229 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -151.53 108.63 2.94 Favored Pre-proline 0 CA--C 1.548 0.888 0 C-N-CA 124.624 1.17 . . . . 0.0 112.145 -161.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -83.99 -30.04 0.82 Allowed 'Trans proline' 0 CA--C 1.541 0.865 0 C-N-CA 122.71 2.273 . . . . 0.0 114.03 -176.631 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 22.9 tp -151.9 66.63 0.86 Allowed 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 124.884 1.274 . . . . 0.0 111.35 -174.824 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 49.2 m 56.08 34.93 24.72 Favored 'General case' 0 N--CA 1.478 0.94 0 N-CA-C 114.639 1.348 . . . . 0.0 114.639 176.006 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 9.3 p -155.04 141.98 13.53 Favored Pre-proline 0 N--CA 1.472 0.665 0 C-N-CA 126.278 1.831 . . . . 0.0 109.424 -173.821 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 95.3 Cg_endo -77.58 65.54 8.08 Favored 'Trans proline' 0 CA--C 1.548 1.197 0 C-N-CA 123.568 2.846 . . . . 0.0 112.384 -177.843 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 38.5 tptt 61.27 113.57 0.02 OUTLIER Pre-proline 0 CA--C 1.555 1.136 0 C-N-CA 129.616 3.167 . . . . 0.0 113.523 -172.652 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -77.85 159.24 31.22 Favored 'Trans proline' 0 C--N 1.352 0.717 0 C-N-CA 123.485 2.79 . . . . 0.0 112.542 -174.726 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 5.7 mptt -73.74 141.24 46.34 Favored 'General case' 0 N--CA 1.478 0.932 0 O-C-N 121.63 -0.669 . . . . 0.0 111.991 178.7 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 54.1 tp -148.29 141.24 24.81 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 125.779 1.632 . . . . 0.0 110.709 -175.464 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -137.14 118.41 14.59 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 125.482 1.513 . . . . 0.0 108.854 165.488 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -144.02 74.39 1.42 Allowed 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 124.587 1.155 . . . . 0.0 109.89 -176.157 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.5 mt -134.74 153.94 51.79 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 126.677 1.991 . . . . 0.0 110.497 -171.393 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 19.0 t -72.1 168.33 18.37 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.088 0.555 . . . . 0.0 110.406 167.298 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -58.65 -45.62 88.92 Favored 'General case' 0 N--CA 1.473 0.695 0 O-C-N 120.25 -1.531 . . . . 0.0 112.607 -174.577 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 9.9 tt0 -71.78 -41.87 67.82 Favored 'General case' 0 N--CA 1.47 0.558 0 O-C-N 121.195 -0.941 . . . . 0.0 111.367 177.344 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 30.6 mm-40 -57.04 -45.32 83.27 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 123.959 0.903 . . . . 0.0 110.72 175.873 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt -60.75 -41.56 95.65 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 124.726 1.21 . . . . 0.0 111.3 178.277 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 51.5 mt -67.54 -41.85 86.26 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 CA-C-O 117.937 -1.03 . . . . 0.0 111.447 177.177 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 36.5 mt -63.8 -44.42 98.21 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 CA-C-N 120.832 1.651 . . . . 0.0 110.072 177.969 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -59.42 -49.21 78.69 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.711 1.204 . . . . 0.0 111.024 177.745 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -64.36 -52.18 59.64 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 124.982 1.313 . . . . 0.0 112.456 177.674 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -60.75 -27.44 67.95 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-N 119.362 0.983 . . . . 0.0 113.027 -179.572 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -69.05 -58.34 4.23 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 123.433 0.693 . . . . 0.0 110.784 174.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 90.8 mt -63.71 -32.68 57.85 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.471 0 C-N-CA 127.016 2.126 . . . . 0.0 111.641 179.572 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -71.48 -25.54 62.31 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.111 0.965 . . . . 0.0 112.713 175.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -90.64 -37.75 13.56 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.188 0.995 . . . . 0.0 112.622 176.233 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.5 m -109.98 -3.41 10.5 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.215 0 N-CA-C 114.371 1.249 . . . . 0.0 114.371 -175.039 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 88.03 10.14 69.6 Favored Glycine 0 N--CA 1.472 1.081 0 C-N-CA 126.096 1.808 . . . . 0.0 116.133 160.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 64.36 4.06 2.05 Favored 'General case' 0 CA--C 1.554 1.116 0 C-N-CA 127.756 2.422 . . . . 0.0 114.677 -164.53 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -85.98 -26.12 25.64 Favored 'General case' 0 N--CA 1.48 1.028 0 O-C-N 120.626 -1.296 . . . . 0.0 113.304 179.631 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 45.6 m-80 -122.63 2.95 9.58 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 113.976 1.102 . . . . 0.0 113.976 -164.85 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 20.5 pt -75.05 155.65 6.26 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.551 0 C-N-CA 123.024 0.53 . . . . 0.0 111.352 174.685 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -139.03 142.18 38.26 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 124.765 1.226 . . . . 0.0 109.304 177.486 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -61.11 -26.51 67.72 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 119.088 0.858 . . . . 0.0 112.439 -179.166 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.9 mp -64.76 -50.88 73.33 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.472 0 C-N-CA 125.555 1.542 . . . . 0.0 109.831 173.778 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 81.1 m -76.3 -41.02 50.0 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 123.849 0.86 . . . . 0.0 110.764 -176.566 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 16.3 tp -61.85 -38.46 88.29 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 125.619 1.568 . . . . 0.0 111.766 174.189 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.422 ' HA ' HG13 ' A' ' 66' ' ' ILE . 39.8 t -56.95 -28.72 62.47 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 124.921 1.288 . . . . 0.0 112.794 170.298 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -100.56 -29.07 12.55 Favored 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 124.789 1.236 . . . . 0.0 114.25 -176.196 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 9.1 mmtm -63.28 -33.61 75.89 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 125.197 1.399 . . . . 0.0 111.715 175.102 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.4 mp -114.43 4.12 15.2 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 125.472 1.509 . . . . 0.0 114.039 -176.584 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 49.2 m-80 53.51 56.66 7.02 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 126.01 1.724 . . . . 0.0 113.366 -179.232 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.422 HG13 ' HA ' ' A' ' 61' ' ' SER . 1.2 pt -125.2 -166.67 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.764 0 C-N-CA 126.885 2.074 . . . . 0.0 110.974 -171.829 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 62.2 p -94.15 155.66 16.96 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 124.514 1.126 . . . . 0.0 111.251 169.915 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 60.6 t -63.93 -24.77 36.58 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 O-C-N 121.628 -0.67 . . . . 0.0 111.086 171.865 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 15.6 mp0 -79.72 -30.33 40.93 Favored 'General case' 0 C--O 1.233 0.209 0 C-N-CA 125.148 1.379 . . . . 0.0 111.124 -174.695 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.16 -32.81 16.48 Favored 'General case' 0 C--N 1.344 0.368 0 CA-C-N 118.156 0.435 . . . . 0.0 111.738 173.978 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -62.14 -46.77 87.5 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 124.239 1.015 . . . . 0.0 111.9 173.149 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 19.9 ptmt -69.0 -24.77 64.26 Favored 'General case' 0 N--CA 1.468 0.449 0 O-C-N 121.296 -0.877 . . . . 0.0 112.121 -176.766 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -60.93 -39.76 90.67 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 120.342 -0.543 . . . . 0.0 110.445 179.247 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 26.4 m-85 -61.48 -38.88 88.88 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 124.609 1.164 . . . . 0.0 112.301 179.752 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 7.3 mt -73.4 -18.11 17.83 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.847 0 C-N-CA 125.852 1.661 . . . . 0.0 111.941 -178.951 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 61.8 tttt -103.52 -33.93 8.86 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 125.678 1.591 . . . . 0.0 110.776 -177.599 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 81.6 m-20 -75.41 -42.98 52.33 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 126.72 2.008 . . . . 0.0 109.838 175.799 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 12.4 t -122.15 129.08 51.99 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 112.789 0.662 . . . . 0.0 112.789 171.476 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 13.0 p30 -149.81 -58.43 0.2 Allowed 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 114.303 1.223 . . . . 0.0 114.303 179.111 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 1.1 mpp_? -85.12 -17.91 35.84 Favored 'General case' 0 N--CA 1.481 1.076 0 N-CA-C 113.615 0.968 . . . . 0.0 113.615 177.731 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 60.0 tp -75.93 -44.43 40.23 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 124.523 1.129 . . . . 0.0 112.738 178.111 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -83.95 113.33 3.71 Favored Glycine 0 CA--C 1.531 1.044 0 N-CA-C 111.124 -0.79 . . . . 0.0 111.124 177.991 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 21.8 mmm-85 -140.47 175.18 9.81 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 125.07 1.348 . . . . 0.0 112.486 -172.492 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 12.6 t -121.34 -5.39 9.37 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 126.427 1.891 . . . . 0.0 114.411 -171.66 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 79.3 m-20 -87.5 159.26 18.71 Favored 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 114.364 1.246 . . . . 0.0 114.364 -167.297 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 42.1 t-20 -132.34 -179.69 5.59 Favored 'General case' 0 CA--C 1.551 1.0 0 C-N-CA 126.853 2.061 . . . . 0.0 110.54 178.441 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 72.8 mt 58.47 32.41 22.08 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 125.995 1.718 . . . . 0.0 113.543 -177.845 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 17.5 ptmt -120.53 5.55 10.61 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 126.424 1.89 . . . . 0.0 114.003 -179.109 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 12.4 t -146.02 120.03 9.4 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 124.722 1.209 . . . . 0.0 110.036 171.868 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -141.5 4.63 0.46 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.784 0 C-N-CA 125.778 1.631 . . . . 0.0 113.19 -177.521 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 69.23 6.69 54.81 Favored Glycine 0 CA--C 1.539 1.566 0 O-C-N 120.693 -1.254 . . . . 0.0 114.762 -169.728 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . 0.281 4.1 mp 54.61 29.16 0.14 Allowed 'Isoleucine or valine' 0 CA--C 1.552 1.046 0 C-N-CA 126.883 2.073 . . . . 0.0 112.033 177.323 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 11.2 tp 54.72 24.0 5.24 Favored 'General case' 0 CA--C 1.553 1.071 0 C-N-CA 126.088 1.755 . . . . 0.0 114.391 -174.691 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 42.0 mt-30 -107.2 53.02 0.7 Allowed 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 126.41 1.884 . . . . 0.0 111.786 -176.605 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -79.69 147.17 32.06 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 124.604 1.162 . . . . 0.0 111.872 173.644 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -145.87 139.86 26.61 Favored 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 125.323 1.449 . . . . 0.0 111.355 175.068 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 95.9 t -138.15 135.13 44.85 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 C-N-CA 126.133 1.773 . . . . 0.0 110.306 179.453 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 19.2 t -154.73 -42.96 0.09 Allowed 'General case' 0 N--CA 1.47 0.529 0 N-CA-C 113.841 1.052 . . . . 0.0 113.841 177.513 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 23.1 p -151.3 117.29 5.54 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-O 122.181 0.991 . . . . 0.0 113.418 -176.187 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 57.9 mtt 54.74 40.97 32.22 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 126.061 1.745 . . . . 0.0 112.983 173.713 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -84.0 3.42 34.45 Favored 'General case' 0 CA--C 1.547 0.828 0 N-CA-C 115.298 1.592 . . . . 0.0 115.298 -163.162 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -133.47 155.37 49.66 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 125.587 1.555 . . . . 0.0 113.167 -174.562 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 33.5 mmtp -127.56 23.36 6.31 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 126.451 1.9 . . . . 0.0 113.515 -176.898 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 21.4 t -125.71 134.96 51.62 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 124.876 1.27 . . . . 0.0 112.282 -177.403 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 87.4 mtp -145.57 169.39 18.5 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 126.872 2.069 . . . . 0.0 111.115 177.448 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 12.1 t -134.05 162.17 32.82 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 125.162 1.385 . . . . 0.0 112.512 177.871 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 13.5 m-90 . . . . . 0 C--O 1.253 1.242 0 C-N-CA 126.808 2.043 . . . . 0.0 112.021 -177.0 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.578 0 N-CA-C 111.163 -0.775 . . . . 0.0 111.163 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 78.9 p -140.86 158.05 44.5 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 125.311 1.444 . . . . 0.0 112.384 179.355 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 34.4 t-80 -150.4 157.25 42.83 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 125.259 1.424 . . . . 0.0 111.027 -179.461 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 63.1 ttp -145.15 134.77 23.34 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 124.821 1.248 . . . . 0.0 111.413 179.585 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . 51.61 -156.93 0.13 Allowed 'General case' 0 CA--C 1.552 1.049 0 C-N-CA 125.907 1.683 . . . . 0.0 113.567 -177.03 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 5.3 t -152.27 151.05 30.44 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 124.398 1.079 . . . . 0.0 111.545 173.491 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 58.5 ttm -152.24 128.88 10.78 Favored 'General case' 0 CA--C 1.537 0.481 0 C-N-CA 124.668 1.187 . . . . 0.0 110.66 174.089 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 25.4 m-20 -127.16 97.62 31.57 Favored Pre-proline 0 CA--C 1.547 0.839 0 C-N-CA 124.922 1.289 . . . . 0.0 111.008 176.217 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 64.8 Cg_endo -83.03 6.87 5.54 Favored 'Trans proline' 0 CA--C 1.539 0.756 0 C-N-CA 123.79 2.993 . . . . 0.0 114.219 179.325 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 92.2 mt -115.55 29.72 7.82 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 125.368 1.467 . . . . 0.0 113.716 -172.734 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -98.02 -1.1 43.36 Favored 'General case' 0 N--CA 1.479 1.024 0 N-CA-C 114.087 1.144 . . . . 0.0 114.087 170.897 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 13.7 ptmt -103.86 -35.38 8.19 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 125.78 1.632 . . . . 0.0 114.78 -171.004 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.3 pp -144.44 -42.12 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.008 0 C-N-CA 125.845 1.658 . . . . 0.0 113.643 -174.324 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . 0.31 10.6 tt 38.27 35.29 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.437 0 N-CA-C 116.283 1.957 . . . . 0.0 116.283 -177.52 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 3.2 t30 55.91 29.07 13.52 Favored 'General case' 0 CA--C 1.552 1.023 0 C-N-CA 125.688 1.595 . . . . 0.0 114.279 -177.744 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 3.2 p-10 -81.2 9.61 6.65 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 116.781 2.141 . . . . 0.0 116.781 -166.11 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 7.1 tp -141.76 18.86 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.835 0 C-N-CA 125.779 1.632 . . . . 0.0 113.733 -175.704 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 13.9 tmtt? -129.34 -30.85 2.11 Favored 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 115.15 1.537 . . . . 0.0 115.15 -175.753 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 22.8 ttmm -133.81 102.73 5.56 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 126.01 1.724 . . . . 0.0 111.017 175.825 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 22.9 tt0 -148.07 25.8 1.01 Allowed 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 124.634 1.173 . . . . 0.0 112.885 179.273 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -88.19 93.71 9.59 Favored 'General case' 0 C--O 1.237 0.41 0 O-C-N 120.161 -1.587 . . . . 0.0 111.903 -177.372 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 53.0 t30 -154.37 130.0 9.96 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 123.356 0.662 . . . . 0.0 111.203 178.357 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 8.8 t0 -137.48 131.75 32.31 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.075 1.35 . . . . 0.0 111.326 177.463 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 40.5 m -121.46 27.83 8.07 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 125.535 1.534 . . . . 0.0 113.165 -179.177 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 88.11 57.86 1.85 Allowed Glycine 0 CA--C 1.528 0.872 0 C-N-CA 124.866 1.222 . . . . 0.0 113.028 178.094 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 14.5 p -116.33 8.89 7.3 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.955 0 C-N-CA 126.429 1.892 . . . . 0.0 112.996 -175.79 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -86.55 167.62 14.43 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 125.782 1.633 . . . . 0.0 113.969 -175.269 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 9.8 mt -87.19 39.51 0.87 Allowed 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 127.53 2.332 . . . . 0.0 111.962 -174.024 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -151.48 155.12 34.19 Favored Pre-proline 0 CA--C 1.549 0.923 0 C-N-CA 124.514 1.126 . . . . 0.0 112.882 -159.881 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -73.83 -26.89 12.93 Favored 'Trans proline' 0 CA--C 1.542 0.904 0 C-N-CA 122.991 2.461 . . . . 0.0 113.588 -178.304 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.455 ' HG ' ' H ' ' A' ' 26' ' ' SER . 6.0 tp -149.8 -163.21 1.72 Allowed 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 125.76 1.624 . . . . 0.0 109.818 174.479 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' SER . . . . . 0.455 ' H ' ' HG ' ' A' ' 25' ' ' LEU . 36.2 p -73.8 43.16 0.15 Allowed 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 127.933 2.493 . . . . 0.0 113.896 177.096 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 10.6 p -150.81 142.2 15.27 Favored Pre-proline 0 N--CA 1.47 0.557 0 C-N-CA 126.166 1.786 . . . . 0.0 110.605 -168.612 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_endo -76.82 73.81 5.18 Favored 'Trans proline' 0 CA--C 1.54 0.79 0 C-N-CA 122.796 2.33 . . . . 0.0 111.504 174.386 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 35.83 87.86 0.1 Allowed Pre-proline 0 CA--C 1.549 0.935 0 C-N-CA 128.617 2.767 . . . . 0.0 115.642 171.039 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 64.4 Cg_endo -61.23 156.99 42.28 Favored 'Trans proline' 0 CA--C 1.538 0.682 0 C-N-CA 121.958 1.772 . . . . 0.0 111.717 173.3 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 62.1 mttp -62.56 120.25 10.78 Favored 'General case' 0 N--CA 1.475 0.794 0 O-C-N 121.851 -0.531 . . . . 0.0 111.877 -173.681 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.5 pp -145.71 139.42 26.52 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 126.041 1.736 . . . . 0.0 111.886 -174.149 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 37.3 mm-40 -146.0 64.13 1.23 Allowed 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 125.759 1.624 . . . . 0.0 110.953 -177.317 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -96.22 93.97 7.22 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.322 1.049 . . . . 0.0 111.824 -176.012 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 34.5 mt -132.14 156.8 45.73 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 126.454 1.902 . . . . 0.0 111.147 -178.806 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 29.7 t -69.68 163.28 25.97 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 123.138 0.575 . . . . 0.0 110.735 168.459 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 7.1 tm-20 -53.86 -42.78 68.92 Favored 'General case' 0 N--CA 1.474 0.741 0 O-C-N 120.874 -1.141 . . . . 0.0 112.82 -179.268 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 7.9 pt20 -78.23 -34.62 49.11 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 112.359 0.503 . . . . 0.0 112.359 175.958 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 91.0 mt-30 -68.12 -37.17 80.83 Favored 'General case' 0 CA--C 1.535 0.37 0 O-C-N 121.501 -0.75 . . . . 0.0 111.578 179.517 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 40.1 ttmt -59.3 -39.52 83.28 Favored 'General case' 0 N--CA 1.47 0.568 0 O-C-N 121.272 -0.893 . . . . 0.0 111.209 172.961 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 45.2 mt -72.77 -40.64 61.33 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 CA-C-O 118.262 -0.875 . . . . 0.0 111.296 176.841 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 39.2 mt -64.4 -42.06 94.18 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 CA-C-N 120.644 1.565 . . . . 0.0 110.526 177.8 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -56.38 -52.74 63.5 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 124.336 1.054 . . . . 0.0 109.952 173.903 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -64.64 -50.68 66.13 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 123.687 0.795 . . . . 0.0 113.003 -178.816 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 18.7 mm-40 -62.35 -22.07 65.81 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 113.525 0.935 . . . . 0.0 113.525 -178.423 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -71.55 -60.68 2.1 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 119.038 0.836 . . . . 0.0 110.742 173.376 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 16.2 mt -63.42 -32.45 56.63 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.496 0 C-N-CA 125.939 1.695 . . . . 0.0 111.688 179.847 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -70.26 -21.56 62.96 Favored 'General case' 0 CA--C 1.545 0.754 0 O-C-N 121.255 -0.903 . . . . 0.0 113.066 175.655 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -94.19 -34.77 12.78 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.358 1.063 . . . . 0.0 112.654 177.751 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 11.7 m -116.7 -18.77 6.79 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.066 0 N-CA-C 114.121 1.156 . . . . 0.0 114.121 -174.411 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 80.62 141.05 2.74 Favored Glycine 0 CA--C 1.53 1.001 0 C-N-CA 124.58 1.086 . . . . 0.0 111.649 -171.501 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.0 tt -64.05 -19.02 64.92 Favored 'General case' 0 N--CA 1.473 0.725 0 O-C-N 121.154 -1.203 . . . . 0.0 114.015 -169.029 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 36.8 mt-30 -66.18 -17.1 64.52 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 126.1 1.76 . . . . 0.0 113.324 174.9 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 69.3 m-80 -112.86 -5.93 13.83 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 114.703 1.372 . . . . 0.0 114.703 -174.145 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 3.7 pt -79.72 162.8 3.72 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 C-N-CA 123.55 0.74 . . . . 0.0 112.48 173.117 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -130.83 147.06 52.44 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 124.931 1.292 . . . . 0.0 109.974 171.895 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -63.76 -25.04 68.01 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 121.429 -0.794 . . . . 0.0 112.029 174.387 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -66.42 -46.98 85.36 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.481 0 C-N-CA 125.455 1.502 . . . . 0.0 109.667 173.423 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 89.7 m -74.22 -43.53 56.75 Favored 'General case' 0 C--O 1.224 -0.27 0 C-N-CA 123.344 0.658 . . . . 0.0 110.151 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 18.7 tp -61.96 -36.04 80.24 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 124.491 1.117 . . . . 0.0 111.864 176.046 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 44.9 t -53.01 -33.25 50.84 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.621 1.168 . . . . 0.0 113.146 168.292 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -100.47 -22.65 14.95 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 125.087 1.355 . . . . 0.0 114.518 -175.584 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 63.9 mmtt -65.19 -38.25 89.91 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 124.709 1.204 . . . . 0.0 111.153 173.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.4 mp -111.62 -0.16 16.19 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 125.073 1.349 . . . . 0.0 114.335 -173.028 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 16.0 m-80 56.89 45.41 21.47 Favored 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 125.743 1.617 . . . . 0.0 112.615 -172.875 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 10.5 pt -104.46 -166.83 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 C-N-CA 125.821 1.648 . . . . 0.0 111.227 -179.47 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 44.5 p -94.74 161.19 14.28 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 123.998 0.919 . . . . 0.0 110.889 166.767 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 82.5 t -61.85 -28.28 43.95 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 O-C-N 121.341 -0.849 . . . . 0.0 111.054 170.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -77.31 -40.21 45.11 Favored 'General case' 0 C--O 1.233 0.214 0 O-C-N 120.68 -1.262 . . . . 0.0 110.453 -175.913 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . 0.366 0.0 OUTLIER -91.59 8.37 37.0 Favored 'General case' 0 C--N 1.348 0.508 0 N-CA-C 113.722 1.008 . . . . 0.0 113.722 175.917 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -95.52 -44.37 7.55 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.467 1.507 . . . . 0.0 111.635 159.799 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 23.9 ttmm -74.15 -29.62 61.88 Favored 'General case' 0 CA--C 1.517 -0.29 0 C-N-CA 124.896 1.278 . . . . 0.0 111.465 -174.475 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 51.9 p-10 -55.53 -42.67 74.88 Favored 'General case' 0 CA--C 1.544 0.735 0 CA-C-O 118.631 -0.7 . . . . 0.0 111.905 176.649 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 20.9 m-85 -59.08 -44.01 91.86 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 125.718 1.607 . . . . 0.0 112.376 175.811 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 69.2 mt -68.44 -25.11 30.42 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.795 0 C-N-CA 124.984 1.314 . . . . 0.0 110.041 179.647 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 73.4 mmtt -93.56 -25.32 17.61 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 115.888 1.81 . . . . 0.0 115.888 -179.846 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 8.4 p30 -103.14 -38.69 7.18 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 120.682 1.583 . . . . 0.0 113.103 175.949 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 22.4 t -104.6 -62.08 1.38 Allowed 'General case' 0 CA--C 1.519 -0.247 0 CA-C-O 119.361 -0.352 . . . . 0.0 111.585 -167.426 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . 0.274 8.6 p30 43.72 31.31 0.45 Allowed 'General case' 0 CA--C 1.551 1.003 0 N-CA-C 116.318 1.97 . . . . 0.0 116.318 -178.18 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 53.68 14.63 0.64 Allowed 'General case' 0 N--CA 1.49 1.562 0 C-N-CA 125.171 1.389 . . . . 0.0 112.874 -170.905 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . 0.279 0.5 OUTLIER 44.22 33.83 0.9 Allowed 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 129.638 3.175 . . . . 0.0 113.601 -166.096 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -73.89 114.61 4.64 Favored Glycine 0 CA--C 1.535 1.282 0 O-C-N 120.799 -1.188 . . . . 0.0 111.759 176.943 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 94.3 mtt-85 -135.21 162.56 32.18 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 125.736 1.614 . . . . 0.0 112.419 -175.013 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 7.6 t -80.72 -17.17 51.91 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 125.334 1.454 . . . . 0.0 114.824 -174.165 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 68.5 m-80 -73.3 129.06 37.21 Favored 'General case' 0 CA--C 1.543 0.691 0 O-C-N 121.032 -1.042 . . . . 0.0 113.139 -172.369 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 8.9 t30 -151.26 120.53 6.8 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.125 1.77 . . . . 0.0 109.509 174.022 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 7.0 tp -156.26 172.3 18.7 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.462 1.505 . . . . 0.0 110.421 -178.049 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 19.1 ptpt -121.6 14.16 10.97 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 126.377 1.871 . . . . 0.0 113.338 -173.6 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 13.3 t -153.12 130.41 11.27 Favored 'General case' 0 C--O 1.233 0.191 0 C-N-CA 125.531 1.532 . . . . 0.0 109.769 173.744 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -146.94 11.57 0.15 Allowed 'Isoleucine or valine' 0 CA--C 1.549 0.92 0 C-N-CA 125.481 1.513 . . . . 0.0 113.683 -171.98 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 80.74 -6.75 60.81 Favored Glycine 0 N--CA 1.476 1.329 0 O-C-N 120.584 -1.322 . . . . 0.0 114.854 -170.221 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 4.8 mp 55.88 85.75 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 C-N-CA 126.756 2.023 . . . . 0.0 109.751 -168.759 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 88.7 mt -63.6 92.38 0.07 Allowed 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 126.186 1.794 . . . . 0.0 112.196 -168.151 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 8.4 pt20 -108.11 2.67 23.15 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 125.496 1.519 . . . . 0.0 114.558 -174.121 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 26.1 tt0 -86.49 144.9 27.03 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 124.724 1.21 . . . . 0.0 113.027 -171.645 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -106.54 98.06 7.78 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 125.071 1.349 . . . . 0.0 111.751 -174.275 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 8.7 m -135.0 31.81 0.79 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.649 0 C-N-CA 125.939 1.696 . . . . 0.0 113.365 -170.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 72.2 m -131.4 -62.19 0.89 Allowed 'General case' 0 N--CA 1.475 0.824 0 N-CA-C 113.524 0.935 . . . . 0.0 113.524 -163.07 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 55.7 p -78.87 -23.74 44.7 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 124.043 0.937 . . . . 0.0 112.963 175.27 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 77.1 mtm -134.69 140.49 46.02 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 126.817 2.047 . . . . 0.0 109.162 169.28 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 6.1 tt0 -145.46 24.31 1.41 Allowed 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 123.865 0.866 . . . . 0.0 112.642 -179.387 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -65.22 127.29 31.11 Favored 'General case' 0 CA--C 1.542 0.65 0 O-C-N 120.701 -1.25 . . . . 0.0 112.55 -173.941 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 47.5 mtmt -138.63 146.2 41.41 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 126.491 1.916 . . . . 0.0 110.778 -177.701 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 78.0 p -138.12 161.96 35.45 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 125.784 1.634 . . . . 0.0 112.985 -178.043 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 98.6 mtp -103.22 160.28 14.81 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 125.382 1.473 . . . . 0.0 112.556 178.234 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 14.5 t -147.47 155.73 42.18 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 125.018 1.327 . . . . 0.0 112.217 178.787 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 22.8 m-90 . . . . . 0 C--O 1.254 1.29 0 C-N-CA 126.561 1.945 . . . . 0.0 111.92 -176.907 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.513 0 N-CA-C 111.711 -0.555 . . . . 0.0 111.711 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 51.0 m -118.51 157.18 27.77 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 125.455 1.502 . . . . 0.0 112.158 -178.58 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 38.0 t-80 -142.09 153.85 44.48 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 125.129 1.372 . . . . 0.0 111.707 179.205 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 28.1 ttt -143.31 99.77 3.5 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.803 1.241 . . . . 0.0 110.993 -177.536 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -156.08 163.2 39.95 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 125.29 1.436 . . . . 0.0 112.042 172.818 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 80.4 p -145.13 120.67 10.39 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.78 1.232 . . . . 0.0 111.486 -176.466 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.4 ttp -152.34 13.4 0.57 Allowed 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 124.196 0.999 . . . . 0.0 113.646 -172.394 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 20.6 m-20 -133.45 79.03 61.36 Favored Pre-proline 0 CA--C 1.549 0.916 0 C-N-CA 124.744 1.217 . . . . 0.0 112.227 -169.472 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo -80.95 -3.08 12.14 Favored 'Trans proline' 0 C--N 1.351 0.682 0 C-N-CA 123.88 3.053 . . . . 0.0 115.081 -177.74 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 97.7 mt -112.84 44.46 1.49 Allowed 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 125.938 1.695 . . . . 0.0 112.256 -175.312 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -116.28 1.75 13.14 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 125.08 1.352 . . . . 0.0 114.506 177.831 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.74 -56.0 2.23 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 124.627 1.171 . . . . 0.0 112.899 -167.458 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.0 pp -130.93 14.09 1.99 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 126.236 1.815 . . . . 0.0 112.82 -174.657 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 8.6 tt -43.82 123.46 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 C-N-CA 124.921 1.288 . . . . 0.0 112.537 178.693 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -146.69 10.15 1.05 Allowed 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 124.399 1.08 . . . . 0.0 113.401 179.82 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -81.41 6.39 14.66 Favored 'General case' 0 CA--C 1.546 0.794 0 N-CA-C 114.939 1.459 . . . . 0.0 114.939 -167.626 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 7.0 tp -146.1 23.05 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 C-N-CA 125.916 1.686 . . . . 0.0 113.609 -173.825 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 40.7 ttmt -124.24 -44.94 1.99 Allowed 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 114.081 1.141 . . . . 0.0 114.081 178.802 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 77.2 tttt -159.26 139.21 11.86 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 125.042 1.337 . . . . 0.0 111.618 -176.056 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -154.39 150.38 27.85 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 125.219 1.408 . . . . 0.0 111.292 -179.382 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -141.88 157.69 44.69 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.039 1.336 . . . . 0.0 112.051 171.94 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -104.45 62.26 0.72 Allowed 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 125.411 1.484 . . . . 0.0 111.725 -172.913 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 24.0 m-20 -109.86 108.47 18.79 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 124.773 1.229 . . . . 0.0 111.064 177.874 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 67.0 m -138.16 104.04 5.1 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 125.368 1.467 . . . . 0.0 110.575 -179.308 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 138.79 -25.75 2.8 Favored Glycine 0 N--CA 1.474 1.217 0 C-N-CA 125.273 1.416 . . . . 0.0 114.416 174.464 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 8.6 p -141.77 121.02 10.36 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 C-N-CA 125.494 1.518 . . . . 0.0 110.394 171.995 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -159.68 161.62 34.94 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 123.793 0.837 . . . . 0.0 113.146 -179.602 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -86.29 29.47 0.76 Allowed 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.962 1.705 . . . . 0.0 115.249 -175.902 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -144.34 125.41 7.82 Favored Pre-proline 0 CA--C 1.548 0.869 0 C-N-CA 125.653 1.581 . . . . 0.0 110.811 -175.878 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 91.6 Cg_endo -80.82 -33.78 0.78 Allowed 'Trans proline' 0 CA--C 1.54 0.821 0 C-N-CA 122.239 1.959 . . . . 0.0 113.93 -173.767 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 30.6 tp -152.91 61.28 0.79 Allowed 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 125.228 1.411 . . . . 0.0 109.8 -179.406 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 5.3 t 59.0 -177.18 0.09 Allowed 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.57 1.148 . . . . 0.0 113.09 -163.588 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 55.5 t 63.93 149.33 0.11 Allowed Pre-proline 0 N--CA 1.482 1.142 0 C-N-CA 127.907 2.483 . . . . 0.0 113.416 -178.317 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -69.88 67.61 1.8 Allowed 'Trans proline' 0 CA--C 1.55 1.286 0 C-N-CA 123.872 3.048 . . . . 0.0 111.935 170.151 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 20.7 tptp 50.17 103.31 0.03 OUTLIER Pre-proline 0 CA--C 1.549 0.941 0 C-N-CA 130.193 3.397 . . . . 0.0 114.259 -169.838 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -70.11 156.63 61.96 Favored 'Trans proline' 0 C--N 1.351 0.679 0 C-N-CA 122.333 2.022 . . . . 0.0 112.053 173.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.53 144.81 55.45 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.207 1.003 . . . . 0.0 112.238 176.684 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 48.4 tp -151.2 131.68 13.81 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.026 1.33 . . . . 0.0 110.332 -175.27 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -138.55 83.86 1.99 Allowed 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.317 1.447 . . . . 0.0 110.17 178.583 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -133.0 92.1 2.98 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.777 1.231 . . . . 0.0 110.729 -177.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.8 mt -133.52 154.44 50.83 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 127.159 2.184 . . . . 0.0 110.055 178.798 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 30.1 t -68.81 163.55 23.93 Favored 'General case' 0 N--CA 1.477 0.911 0 O-C-N 121.81 -0.557 . . . . 0.0 110.636 166.882 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -57.93 -42.0 83.91 Favored 'General case' 0 N--CA 1.477 0.884 0 O-C-N 120.335 -1.478 . . . . 0.0 112.875 -176.595 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 6.9 pt20 -74.96 -35.79 62.09 Favored 'General case' 0 N--CA 1.47 0.544 0 O-C-N 121.71 -0.619 . . . . 0.0 112.323 173.9 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 93.4 mt-30 -66.07 -38.22 87.77 Favored 'General case' 0 CA--C 1.532 0.276 0 O-C-N 121.563 -0.711 . . . . 0.0 111.261 178.823 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 40.7 ttmt -58.83 -41.13 86.15 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 124.228 1.011 . . . . 0.0 111.066 174.941 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 39.4 mt -71.65 -42.44 71.32 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 CA-C-O 118.441 -0.79 . . . . 0.0 110.993 178.106 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 40.1 mt -63.65 -43.04 97.99 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.988 0 CA-C-N 120.282 1.401 . . . . 0.0 110.19 177.851 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -57.4 -51.39 69.6 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 125.043 1.337 . . . . 0.0 110.129 176.097 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -65.14 -46.66 80.03 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.367 1.067 . . . . 0.0 113.508 179.685 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 17.7 mm-40 -67.35 -25.22 65.88 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 123.931 0.892 . . . . 0.0 112.96 179.8 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -72.35 -51.51 20.28 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 118.811 0.732 . . . . 0.0 110.589 175.642 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 42.6 mt -61.51 -32.51 53.67 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.596 0 C-N-CA 124.789 1.236 . . . . 0.0 111.229 173.591 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -66.3 -24.08 66.49 Favored 'General case' 0 CA--C 1.546 0.802 0 O-C-N 121.091 -1.005 . . . . 0.0 113.288 173.953 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -92.43 -31.48 15.28 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.543 1.137 . . . . 0.0 112.828 179.4 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 6.4 m -127.57 -22.39 1.73 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.94 0 N-CA-C 114.209 1.189 . . . . 0.0 114.209 -172.137 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 88.67 148.16 16.39 Favored Glycine 0 CA--C 1.533 1.206 0 C-N-CA 125.422 1.486 . . . . 0.0 113.458 -172.455 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -57.23 -25.63 59.44 Favored 'General case' 0 N--CA 1.481 1.08 0 CA-C-O 123.569 1.652 . . . . 0.0 112.544 -176.833 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 7.2 pt20 -81.16 -13.32 58.75 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 126.738 2.015 . . . . 0.0 114.622 -179.7 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 76.0 m-20 -118.07 -11.93 10.12 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 114.759 1.392 . . . . 0.0 114.759 -177.894 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 46.0 pt -64.21 152.61 8.21 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 CA-C-O 120.899 0.38 . . . . 0.0 110.678 163.418 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -130.15 143.53 50.84 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 124.452 1.101 . . . . 0.0 109.991 178.363 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -62.17 -24.77 67.38 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 118.931 0.787 . . . . 0.0 112.49 -179.65 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.9 mp -70.29 -42.11 78.73 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 C-N-CA 125.868 1.667 . . . . 0.0 110.747 174.629 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 88.8 m -79.09 -42.87 25.31 Favored 'General case' 0 C--N 1.33 -0.276 0 O-C-N 121.675 -0.64 . . . . 0.0 109.62 -179.411 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 17.3 tp -64.86 -35.97 82.83 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 125.701 1.6 . . . . 0.0 112.329 177.022 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.431 ' HA ' HG13 ' A' ' 66' ' ' ILE . 60.5 p -58.29 -26.47 63.05 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 118.995 0.816 . . . . 0.0 112.397 170.982 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -99.49 -30.1 12.35 Favored 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 124.794 1.238 . . . . 0.0 114.22 -178.913 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 11.1 mmtm -63.19 -34.44 77.63 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 125.077 1.351 . . . . 0.0 112.196 177.586 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.1 mp -118.06 8.78 12.53 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 124.981 1.312 . . . . 0.0 113.998 -177.585 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 14.2 t30 55.38 61.82 2.72 Favored 'General case' 0 CA--C 1.552 1.044 0 C-N-CA 125.091 1.357 . . . . 0.0 111.854 177.165 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.431 HG13 ' HA ' ' A' ' 61' ' ' SER . 1.6 pt -136.5 175.87 9.31 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 C-N-CA 126.428 1.891 . . . . 0.0 111.476 -171.148 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 32.4 p -74.99 160.27 30.76 Favored 'General case' 0 N--CA 1.472 0.639 0 O-C-N 120.964 -1.085 . . . . 0.0 111.073 171.987 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 90.6 t -66.61 -26.39 37.27 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.02 0 O-C-N 121.364 -0.835 . . . . 0.0 110.987 169.938 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -77.53 -30.79 52.98 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 124.822 1.249 . . . . 0.0 111.204 -176.916 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . 0.352 0.0 OUTLIER -102.49 18.01 22.23 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 125.254 1.422 . . . . 0.0 113.395 171.254 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -104.05 -43.82 5.17 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.134 1.374 . . . . 0.0 111.616 158.029 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 9.2 ptmm? -73.61 -24.66 60.08 Favored 'General case' 0 N--CA 1.472 0.629 0 O-C-N 120.877 -1.14 . . . . 0.0 112.478 -176.202 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 28.3 p-10 -54.15 -39.63 66.69 Favored 'General case' 0 CA--C 1.545 0.755 0 N-CA-C 113.246 0.832 . . . . 0.0 113.246 173.444 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 28.2 m-85 -69.68 -47.23 63.97 Favored 'General case' 0 C--O 1.226 -0.164 0 C-N-CA 126.902 2.081 . . . . 0.0 110.167 179.314 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 67.7 mt -65.25 -42.76 94.74 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.497 0 C-N-CA 123.974 0.91 . . . . 0.0 109.821 -179.355 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 2.7 tppp? -70.03 -31.54 69.24 Favored 'General case' 0 N--CA 1.467 0.419 0 O-C-N 120.809 -1.182 . . . . 0.0 112.533 -176.17 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 3.6 p30 -88.42 -39.49 14.23 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 119.202 0.91 . . . . 0.0 112.032 175.443 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 7.1 t -88.08 -16.64 32.99 Favored 'General case' 0 CA--C 1.542 0.672 0 N-CA-C 115.287 1.588 . . . . 0.0 115.287 -165.001 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 9.8 p30 -63.98 -17.1 62.97 Favored 'General case' 0 N--CA 1.477 0.911 0 N-CA-C 116.537 2.051 . . . . 0.0 116.537 -167.726 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 6.3 mpt_? -96.76 1.09 50.45 Favored 'General case' 0 N--CA 1.482 1.175 0 N-CA-C 114.623 1.342 . . . . 0.0 114.623 172.735 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 54.2 tp -114.63 -55.25 2.51 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 125.286 1.434 . . . . 0.0 112.218 175.154 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 72.13 -78.27 0.67 Allowed Glycine 0 CA--C 1.536 1.351 0 C-N-CA 123.335 0.493 . . . . 0.0 112.52 -169.029 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 87.9 mtt-85 -139.9 167.81 21.25 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 125.983 1.713 . . . . 0.0 112.366 177.828 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 13.2 t -106.57 60.78 0.64 Allowed 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 126.314 1.846 . . . . 0.0 113.082 -164.97 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 68.7 m-80 -128.28 28.83 5.43 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 124.81 1.244 . . . . 0.0 114.064 -175.783 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 52.3 t30 -137.53 155.41 49.28 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 124.936 1.294 . . . . 0.0 111.418 176.404 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 78.5 mt 51.17 40.75 26.66 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 126.141 1.776 . . . . 0.0 113.792 178.327 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 65.8 pttt -107.56 -5.66 17.42 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 125.819 1.648 . . . . 0.0 114.107 -177.631 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 15.0 t -152.68 125.12 8.2 Favored 'General case' 0 N--CA 1.465 0.281 0 C-N-CA 124.867 1.267 . . . . 0.0 110.35 168.179 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -140.61 4.11 0.52 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.833 0 C-N-CA 125.848 1.659 . . . . 0.0 113.457 -179.003 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 67.57 10.22 57.29 Favored Glycine 0 CA--C 1.54 1.61 0 O-C-N 120.669 -1.27 . . . . 0.0 114.523 -169.878 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . 0.288 4.2 mp 55.29 29.35 0.14 Allowed 'Isoleucine or valine' 0 CA--C 1.552 1.053 0 C-N-CA 126.56 1.944 . . . . 0.0 111.973 177.768 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 53.55 26.26 5.5 Favored 'General case' 0 CA--C 1.553 1.085 0 C-N-CA 125.964 1.706 . . . . 0.0 114.125 -175.277 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 83.5 mt-30 -111.41 93.8 4.65 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 125.695 1.598 . . . . 0.0 110.313 179.932 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -121.43 162.51 20.3 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 125.991 1.716 . . . . 0.0 111.393 176.759 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -135.52 122.87 21.82 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 124.94 1.296 . . . . 0.0 110.848 -179.004 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 67.9 t -133.94 127.82 52.45 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 C-N-CA 125.513 1.525 . . . . 0.0 109.933 176.835 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 44.2 t -161.29 -56.61 0.05 OUTLIER 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 123.978 0.911 . . . . 0.0 112.635 174.447 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 13.2 t -80.09 -29.6 39.08 Favored 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 113.553 0.945 . . . . 0.0 113.553 -174.517 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 13.3 ttt -135.34 115.08 12.84 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 125.283 1.433 . . . . 0.0 109.991 -178.875 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -117.76 -10.07 10.58 Favored 'General case' 0 N--CA 1.479 0.988 0 N-CA-C 113.89 1.071 . . . . 0.0 113.89 -169.291 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -87.42 124.65 33.64 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 124.866 1.266 . . . . 0.0 112.005 -178.043 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 59.4 mtmt -140.91 135.2 31.02 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 126.098 1.759 . . . . 0.0 110.489 174.957 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 39.9 m -142.89 -47.79 0.32 Allowed 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 124.352 1.061 . . . . 0.0 113.011 -178.51 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -131.27 156.84 44.73 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 125.614 1.565 . . . . 0.0 111.771 -177.364 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 10.1 t -102.13 165.43 11.16 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 125.273 1.429 . . . . 0.0 111.962 171.794 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 13.0 t-105 . . . . . 0 C--O 1.253 1.265 0 C-N-CA 125.82 1.648 . . . . 0.0 112.894 -170.247 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.589 0 N-CA-C 111.74 -0.544 . . . . 0.0 111.74 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 50.9 m -78.23 87.27 4.31 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.54 1.136 . . . . 0.0 112.557 -175.421 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 49.7 t-80 -144.75 138.45 27.19 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 125.322 1.449 . . . . 0.0 110.72 175.372 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 11.0 tpt -149.9 78.35 1.35 Allowed 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 123.852 0.861 . . . . 0.0 111.744 -171.52 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -149.21 164.52 34.54 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 124.853 1.261 . . . . 0.0 112.533 176.361 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 4.4 t -148.9 162.22 40.3 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 125.178 1.391 . . . . 0.0 112.057 175.338 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.1 mtt -140.4 136.51 33.17 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 125.562 1.545 . . . . 0.0 110.765 174.077 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 -135.88 148.44 65.1 Favored Pre-proline 0 CA--C 1.548 0.872 0 C-N-CA 125.11 1.364 . . . . 0.0 112.09 176.67 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -81.43 -7.85 12.72 Favored 'Trans proline' 0 CA--C 1.538 0.678 0 C-N-CA 123.643 2.895 . . . . 0.0 115.097 -177.0 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -130.94 31.4 4.48 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 125.787 1.635 . . . . 0.0 114.206 -174.194 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -101.29 -4.11 27.68 Favored 'General case' 0 N--CA 1.478 0.971 0 N-CA-C 114.67 1.359 . . . . 0.0 114.67 179.589 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -129.79 -57.63 1.11 Allowed 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 124.647 1.179 . . . . 0.0 113.424 -160.62 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.8 pp -107.05 9.5 9.39 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.761 0 C-N-CA 125.925 1.69 . . . . 0.0 112.869 -177.157 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 18.0 tt -48.61 114.4 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.841 0 C-N-CA 125.045 1.338 . . . . 0.0 113.791 -175.219 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 7.7 t30 -161.14 130.15 4.64 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 126.942 2.097 . . . . 0.0 108.586 171.652 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 29.2 t0 -150.42 47.87 0.89 Allowed 'General case' 0 N--CA 1.476 0.835 0 CA-C-O 122.556 1.17 . . . . 0.0 111.106 178.409 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 58.5 mt 48.69 96.7 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 C-N-CA 128.83 2.852 . . . . 0.0 112.539 -168.362 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.445 ' HA ' ' HE2' ' A' ' 12' ' ' LYS . 11.3 mmpt? 56.02 39.47 30.47 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 125.136 1.374 . . . . 0.0 113.321 172.463 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 22.5 mmtm -100.55 10.07 41.69 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 127.766 2.426 . . . . 0.0 113.364 176.937 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 6.9 mp0 -90.95 152.11 20.83 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 125.517 1.527 . . . . 0.0 111.839 -171.843 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -81.66 48.25 1.17 Allowed 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 125.234 1.414 . . . . 0.0 114.171 -169.959 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 51.5 t-20 -136.63 107.51 6.66 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 124.904 1.282 . . . . 0.0 111.172 -175.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -110.56 145.27 38.1 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.484 1.514 . . . . 0.0 111.998 174.827 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 3.8 t -135.58 43.42 2.61 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 124.888 1.275 . . . . 0.0 112.707 -179.771 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -142.91 40.28 1.26 Allowed Glycine 0 N--CA 1.471 0.969 0 C-N-CA 124.201 0.905 . . . . 0.0 115.235 179.962 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 91.3 t -97.5 143.38 12.72 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 C-N-CA 125.346 1.459 . . . . 0.0 110.941 178.265 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 5.2 t -133.59 -168.04 2.04 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 126.035 1.734 . . . . 0.0 111.497 177.077 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -76.54 29.32 0.12 Allowed 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 126.27 1.828 . . . . 0.0 114.449 -171.891 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -155.82 130.51 5.05 Favored Pre-proline 0 CA--C 1.547 0.835 0 C-N-CA 126.038 1.735 . . . . 0.0 110.066 -161.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -77.73 -39.05 0.55 Allowed 'Trans proline' 0 CA--C 1.538 0.698 0 C-N-CA 122.077 1.851 . . . . 0.0 113.847 -169.378 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 18.4 tp -154.61 62.51 0.67 Allowed 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 124.13 0.972 . . . . 0.0 111.967 -175.761 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.9 t 56.12 43.46 26.85 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 124.735 1.214 . . . . 0.0 113.936 179.041 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 12.7 p -154.55 144.81 15.78 Favored Pre-proline 0 N--CA 1.473 0.709 0 C-N-CA 125.764 1.626 . . . . 0.0 109.915 -172.22 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 91.3 Cg_endo -77.53 60.27 7.04 Favored 'Trans proline' 0 CA--C 1.548 1.2 0 C-N-CA 123.56 2.84 . . . . 0.0 112.349 178.0 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 27.9 tptt 58.4 110.74 0.02 OUTLIER Pre-proline 0 N--CA 1.483 1.176 0 C-N-CA 129.654 3.182 . . . . 0.0 114.263 -176.902 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_endo -79.83 149.52 20.57 Favored 'Trans proline' 0 CA--C 1.538 0.692 0 C-N-CA 123.015 2.477 . . . . 0.0 112.07 -174.226 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 48.9 pttt -60.8 129.72 42.91 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 124.447 1.099 . . . . 0.0 112.588 -178.455 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 14.8 tp -147.62 139.22 23.9 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.316 1.446 . . . . 0.0 111.102 -170.753 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -150.65 60.07 0.94 Allowed 'General case' 0 N--CA 1.476 0.869 0 CA-C-O 122.643 1.211 . . . . 0.0 113.221 -176.286 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -95.07 87.7 4.99 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 125.232 1.413 . . . . 0.0 112.875 -173.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 63.7 mt -138.38 163.19 32.51 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 126.436 1.895 . . . . 0.0 112.988 -176.692 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 67.4 m -76.33 165.0 25.48 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.73 0.812 . . . . 0.0 110.299 171.144 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -55.22 -45.91 75.95 Favored 'General case' 0 N--CA 1.48 1.027 0 O-C-N 120.746 -1.222 . . . . 0.0 113.185 -174.348 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 10.5 tt0 -67.69 -43.43 80.13 Favored 'General case' 0 N--CA 1.469 0.522 0 O-C-N 121.496 -0.752 . . . . 0.0 111.063 176.758 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 88.7 mt-30 -62.95 -41.48 99.52 Favored 'General case' 0 CA--C 1.536 0.412 0 O-C-N 121.916 -0.49 . . . . 0.0 111.819 178.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 22.6 ttmm -59.74 -40.98 89.89 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 124.27 1.028 . . . . 0.0 110.982 174.742 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 50.6 mt -67.38 -41.53 86.4 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 CA-C-O 118.077 -0.963 . . . . 0.0 111.474 175.583 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 45.6 mt -64.5 -44.91 96.95 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.904 0 CA-C-N 120.773 1.624 . . . . 0.0 110.29 178.074 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -58.29 -48.38 80.66 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.774 1.23 . . . . 0.0 110.587 177.434 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -63.56 -53.11 56.92 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.625 1.17 . . . . 0.0 112.599 176.529 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.3 mm-40 -60.01 -29.99 68.85 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-N 118.998 0.817 . . . . 0.0 112.822 -179.696 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -68.04 -56.95 7.02 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 118.806 0.73 . . . . 0.0 110.93 176.311 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 80.1 mt -64.98 -33.65 65.14 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.333 0 C-N-CA 126.526 1.931 . . . . 0.0 111.195 -179.323 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -72.25 -27.96 62.84 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.892 0.877 . . . . 0.0 112.568 176.309 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -85.53 -39.67 17.16 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 123.861 0.865 . . . . 0.0 112.503 176.337 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.9 m -105.21 -6.95 9.83 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.047 0 N-CA-C 113.654 0.983 . . . . 0.0 113.654 -175.497 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . 0.418 ' C ' ' H ' ' A' ' 53' ' ' GLN . . . 81.48 33.23 28.72 Favored Glycine 0 N--CA 1.471 0.985 0 C-N-CA 124.263 0.935 . . . . 0.0 114.176 164.207 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 20.0 tp 60.86 -26.77 0.04 OUTLIER 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 129.945 3.298 . . . . 0.0 117.708 -174.148 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.418 ' H ' ' C ' ' A' ' 51' ' ' GLY . 29.5 mt-30 -77.27 -13.0 60.02 Favored 'General case' 0 C--N 1.32 -0.684 0 C-N-CA 126.922 2.089 . . . . 0.0 113.752 -169.277 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 60.5 m-80 -123.31 1.16 9.03 Favored 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 114.336 1.236 . . . . 0.0 114.336 -169.736 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 18.3 pt -75.91 155.46 5.95 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 CA-C-O 121.072 0.463 . . . . 0.0 111.705 175.006 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -137.85 143.94 41.19 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 124.658 1.183 . . . . 0.0 110.018 178.794 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -61.33 -26.62 67.93 Favored 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 123.634 0.773 . . . . 0.0 112.316 -179.758 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -67.47 -51.21 54.37 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.327 0 C-N-CA 125.343 1.457 . . . . 0.0 109.631 174.538 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 83.6 m -73.81 -43.82 57.66 Favored 'General case' 0 C--N 1.33 -0.239 0 O-C-N 121.749 -0.594 . . . . 0.0 109.918 -176.719 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 17.2 tp -60.61 -35.09 75.29 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 125.53 1.532 . . . . 0.0 112.343 174.384 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.433 ' HA ' HG13 ' A' ' 66' ' ' ILE . 12.0 t -54.99 -30.43 59.3 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 124.975 1.31 . . . . 0.0 112.581 169.485 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 1.5 mptp? -105.19 -22.78 13.01 Favored 'General case' 0 N--CA 1.468 0.474 0 N-CA-C 114.491 1.293 . . . . 0.0 114.491 -176.464 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 68.4 mmtt -62.9 -34.57 77.69 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 119.797 1.18 . . . . 0.0 111.636 174.074 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.2 mp -120.92 13.65 11.44 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.923 1.289 . . . . 0.0 114.05 -176.401 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . 0.273 0.9 OUTLIER 48.2 53.68 11.4 Favored 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 126.614 1.965 . . . . 0.0 114.218 -177.14 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.433 HG13 ' HA ' ' A' ' 61' ' ' SER . 2.7 pt -117.42 -176.05 0.92 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 C-N-CA 126.781 2.032 . . . . 0.0 111.483 -174.626 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 36.8 p -83.94 156.76 22.19 Favored 'General case' 0 N--CA 1.474 0.734 0 O-C-N 121.214 -0.929 . . . . 0.0 111.084 170.791 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 66.7 t -62.27 -28.94 45.54 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 O-C-N 121.672 -0.643 . . . . 0.0 111.132 170.914 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -74.91 -42.71 57.24 Favored 'General case' 0 C--O 1.234 0.263 0 O-C-N 120.988 -1.07 . . . . 0.0 109.879 -176.597 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . 0.262 0.0 OUTLIER -77.69 -30.17 51.79 Favored 'General case' 0 C--N 1.344 0.348 0 CA-C-N 118.137 0.426 . . . . 0.0 111.88 -178.993 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -65.04 -47.32 77.81 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 124.678 1.191 . . . . 0.0 112.324 169.322 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 38.1 ttmt -68.1 -28.91 67.75 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 124.32 1.048 . . . . 0.0 111.492 -178.258 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -55.17 -36.54 65.96 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 123.494 0.718 . . . . 0.0 112.361 175.729 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 31.5 m-85 -69.54 -42.7 74.28 Favored 'General case' 0 C--O 1.223 -0.324 0 C-N-CA 125.569 1.548 . . . . 0.0 111.02 177.136 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 75.2 mt -68.45 -37.27 77.56 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.468 0 C-N-CA 124.173 0.989 . . . . 0.0 110.264 -178.626 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 88.5 mttt -65.19 -34.91 79.49 Favored 'General case' 0 N--CA 1.471 0.594 0 O-C-N 120.853 -1.154 . . . . 0.0 113.448 178.538 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 9.6 p30 -87.57 -40.26 14.39 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 119.315 0.961 . . . . 0.0 111.105 174.202 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 8.5 t -114.45 91.15 3.53 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-O 121.696 0.76 . . . . 0.0 111.458 -174.746 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 9.4 p30 -144.64 138.93 27.7 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.497 1.119 . . . . 0.0 109.885 167.493 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 2.6 mpt_? 57.8 -23.17 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.624 0 C-N-CA 128.044 2.537 . . . . 0.0 116.71 -172.421 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 56.0 tp -96.37 -34.56 11.51 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 126.63 1.972 . . . . 0.0 113.452 -174.206 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -75.23 146.64 34.94 Favored Glycine 0 CA--C 1.535 1.295 0 CA-C-N 118.008 0.367 . . . . 0.0 112.833 178.647 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 84.9 mtt-85 -135.61 -82.87 0.4 Allowed 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 124.839 1.256 . . . . 0.0 111.637 -178.099 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 3.9 t -159.75 119.58 2.95 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 125.361 1.465 . . . . 0.0 109.486 177.508 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 7.1 m120 -138.84 135.69 34.82 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 123.928 0.891 . . . . 0.0 110.393 -171.588 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 11.9 p-10 -153.31 166.7 31.79 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 124.835 1.254 . . . . 0.0 112.12 -175.524 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER 56.62 29.04 14.95 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 125.76 1.624 . . . . 0.0 114.42 176.901 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 17.9 ptpt -129.26 5.46 5.27 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 125.643 1.577 . . . . 0.0 114.848 -178.221 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 13.6 t -148.22 122.66 9.71 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 124.421 1.088 . . . . 0.0 110.299 173.919 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -140.52 4.94 0.53 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.812 0 C-N-CA 126.241 1.816 . . . . 0.0 113.025 -179.133 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 69.17 6.66 54.46 Favored Glycine 0 CA--C 1.538 1.475 0 O-C-N 120.751 -1.218 . . . . 0.0 114.753 -170.145 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . 0.287 4.6 mp 56.87 24.19 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.061 0 C-N-CA 126.532 1.933 . . . . 0.0 112.403 177.219 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 10.7 tp 53.68 23.39 3.63 Favored 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 126.28 1.832 . . . . 0.0 114.238 -172.085 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -95.39 93.21 7.1 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.655 1.582 . . . . 0.0 110.215 -179.407 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -121.21 144.64 48.49 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 125.303 1.441 . . . . 0.0 111.72 179.377 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -121.43 74.25 1.1 Allowed 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 125.166 1.386 . . . . 0.0 110.692 -175.394 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 18.6 m -135.12 21.92 1.05 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.615 0 C-N-CA 125.588 1.555 . . . . 0.0 114.229 -170.76 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 22.9 t -146.45 -56.59 0.28 Allowed 'General case' 0 N--CA 1.476 0.831 0 N-CA-C 113.517 0.932 . . . . 0.0 113.517 -176.625 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 45.6 m -88.15 -40.27 13.87 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 123.261 0.624 . . . . 0.0 112.441 -175.509 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 1.8 mpt? -125.05 141.66 51.98 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 126.473 1.909 . . . . 0.0 108.827 169.75 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -148.04 94.49 2.34 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.752 1.221 . . . . 0.0 109.259 178.31 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -138.2 156.18 47.95 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.195 1.398 . . . . 0.0 112.304 -178.863 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 2.0 mmmp? -128.16 139.97 52.18 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 125.996 1.718 . . . . 0.0 110.831 179.894 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 55.0 m -143.61 154.8 43.93 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 125.401 1.48 . . . . 0.0 111.886 -177.5 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 27.2 mmt -78.51 158.41 28.59 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 124.03 0.932 . . . . 0.0 112.681 171.011 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 7.1 t -78.12 171.32 15.2 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 124.738 1.215 . . . . 0.0 112.377 170.534 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 21.7 m-90 . . . . . 0 C--O 1.253 1.269 0 C-N-CA 126.453 1.901 . . . . 0.0 112.883 -173.557 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.512 0 N-CA-C 111.345 -0.702 . . . . 0.0 111.345 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 13.3 t -150.11 156.39 41.55 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 125.368 1.467 . . . . 0.0 111.176 177.121 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 1.5 t-160 -149.07 163.93 36.11 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 124.896 1.279 . . . . 0.0 111.726 -179.686 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 20.7 ttt -103.78 140.52 37.52 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 124.719 1.207 . . . . 0.0 112.393 -174.179 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -80.52 156.93 26.29 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 124.301 1.04 . . . . 0.0 113.382 -178.131 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 22.9 t -151.19 157.22 42.39 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 125.295 1.438 . . . . 0.0 111.651 174.973 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 36.9 ttm -135.34 9.89 3.47 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 125.532 1.533 . . . . 0.0 112.926 -178.732 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 -84.76 147.81 49.76 Favored Pre-proline 0 CA--C 1.547 0.847 0 C-N-CA 124.628 1.171 . . . . 0.0 112.481 -179.141 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_endo -71.03 -19.18 30.44 Favored 'Trans proline' 0 C--N 1.35 0.655 0 C-N-CA 122.935 2.424 . . . . 0.0 114.963 -173.634 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.414 HD21 ' H ' ' A' ' 4' ' ' LEU . 2.6 pt? -112.63 25.68 11.24 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 126.828 2.051 . . . . 0.0 114.402 -172.353 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -103.01 0.52 32.22 Favored 'General case' 0 N--CA 1.477 0.876 0 N-CA-C 114.815 1.413 . . . . 0.0 114.815 -178.167 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -122.46 -55.36 1.84 Allowed 'General case' 0 N--CA 1.484 1.234 0 N-CA-C 113.894 1.072 . . . . 0.0 113.894 -165.168 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.0 pp -129.84 15.15 2.39 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 C-N-CA 125.652 1.581 . . . . 0.0 112.81 -171.784 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 14.2 tt -39.79 133.33 0.49 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.847 0 C-N-CA 126.407 1.883 . . . . 0.0 114.407 178.724 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 25.8 t30 -148.54 148.85 30.66 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 126.242 1.817 . . . . 0.0 110.732 170.63 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 20.2 m-20 -132.63 71.47 1.47 Allowed 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 125.389 1.475 . . . . 0.0 111.004 170.41 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . 0.34 6.7 tp 52.21 26.26 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.069 0 C-N-CA 128.262 2.625 . . . . 0.0 115.571 175.098 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -130.98 -33.6 1.54 Allowed 'General case' 0 N--CA 1.476 0.867 0 N-CA-C 114.818 1.414 . . . . 0.0 114.818 177.612 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 45.7 tttm 50.73 38.45 19.42 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 125.982 1.713 . . . . 0.0 113.252 -174.381 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -77.17 122.73 25.42 Favored 'General case' 0 CA--C 1.541 0.617 0 O-C-N 121.321 -0.862 . . . . 0.0 111.368 -177.251 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -153.32 166.39 32.75 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 125.747 1.619 . . . . 0.0 111.433 178.925 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -111.4 126.69 55.21 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 124.798 1.239 . . . . 0.0 111.791 179.153 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 20.7 m-20 -144.56 145.69 31.95 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 126.144 1.777 . . . . 0.0 110.54 175.341 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 83.6 p -139.07 10.8 2.6 Favored 'General case' 0 N--CA 1.479 0.998 0 N-CA-C 115.444 1.646 . . . . 0.0 115.444 -173.917 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -168.56 109.06 0.32 Allowed Glycine 0 CA--C 1.529 0.929 0 O-C-N 121.561 -0.712 . . . . 0.0 112.043 172.33 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 4.4 t -132.65 40.15 0.69 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.125 0 C-N-CA 125.432 1.493 . . . . 0.0 110.736 -175.717 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -150.22 159.87 44.11 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 114.949 1.463 . . . . 0.0 114.949 -175.623 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -93.17 29.17 1.95 Allowed 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 126.747 2.019 . . . . 0.0 114.937 -171.071 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -135.54 143.14 43.83 Favored Pre-proline 0 CA--C 1.55 0.95 0 C-N-CA 125.443 1.497 . . . . 0.0 112.258 -170.736 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_endo -79.61 -29.38 2.93 Favored 'Trans proline' 0 CA--C 1.541 0.866 0 C-N-CA 123.201 2.601 . . . . 0.0 112.851 -177.949 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 8.1 tp -150.08 -158.16 0.89 Allowed 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 126.971 2.108 . . . . 0.0 108.305 174.641 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 5.2 t -78.06 54.37 1.32 Allowed 'General case' 0 N--CA 1.479 0.992 0 O-C-N 120.751 -1.218 . . . . 0.0 112.604 176.626 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 13.1 p -159.14 140.45 9.51 Favored Pre-proline 0 N--CA 1.474 0.771 0 C-N-CA 126.23 1.812 . . . . 0.0 110.859 -171.631 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -79.44 64.06 8.8 Favored 'Trans proline' 0 CA--C 1.546 1.124 0 C-N-CA 123.789 2.993 . . . . 0.0 112.341 178.26 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 17.8 tptt 59.47 107.11 0.03 OUTLIER Pre-proline 0 N--CA 1.483 1.202 0 C-N-CA 129.038 2.935 . . . . 0.0 114.043 -177.51 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 86.3 Cg_endo -77.36 137.23 16.59 Favored 'Trans proline' 0 CA--C 1.539 0.731 0 C-N-CA 122.843 2.362 . . . . 0.0 112.153 -173.232 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 13.4 ptmm? -72.85 130.71 41.04 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 124.712 1.205 . . . . 0.0 113.092 -175.556 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.1 pp -147.94 151.74 36.33 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 124.945 1.298 . . . . 0.0 113.319 -179.979 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -138.31 50.53 1.89 Allowed 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 125.139 1.375 . . . . 0.0 111.922 -175.827 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -82.73 78.51 9.33 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 124.967 1.307 . . . . 0.0 111.638 -174.543 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 11.2 mt -134.0 148.64 51.14 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 126.953 2.101 . . . . 0.0 110.398 -173.195 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 68.3 m -69.06 167.19 16.52 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.006 0.522 . . . . 0.0 110.47 171.158 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -56.26 -45.48 80.07 Favored 'General case' 0 N--CA 1.478 0.927 0 O-C-N 120.463 -1.398 . . . . 0.0 112.651 -176.327 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 10.3 tt0 -70.16 -44.25 69.18 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 123.527 0.731 . . . . 0.0 111.347 176.338 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 82.9 mt-30 -59.71 -41.66 91.3 Favored 'General case' 0 N--CA 1.468 0.453 0 O-C-N 121.805 -0.559 . . . . 0.0 111.693 178.16 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 3.4 ttmp? -62.34 -40.05 95.11 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 124.206 1.002 . . . . 0.0 111.215 177.542 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 52.4 mt -70.53 -39.46 76.18 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.558 0 CA-C-O 117.958 -1.02 . . . . 0.0 111.585 175.655 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 50.7 mt -62.87 -45.64 98.36 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.99 0 CA-C-N 120.942 1.701 . . . . 0.0 109.733 176.676 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -58.58 -49.44 77.45 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.829 1.251 . . . . 0.0 110.924 178.56 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -63.94 -52.21 60.8 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 124.784 1.234 . . . . 0.0 112.766 177.086 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -60.22 -30.36 69.34 Favored 'General case' 0 N--CA 1.472 0.625 0 CA-C-N 118.99 0.814 . . . . 0.0 112.724 179.867 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -67.02 -56.84 8.38 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 118.631 0.65 . . . . 0.0 110.605 176.659 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 87.1 mt -62.81 -34.14 64.14 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 C-N-CA 126.383 1.873 . . . . 0.0 111.287 178.126 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -70.91 -28.08 64.26 Favored 'General case' 0 CA--C 1.542 0.663 0 O-C-N 121.267 -0.896 . . . . 0.0 112.654 177.169 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -85.67 -40.26 16.37 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.127 0.971 . . . . 0.0 112.208 175.689 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.5 m -108.75 -5.04 10.73 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.159 0 N-CA-C 114.32 1.23 . . . . 0.0 114.32 -172.275 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 84.96 25.25 41.66 Favored Glycine 0 CA--C 1.529 0.96 0 C-N-CA 125.111 1.339 . . . . 0.0 115.263 161.318 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 58.01 6.64 0.51 Allowed 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 127.267 2.227 . . . . 0.0 115.155 -172.923 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 29.2 mt-30 -105.71 -18.01 14.21 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 125.856 1.663 . . . . 0.0 113.098 -172.139 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 47.0 m-80 -124.06 3.79 8.64 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 124.257 1.023 . . . . 0.0 113.542 -172.631 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 24.6 pt -74.36 154.31 6.68 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 CA-C-O 121.085 0.469 . . . . 0.0 111.116 172.666 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -138.85 142.65 38.63 Favored 'General case' 0 N--CA 1.466 0.375 0 C-N-CA 124.824 1.25 . . . . 0.0 109.525 178.68 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -61.01 -27.87 68.63 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 118.838 0.745 . . . . 0.0 112.274 -179.772 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -63.84 -49.29 82.58 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.466 0 C-N-CA 125.576 1.55 . . . . 0.0 109.922 174.626 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 83.9 m -78.98 -43.0 25.35 Favored 'General case' 0 C--O 1.223 -0.32 0 C-N-CA 123.806 0.842 . . . . 0.0 110.302 -175.904 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 14.0 tp -60.01 -36.75 77.89 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 125.078 1.351 . . . . 0.0 111.745 174.098 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 30.4 t -56.44 -31.41 63.93 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 124.839 1.255 . . . . 0.0 112.632 170.601 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -101.24 -26.36 13.67 Favored 'General case' 0 N--CA 1.467 0.39 0 N-CA-C 114.643 1.349 . . . . 0.0 114.643 -175.81 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 58.7 mmtt -64.41 -33.01 74.87 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 125.135 1.374 . . . . 0.0 111.577 175.387 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.7 mp -117.84 3.92 12.22 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.213 1.405 . . . . 0.0 114.353 -175.086 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 24.7 m-80 57.0 57.52 4.57 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 126.388 1.875 . . . . 0.0 113.415 -178.659 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 1.2 pt -124.74 -163.99 0.38 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.849 0 C-N-CA 127.243 2.217 . . . . 0.0 110.554 -174.641 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 2.4 p -100.8 162.24 13.04 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 124.296 1.039 . . . . 0.0 111.126 170.284 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 69.2 t -61.65 -28.9 45.05 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 C-N-CA 123.545 0.738 . . . . 0.0 111.391 173.242 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -80.87 -38.17 28.59 Favored 'General case' 0 N--CA 1.471 0.613 0 O-C-N 120.893 -1.129 . . . . 0.0 110.394 -178.971 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 9.5 tmtt? -64.67 -45.5 86.45 Favored 'General case' 0 C--O 1.224 -0.237 0 C-N-CA 125.632 1.573 . . . . 0.0 110.518 176.961 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -60.34 -48.62 80.97 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 126.275 1.83 . . . . 0.0 113.444 170.71 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 36.5 ttmt -71.62 -23.03 61.64 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 124.227 1.011 . . . . 0.0 111.758 -174.417 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -52.02 -47.73 64.86 Favored 'General case' 0 CA--C 1.545 0.76 0 CA-C-N 118.137 0.426 . . . . 0.0 110.527 171.421 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 33.9 m-85 -64.6 -43.28 94.29 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 123.845 0.858 . . . . 0.0 111.982 179.776 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 55.8 mt -63.91 -25.38 38.04 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.629 0 C-N-CA 123.978 0.911 . . . . 0.0 111.099 179.15 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -91.06 -31.85 16.11 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 125.176 1.39 . . . . 0.0 114.686 179.724 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 23.5 p30 -105.17 -28.56 10.9 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 120.247 1.385 . . . . 0.0 114.224 -179.258 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 4.3 t -91.78 -14.63 29.54 Favored 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 113.865 1.061 . . . . 0.0 113.865 -171.392 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 20.7 p30 -59.18 -18.33 35.33 Favored 'General case' 0 CA--C 1.546 0.817 0 N-CA-C 115.394 1.627 . . . . 0.0 115.394 -175.329 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 2.7 mpt_? -71.77 -22.28 61.62 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 124.758 1.223 . . . . 0.0 112.649 -179.82 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 12.9 tp -78.75 -48.75 14.28 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 124.839 1.255 . . . . 0.0 112.815 -169.347 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -86.82 50.63 4.21 Favored Glycine 0 CA--C 1.534 1.234 0 C-N-CA 125.093 1.33 . . . . 0.0 113.867 -176.326 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 28.2 mtt85 -129.88 -60.83 1.02 Allowed 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 124.899 1.28 . . . . 0.0 112.61 -174.269 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 2.7 t -161.17 132.4 5.46 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 124.371 1.068 . . . . 0.0 109.736 -178.5 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 7.5 m120 -133.97 149.76 51.25 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 124.85 1.26 . . . . 0.0 110.91 -173.053 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 58.3 t30 -113.13 143.56 44.15 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.671 1.188 . . . . 0.0 111.687 178.191 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 5.3 tp 56.33 -178.85 0.04 OUTLIER 'General case' 0 CA--C 1.553 1.096 0 C-N-CA 126.557 1.943 . . . . 0.0 112.799 -170.009 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -133.3 7.25 3.9 Favored 'General case' 0 N--CA 1.482 1.159 0 N-CA-C 115.791 1.774 . . . . 0.0 115.791 -171.174 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 1.5 t -135.64 8.46 3.33 Favored 'General case' 0 N--CA 1.484 1.253 0 N-CA-C 116.381 1.993 . . . . 0.0 116.381 -165.652 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 1.6 tp -114.1 7.64 7.72 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.671 0 N-CA-C 115.1 1.518 . . . . 0.0 115.1 -141.955 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 61.75 7.2 10.82 Favored Glycine 0 CA--C 1.532 1.129 0 CA-C-N 114.338 -1.301 . . . . 0.0 113.855 -152.227 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . 0.29 3.7 mp 59.66 35.68 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.377 0 CA-C-O 122.449 1.119 . . . . 0.0 109.223 -166.86 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 10.9 tp 50.49 25.47 1.97 Allowed 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 127.978 2.511 . . . . 0.0 114.963 -174.303 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 37.2 mt-30 -136.64 85.54 2.15 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 125.718 1.607 . . . . 0.0 110.8 -172.035 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -125.42 145.21 50.16 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 124.883 1.273 . . . . 0.0 111.276 172.28 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -144.64 96.8 2.93 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 124.833 1.253 . . . . 0.0 110.345 -175.535 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 71.7 t -136.59 137.99 46.99 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 C-N-CA 125.577 1.551 . . . . 0.0 110.683 -177.33 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 67.5 p -161.92 -66.26 0.05 Allowed 'General case' 0 N--CA 1.476 0.837 0 N-CA-C 113.609 0.966 . . . . 0.0 113.609 172.632 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 77.9 p -82.43 -23.54 34.77 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 124.977 1.311 . . . . 0.0 114.291 -173.157 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 93.1 mtp -133.5 130.93 39.21 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 126.023 1.729 . . . . 0.0 109.495 174.551 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -138.69 65.63 1.45 Allowed 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 125.074 1.35 . . . . 0.0 109.93 -174.683 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 53.4 -155.62 0.2 Allowed 'General case' 0 CA--C 1.555 1.147 0 C-N-CA 125.855 1.662 . . . . 0.0 113.886 -174.94 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 71.2 mmtt -131.56 155.82 46.82 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 126.287 1.835 . . . . 0.0 111.947 177.851 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 66.7 p -116.01 15.29 16.17 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 126.455 1.902 . . . . 0.0 114.148 -172.985 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 67.9 mtt -67.73 160.71 27.55 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 124.732 1.213 . . . . 0.0 113.407 -178.136 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 14.8 t -137.53 156.23 48.35 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 125.377 1.471 . . . . 0.0 112.314 179.004 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 25.0 m-90 . . . . . 0 C--O 1.252 1.222 0 C-N-CA 126.59 1.956 . . . . 0.0 112.094 -175.114 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.574 0 N-CA-C 111.795 -0.522 . . . . 0.0 111.795 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 78.9 p -146.52 160.43 42.13 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 125.177 1.391 . . . . 0.0 112.669 -179.605 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 73.1 m80 -137.82 161.8 35.63 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 125.855 1.662 . . . . 0.0 111.803 -178.164 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 64.9 ttp -138.38 137.56 37.42 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 125.299 1.439 . . . . 0.0 110.992 177.827 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . 42.93 76.34 0.08 Allowed 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 127.341 2.256 . . . . 0.0 115.249 172.855 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 23.7 t -126.23 117.52 23.25 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 125.293 1.437 . . . . 0.0 111.514 -171.32 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 21.0 ttt -147.66 18.14 1.15 Allowed 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 125.283 1.433 . . . . 0.0 112.298 -174.808 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -120.82 98.39 47.81 Favored Pre-proline 0 CA--C 1.546 0.809 0 O-C-N 120.639 -1.288 . . . . 0.0 111.981 -168.796 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 95.5 Cg_endo -83.66 -8.59 10.31 Favored 'Trans proline' 0 C--N 1.351 0.665 0 C-N-CA 123.205 2.603 . . . . 0.0 114.699 178.145 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 94.3 mt -102.69 44.22 1.03 Allowed 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.626 1.57 . . . . 0.0 113.683 -170.582 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -106.91 -1.77 21.98 Favored 'General case' 0 N--CA 1.479 1.004 0 N-CA-C 114.907 1.447 . . . . 0.0 114.907 172.073 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -128.49 -56.46 1.23 Allowed 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 124.174 0.99 . . . . 0.0 113.363 -166.833 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.7 pp -109.54 9.07 8.96 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 C-N-CA 126.029 1.732 . . . . 0.0 112.888 -175.912 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 13.3 tt -49.85 120.31 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 124.223 1.009 . . . . 0.0 112.559 -179.252 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 53.85 21.48 2.79 Favored 'General case' 0 CA--C 1.55 0.965 0 C-N-CA 126.536 1.935 . . . . 0.0 115.244 179.937 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -86.32 13.83 7.5 Favored 'General case' 0 CA--C 1.547 0.832 0 N-CA-C 114.794 1.405 . . . . 0.0 114.794 -168.636 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 12.7 tt -143.69 21.35 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.879 0 C-N-CA 125.325 1.45 . . . . 0.0 114.201 -174.076 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 54.3 mtpt -126.86 -36.82 2.17 Favored 'General case' 0 N--CA 1.479 0.979 0 N-CA-C 115.572 1.693 . . . . 0.0 115.572 178.895 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 45.8 tttm -157.61 149.48 22.16 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 124.462 1.105 . . . . 0.0 112.788 -174.53 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -83.37 144.82 29.39 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.336 1.054 . . . . 0.0 111.86 167.553 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -140.54 27.11 2.09 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 125.019 1.327 . . . . 0.0 113.892 -163.601 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -110.49 -26.45 9.5 Favored 'General case' 0 CA--C 1.549 0.911 0 N-CA-C 114.834 1.42 . . . . 0.0 114.834 -169.387 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 -139.75 138.7 36.12 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 124.914 1.286 . . . . 0.0 111.751 -175.901 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 42.9 m -140.91 44.45 1.8 Allowed 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 125.035 1.334 . . . . 0.0 112.803 -170.759 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -148.56 36.7 1.07 Allowed Glycine 0 CA--C 1.53 1.001 0 N-CA-C 115.202 0.841 . . . . 0.0 115.202 -175.202 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 39.7 t -129.67 39.34 0.84 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 C-N-CA 125.751 1.62 . . . . 0.0 110.199 -170.363 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -147.61 164.05 34.69 Favored 'General case' 0 N--CA 1.476 0.85 0 O-C-N 120.333 -1.479 . . . . 0.0 114.384 -178.127 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 6.0 mt -91.04 38.89 0.97 Allowed 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 127.17 2.188 . . . . 0.0 112.229 -163.695 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -141.78 103.65 5.82 Favored Pre-proline 0 CA--C 1.549 0.924 0 C-N-CA 124.106 0.962 . . . . 0.0 112.238 -157.52 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo -79.63 -26.28 4.85 Favored 'Trans proline' 0 CA--C 1.541 0.848 0 C-N-CA 122.843 2.362 . . . . 0.0 113.921 -175.532 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 6.2 mt -138.37 47.49 1.98 Allowed 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 125.476 1.511 . . . . 0.0 112.267 -176.296 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 1.3 t 57.87 31.21 20.23 Favored 'General case' 0 N--CA 1.477 0.892 0 CA-C-O 123.084 1.421 . . . . 0.0 114.655 -179.972 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 16.8 t -149.32 138.54 12.61 Favored Pre-proline 0 N--CA 1.469 0.475 0 C-N-CA 128.887 2.875 . . . . 0.0 106.905 -172.567 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_endo -73.77 71.82 3.97 Favored 'Trans proline' 0 CA--C 1.544 0.976 0 C-N-CA 123.986 3.124 . . . . 0.0 111.847 -179.316 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 60.34 101.63 0.04 OUTLIER Pre-proline 0 N--CA 1.476 0.87 0 C-N-CA 128.137 2.575 . . . . 0.0 112.819 -175.469 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 77.2 Cg_endo -71.01 164.41 35.84 Favored 'Trans proline' 0 CA--C 1.54 0.781 0 C-N-CA 122.478 2.119 . . . . 0.0 112.045 170.395 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 22.2 pttp -112.75 124.17 51.96 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 125.256 1.422 . . . . 0.0 111.829 173.149 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -154.04 157.88 39.69 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.558 1.543 . . . . 0.0 113.741 -171.009 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 65.0 mm-40 -139.02 55.28 1.71 Allowed 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 126.045 1.738 . . . . 0.0 111.605 179.414 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -105.47 95.17 5.63 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 125.48 1.512 . . . . 0.0 112.036 -173.894 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 8.1 mt -133.87 155.87 49.09 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 127.272 2.229 . . . . 0.0 110.224 177.973 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 22.8 t -70.93 164.46 25.39 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 122.93 0.492 . . . . 0.0 110.747 169.83 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -57.24 -44.17 83.58 Favored 'General case' 0 N--CA 1.476 0.836 0 O-C-N 120.531 -1.355 . . . . 0.0 112.965 -175.3 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 8.1 pt20 -75.9 -33.88 59.93 Favored 'General case' 0 N--CA 1.471 0.6 0 O-C-N 121.693 -0.63 . . . . 0.0 112.155 174.769 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 93.2 mt-30 -67.52 -39.5 85.11 Favored 'General case' 0 CA--C 1.532 0.264 0 O-C-N 121.662 -0.649 . . . . 0.0 111.52 -179.691 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 23.7 ttmm -59.36 -41.0 88.24 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 124.213 1.005 . . . . 0.0 110.81 174.682 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 46.2 mt -69.65 -42.2 80.38 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.656 0 CA-C-O 118.136 -0.935 . . . . 0.0 111.283 177.026 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 42.4 mt -63.86 -44.5 98.11 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.069 0 CA-C-N 120.702 1.592 . . . . 0.0 110.361 178.357 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -59.69 -47.52 85.33 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 125.033 1.333 . . . . 0.0 110.865 176.74 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -63.92 -51.83 62.67 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 124.634 1.173 . . . . 0.0 112.67 176.703 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -58.95 -31.62 68.87 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-N 119.261 0.937 . . . . 0.0 112.689 179.124 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -66.07 -57.41 7.78 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 118.621 0.646 . . . . 0.0 110.587 176.869 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 71.0 mt -62.7 -35.13 69.17 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.352 0 C-N-CA 127.199 2.2 . . . . 0.0 111.896 178.631 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -71.97 -29.03 63.83 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.023 0.929 . . . . 0.0 112.408 178.138 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -86.27 -38.76 17.22 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 123.988 0.915 . . . . 0.0 112.312 176.236 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.3 m -106.55 -5.91 10.19 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.191 0 N-CA-C 114.285 1.217 . . . . 0.0 114.285 -174.372 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 86.32 25.85 35.27 Favored Glycine 0 N--CA 1.472 1.085 0 C-N-CA 124.967 1.27 . . . . 0.0 115.306 161.594 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 54.3 14.24 0.74 Allowed 'General case' 0 CA--C 1.554 1.116 0 C-N-CA 127.381 2.272 . . . . 0.0 115.129 -173.538 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 5.2 pt20 -124.6 -3.17 7.84 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 124.854 1.262 . . . . 0.0 113.662 -171.589 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 50.4 m-80 -124.55 3.52 8.31 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 124.935 1.294 . . . . 0.0 113.411 174.419 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 33.0 pt -74.51 152.95 6.76 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.648 0 O-C-N 121.68 -0.638 . . . . 0.0 112.192 177.007 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -135.49 146.13 47.83 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 125.237 1.415 . . . . 0.0 109.864 174.522 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -65.0 -24.99 67.67 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.884 0.874 . . . . 0.0 112.125 177.397 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -68.02 -38.5 79.99 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.488 0 C-N-CA 125.905 1.682 . . . . 0.0 110.419 173.464 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 90.7 m -83.06 -43.67 16.04 Favored 'General case' 0 C--N 1.33 -0.25 0 O-C-N 121.661 -0.649 . . . . 0.0 109.668 -178.643 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 8.0 mt -60.44 -36.86 79.18 Favored 'General case' 0 N--CA 1.468 0.439 0 O-C-N 121.442 -0.786 . . . . 0.0 112.571 171.297 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.416 ' HA ' HG13 ' A' ' 66' ' ' ILE . 62.1 p -59.98 -24.69 64.64 Favored 'General case' 0 N--CA 1.477 0.921 0 CA-C-N 119.509 1.049 . . . . 0.0 112.669 175.938 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -103.13 -28.23 12.07 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 125.277 1.431 . . . . 0.0 114.246 -177.625 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 19.7 mmmt -64.31 -31.0 72.03 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.841 1.257 . . . . 0.0 112.775 176.889 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.3 mp -126.71 9.5 7.03 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 114.158 1.17 . . . . 0.0 114.158 -175.378 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 16.4 m-80 56.04 59.8 3.55 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 125.932 1.693 . . . . 0.0 113.222 -178.541 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.416 HG13 ' HA ' ' A' ' 61' ' ' SER . 1.1 pt -128.41 173.83 12.81 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 C-N-CA 126.747 2.019 . . . . 0.0 111.679 -173.986 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.2 p -77.17 158.16 30.53 Favored 'General case' 0 N--CA 1.477 0.905 0 O-C-N 120.998 -1.064 . . . . 0.0 111.054 173.931 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 87.6 t -63.69 -28.88 45.89 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.909 0 O-C-N 121.632 -0.667 . . . . 0.0 111.25 172.752 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -77.63 -37.83 49.27 Favored 'General case' 0 N--CA 1.47 0.551 0 O-C-N 120.711 -1.243 . . . . 0.0 110.19 -179.757 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 5.0 tmtm? -65.01 -48.52 73.62 Favored 'General case' 0 C--O 1.225 -0.227 0 C-N-CA 125.489 1.515 . . . . 0.0 110.402 176.423 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -59.61 -42.9 93.67 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 126.107 1.763 . . . . 0.0 113.213 172.808 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 36.3 ttmt -74.16 -29.37 61.75 Favored 'General case' 0 CA--C 1.516 -0.342 0 C-N-CA 124.477 1.111 . . . . 0.0 111.838 -175.958 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -50.5 -45.98 56.86 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 118.415 0.552 . . . . 0.0 110.405 176.837 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 35.6 m-85 -64.58 -39.17 93.25 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.75 0.82 . . . . 0.0 111.559 -176.453 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 20.2 mt -71.91 -28.07 29.23 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.623 0 C-N-CA 124.594 1.157 . . . . 0.0 110.955 -179.952 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 25.4 mmmt -76.98 -39.93 48.69 Favored 'General case' 0 N--CA 1.466 0.33 0 O-C-N 120.878 -1.138 . . . . 0.0 112.251 178.032 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 24.2 p30 -97.09 -39.98 9.05 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 119.123 0.874 . . . . 0.0 112.63 -174.771 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 8.0 t -111.29 86.4 2.32 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.778 0.831 . . . . 0.0 111.566 -175.055 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 25.8 p30 -135.78 -40.75 0.69 Allowed 'General case' 0 CA--C 1.545 0.788 0 N-CA-C 116.121 1.897 . . . . 0.0 116.121 -173.805 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 1.2 mpt_? -90.17 -18.93 24.87 Favored 'General case' 0 N--CA 1.484 1.232 0 CA-C-N 119.737 1.153 . . . . 0.0 113.244 168.018 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 8.2 tt -65.56 -42.52 91.74 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 124.559 1.144 . . . . 0.0 111.899 179.302 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -92.88 22.15 35.59 Favored Glycine 0 CA--C 1.535 1.298 0 CA-C-O 119.202 -0.777 . . . . 0.0 114.623 179.873 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 42.1 ttt-85 -108.45 -71.93 0.74 Allowed 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 124.658 1.183 . . . . 0.0 111.786 -173.263 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 2.6 t -166.1 124.8 1.55 Allowed 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 124.977 1.311 . . . . 0.0 110.625 174.419 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 65.3 m-80 -144.79 162.0 37.86 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.647 1.579 . . . . 0.0 111.55 -177.902 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 54.75 38.44 30.12 Favored 'General case' 0 CA--C 1.553 1.08 0 C-N-CA 125.68 1.592 . . . . 0.0 113.622 179.9 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 12.0 tp -147.15 40.35 1.04 Allowed 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 125.084 1.353 . . . . 0.0 111.416 -175.655 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 54.3 tptt -85.24 -26.52 26.64 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 125.559 1.544 . . . . 0.0 111.473 -179.092 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 8.8 t -162.55 128.81 3.49 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 126.721 2.009 . . . . 0.0 109.662 176.895 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -142.72 2.14 0.38 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.743 0 C-N-CA 125.131 1.372 . . . . 0.0 114.621 -178.037 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 66.28 12.62 58.62 Favored Glycine 0 CA--C 1.541 1.677 0 O-C-N 120.734 -1.229 . . . . 0.0 114.229 -169.638 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . 0.276 3.4 mp 51.03 40.77 0.35 Allowed 'Isoleucine or valine' 0 CA--C 1.549 0.924 0 C-N-CA 127.307 2.243 . . . . 0.0 111.984 176.689 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER 52.56 27.12 4.79 Favored 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 126.622 1.969 . . . . 0.0 114.607 178.818 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 31.9 mt-30 -132.35 76.57 1.7 Allowed 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 125.54 1.536 . . . . 0.0 110.566 -170.308 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -121.44 -50.44 2.11 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.801 1.24 . . . . 0.0 112.549 -178.21 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -132.17 43.07 3.06 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 125.092 1.357 . . . . 0.0 112.291 -179.911 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 7.2 p -152.37 142.83 15.38 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.442 0 C-N-CA 124.916 1.286 . . . . 0.0 111.321 -173.369 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 43.9 m 53.17 28.26 6.84 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 125.859 1.664 . . . . 0.0 115.361 177.618 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 35.4 t -153.57 -49.42 0.09 Allowed 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 124.916 1.286 . . . . 0.0 112.145 -179.029 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 78.1 mtm -131.16 69.08 1.48 Allowed 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 125.401 1.48 . . . . 0.0 110.556 178.648 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -77.1 74.7 3.67 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 124.836 1.255 . . . . 0.0 110.318 176.376 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 56.27 -170.98 0.08 Allowed 'General case' 0 CA--C 1.554 1.133 0 C-N-CA 126.479 1.912 . . . . 0.0 113.899 -167.887 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -133.53 149.78 51.68 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 126.028 1.731 . . . . 0.0 111.712 178.757 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 23.1 t -94.55 133.07 38.57 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.546 1.139 . . . . 0.0 110.646 170.263 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 25.0 ptp -157.6 170.43 22.42 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 125.169 1.388 . . . . 0.0 112.324 -178.211 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 13.7 t -142.78 158.16 43.91 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 125.147 1.379 . . . . 0.0 111.024 167.234 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 17.3 t-105 . . . . . 0 C--O 1.254 1.298 0 C-N-CA 126.083 1.753 . . . . 0.0 112.637 -168.479 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.57 0 N-CA-C 111.557 -0.617 . . . . 0.0 111.557 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 77.4 p -146.85 158.0 43.8 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 125.065 1.346 . . . . 0.0 112.719 -178.466 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 7.6 m-70 -115.64 161.89 18.02 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 125.993 1.717 . . . . 0.0 111.164 174.918 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 42.0 ttm 53.0 51.72 15.27 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 125.286 1.435 . . . . 0.0 112.943 -177.777 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -151.3 169.16 22.64 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.826 1.25 . . . . 0.0 112.883 -175.141 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 40.9 m -121.67 152.24 39.57 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 125.974 1.71 . . . . 0.0 112.266 -172.704 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 98.8 mmm -108.94 145.75 34.93 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 125.407 1.483 . . . . 0.0 111.437 177.291 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 22.2 m-20 -122.42 102.18 39.79 Favored Pre-proline 0 CA--C 1.547 0.834 0 C-N-CA 125.225 1.41 . . . . 0.0 111.008 177.902 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 65.1 Cg_endo -86.29 2.82 7.18 Favored 'Trans proline' 0 C--N 1.35 0.607 0 C-N-CA 123.66 2.906 . . . . 0.0 114.559 -179.336 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 84.6 mt -111.32 41.69 1.81 Allowed 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 125.449 1.5 . . . . 0.0 113.176 -171.575 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -110.02 1.02 18.72 Favored 'General case' 0 N--CA 1.48 1.031 0 N-CA-C 114.985 1.476 . . . . 0.0 114.985 176.572 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -117.13 -55.51 2.33 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 124.142 0.977 . . . . 0.0 113.418 -168.443 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.9 pp -129.22 12.23 2.61 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 C-N-CA 126.238 1.815 . . . . 0.0 112.996 -171.975 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 11.7 tt -41.98 126.81 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.908 0 C-N-CA 125.569 1.547 . . . . 0.0 113.794 -176.854 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 49.5 t30 -153.93 138.93 17.26 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.497 1.519 . . . . 0.0 110.516 165.515 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 33.5 t0 -152.59 62.07 0.81 Allowed 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.765 1.226 . . . . 0.0 110.204 171.509 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 86.8 mt 54.95 106.57 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.543 0 C-N-CA 128.363 2.665 . . . . 0.0 112.153 -162.013 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 11.6 mmpt? 53.29 34.9 18.83 Favored 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 125.57 1.548 . . . . 0.0 113.438 175.611 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 61.3 mttp 48.95 48.12 20.94 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 126.728 2.011 . . . . 0.0 113.672 -175.481 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -58.95 118.77 6.16 Favored 'General case' 0 CA--C 1.545 0.762 0 O-C-N 121.569 -0.707 . . . . 0.0 111.571 177.126 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -155.54 171.78 19.36 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.857 1.663 . . . . 0.0 111.403 -177.353 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 1.9 t30 -135.71 93.04 2.89 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 124.74 1.216 . . . . 0.0 111.04 -179.078 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 18.8 m-20 -134.85 120.12 18.93 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 125.461 1.504 . . . . 0.0 109.953 174.454 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 37.9 m -137.53 41.21 2.39 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 124.594 1.157 . . . . 0.0 112.918 -167.834 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 79.82 74.11 1.11 Allowed Glycine 0 CA--C 1.531 1.076 0 C-N-CA 124.464 1.031 . . . . 0.0 112.56 -179.313 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 9.9 p -111.62 5.19 8.44 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.108 0 C-N-CA 126.119 1.768 . . . . 0.0 113.853 -170.776 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 3.8 m -106.94 143.75 34.58 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 124.677 1.191 . . . . 0.0 113.06 -162.55 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.406 ' H ' HD21 ' A' ' 22' ' ' LEU . 2.4 pt? -82.97 30.64 0.44 Allowed 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 126.235 1.814 . . . . 0.0 115.303 -178.157 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -143.63 145.88 33.01 Favored Pre-proline 0 CA--C 1.547 0.845 0 C-N-CA 125.311 1.445 . . . . 0.0 112.201 -174.745 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 95.0 Cg_endo -78.19 -39.65 0.43 Allowed 'Trans proline' 0 CA--C 1.538 0.722 0 C-N-CA 122.859 2.373 . . . . 0.0 113.003 -178.251 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 24.3 tp -154.45 56.58 0.7 Allowed 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.202 1.401 . . . . 0.0 110.282 -177.309 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 5.0 t 61.21 176.73 0.11 Allowed 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 124.916 1.286 . . . . 0.0 113.653 -165.374 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 72.7 t 62.35 148.99 0.09 OUTLIER Pre-proline 0 N--CA 1.481 1.096 0 C-N-CA 128.114 2.565 . . . . 0.0 113.062 -172.257 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -67.47 75.16 0.55 Allowed 'Trans proline' 0 CA--C 1.548 1.188 0 C-N-CA 123.357 2.704 . . . . 0.0 112.163 171.3 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 49.9 tptt 50.7 82.09 0.25 Allowed Pre-proline 0 CA--C 1.549 0.925 0 C-N-CA 129.291 3.036 . . . . 0.0 113.638 175.299 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_endo -71.33 130.41 17.38 Favored 'Trans proline' 0 C--N 1.35 0.649 0 C-N-CA 122.982 2.454 . . . . 0.0 113.66 -174.588 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 21.2 ptmt -47.96 147.91 1.88 Allowed 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 127.685 2.394 . . . . 0.0 115.48 -172.595 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 22.5 tp -137.69 148.95 46.12 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 126.255 1.822 . . . . 0.0 111.533 -172.052 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -139.9 74.18 1.46 Allowed 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 125.37 1.468 . . . . 0.0 111.788 174.641 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 25.2 tt0 -126.44 72.8 1.34 Allowed 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 125.291 1.436 . . . . 0.0 112.49 -171.623 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.1 mt -129.43 150.36 50.81 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 126.224 1.81 . . . . 0.0 111.081 179.649 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 23.2 t -73.45 166.34 23.4 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.452 0.701 . . . . 0.0 110.768 169.015 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -56.98 -44.29 82.52 Favored 'General case' 0 N--CA 1.476 0.83 0 O-C-N 120.343 -1.473 . . . . 0.0 113.106 -174.732 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 6.7 pt20 -76.3 -35.88 58.63 Favored 'General case' 0 N--CA 1.47 0.542 0 O-C-N 121.642 -0.661 . . . . 0.0 112.233 175.028 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 92.7 mt-30 -65.35 -38.98 91.75 Favored 'General case' 0 N--CA 1.464 0.271 0 O-C-N 121.595 -0.69 . . . . 0.0 111.21 179.254 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 40.9 ttmt -58.87 -41.44 87.06 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 124.522 1.129 . . . . 0.0 110.814 175.569 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 42.5 mt -71.24 -41.21 74.85 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.638 0 CA-C-O 118.358 -0.829 . . . . 0.0 111.219 177.911 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 37.9 mt -65.15 -41.44 91.77 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.964 0 CA-C-N 120.166 1.348 . . . . 0.0 110.363 177.416 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -60.72 -48.45 81.72 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.541 1.137 . . . . 0.0 110.737 176.763 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -66.04 -50.21 64.96 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 124.472 1.109 . . . . 0.0 112.141 178.608 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -65.56 -22.65 66.72 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 119.222 0.919 . . . . 0.0 113.104 -176.185 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -71.58 -58.96 3.02 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.228 1.011 . . . . 0.0 110.834 173.075 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 86.8 mt -63.84 -33.06 59.61 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.451 0 C-N-CA 126.794 2.038 . . . . 0.0 111.598 -179.861 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -71.04 -24.75 62.41 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.076 0.951 . . . . 0.0 112.704 176.234 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -90.78 -38.81 12.76 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.199 0.999 . . . . 0.0 112.517 175.767 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.3 m -110.24 -3.41 10.54 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.111 0 N-CA-C 114.167 1.173 . . . . 0.0 114.167 -173.577 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 85.21 23.11 49.75 Favored Glycine 0 N--CA 1.473 1.112 0 C-N-CA 125.219 1.39 . . . . 0.0 115.457 159.326 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 56.87 6.9 0.35 Allowed 'General case' 0 CA--C 1.554 1.128 0 C-N-CA 127.577 2.351 . . . . 0.0 115.181 -170.335 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 29.2 mt-30 -104.71 -17.69 14.55 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 125.545 1.538 . . . . 0.0 112.977 -173.005 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 44.5 m-80 -123.98 4.17 8.68 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.396 1.078 . . . . 0.0 113.634 -173.543 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 23.1 pt -75.28 155.26 6.22 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 C-N-CA 122.976 0.51 . . . . 0.0 111.291 173.377 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -137.62 142.85 41.23 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 124.487 1.115 . . . . 0.0 110.257 179.106 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -60.7 -27.45 67.89 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.741 0.816 . . . . 0.0 112.227 -179.867 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -65.93 -49.76 74.64 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.484 0 C-N-CA 125.606 1.562 . . . . 0.0 110.125 175.044 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 61.9 m -77.79 -43.41 30.73 Favored 'General case' 0 C--O 1.222 -0.387 0 C-N-CA 123.612 0.765 . . . . 0.0 109.962 -175.642 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 19.8 tp -61.39 -35.11 76.6 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 125.481 1.513 . . . . 0.0 112.171 174.322 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.409 ' HA ' HG13 ' A' ' 66' ' ' ILE . 30.3 t -54.96 -31.65 60.82 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 124.719 1.208 . . . . 0.0 112.513 168.501 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -100.57 -26.9 13.67 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 125.033 1.333 . . . . 0.0 114.162 -174.892 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 64.6 mmtt -61.44 -37.7 84.51 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 125.018 1.327 . . . . 0.0 111.773 174.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.2 mp -116.95 6.73 13.06 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 114.146 1.165 . . . . 0.0 114.146 -174.373 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 20.4 m-80 56.56 57.46 4.82 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 126.485 1.914 . . . . 0.0 113.23 -179.046 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.409 HG13 ' HA ' ' A' ' 61' ' ' SER . 1.6 pt -124.76 -170.93 0.67 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.693 0 C-N-CA 126.584 1.954 . . . . 0.0 110.917 -172.753 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.5 p -89.76 159.98 16.77 Favored 'General case' 0 N--CA 1.476 0.862 0 O-C-N 121.311 -0.868 . . . . 0.0 110.921 170.258 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 88.8 t -62.14 -30.18 48.2 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.893 0 C-N-CA 123.187 0.595 . . . . 0.0 111.307 172.641 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -79.73 -36.7 36.99 Favored 'General case' 0 N--CA 1.469 0.492 0 O-C-N 121.001 -1.062 . . . . 0.0 110.514 -179.055 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 4.6 tmtm? -68.08 -44.45 76.26 Favored 'General case' 0 C--O 1.222 -0.362 0 C-N-CA 124.421 1.088 . . . . 0.0 110.715 177.242 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -59.33 -46.87 87.42 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 125.046 1.338 . . . . 0.0 112.752 170.107 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 18.9 ttmm -67.67 -26.69 66.32 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 124.417 1.087 . . . . 0.0 111.523 -176.79 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -51.26 -42.14 60.86 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-N 118.171 0.441 . . . . 0.0 111.216 174.2 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 24.2 m-85 -70.39 -39.71 74.37 Favored 'General case' 0 C--O 1.225 -0.211 0 C-N-CA 124.479 1.111 . . . . 0.0 111.588 -177.474 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 52.6 mt -67.15 -24.79 32.58 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 C-N-CA 125.608 1.563 . . . . 0.0 111.185 179.292 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.437 ' HA ' ' HE2' ' A' ' 76' ' ' LYS . 10.6 mmpt? -95.23 -25.44 16.37 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 125.322 1.449 . . . . 0.0 113.177 178.46 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 42.6 m-20 -80.89 -41.93 22.28 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 125.305 1.442 . . . . 0.0 110.679 174.242 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 50.6 m -123.17 123.32 40.54 Favored 'General case' 0 N--CA 1.465 0.281 0 C-N-CA 123.818 0.847 . . . . 0.0 112.347 174.491 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 6.8 t-20 -148.15 -66.35 0.24 Allowed 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 113.377 0.88 . . . . 0.0 113.377 -171.142 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 23.6 mmt85 -96.49 -13.37 23.11 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 125.366 1.466 . . . . 0.0 113.779 -179.588 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 50.4 tp -87.94 -51.63 5.72 Favored 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 125.156 1.383 . . . . 0.0 113.186 -173.225 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 71.24 -62.2 1.05 Allowed Glycine 0 CA--C 1.539 1.576 0 N-CA-C 115.162 0.825 . . . . 0.0 115.162 -171.599 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 23.5 mmt85 -136.57 154.73 50.61 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 126.141 1.776 . . . . 0.0 112.6 -175.101 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 6.7 t -71.47 -14.5 62.15 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 125.608 1.563 . . . . 0.0 115.037 -174.744 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 71.5 m-80 -100.14 127.01 46.47 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.247 1.019 . . . . 0.0 111.979 -177.726 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 45.5 t30 -151.28 -70.51 0.17 Allowed 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.603 1.161 . . . . 0.0 111.611 169.465 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 12.0 tp -150.77 36.79 0.63 Allowed 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 125.883 1.673 . . . . 0.0 111.672 -177.606 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 39.9 ttpt -84.87 -27.56 26.61 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 125.937 1.695 . . . . 0.0 111.519 -179.065 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 8.9 t -157.41 127.44 6.25 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 126.465 1.906 . . . . 0.0 109.621 175.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -142.92 3.64 0.37 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.791 0 C-N-CA 125.645 1.578 . . . . 0.0 113.832 -178.672 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 65.74 12.69 57.45 Favored Glycine 0 CA--C 1.541 1.659 0 O-C-N 120.65 -1.281 . . . . 0.0 114.154 -168.355 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . 0.293 3.0 mp 50.66 33.3 0.2 Allowed 'Isoleucine or valine' 0 CA--C 1.552 1.034 0 C-N-CA 127.559 2.344 . . . . 0.0 112.11 179.245 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 8.0 tp 51.35 26.86 3.29 Favored 'General case' 0 CA--C 1.553 1.077 0 C-N-CA 126.638 1.975 . . . . 0.0 114.761 -179.034 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 6.3 pt20 -121.18 32.2 6.04 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 125.439 1.496 . . . . 0.0 113.397 -172.802 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 17.3 mm-40 -70.65 -21.97 62.55 Favored 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 114.083 1.142 . . . . 0.0 114.083 -175.192 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -143.41 79.9 1.65 Allowed 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 124.579 1.152 . . . . 0.0 111.2 178.614 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 11.6 p -151.1 154.77 7.95 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.715 0 C-N-CA 125.71 1.604 . . . . 0.0 110.578 177.099 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 25.5 m 63.76 -39.42 0.2 Allowed 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 128.301 2.64 . . . . 0.0 116.909 -179.333 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 49.8 m -86.01 -19.56 30.16 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.738 1.215 . . . . 0.0 114.122 -177.547 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 13.5 ttt -144.57 28.99 1.28 Allowed 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.986 1.315 . . . . 0.0 112.458 -177.731 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -83.54 59.68 5.25 Favored 'General case' 0 CA--C 1.55 0.943 0 C-N-CA 124.881 1.273 . . . . 0.0 111.624 -174.75 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -152.02 165.1 35.71 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 125.841 1.656 . . . . 0.0 112.442 -177.628 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 36.4 mtmm -128.56 151.73 49.11 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 125.848 1.659 . . . . 0.0 111.539 171.569 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 61.0 m -136.22 145.92 46.2 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 125.748 1.619 . . . . 0.0 111.003 178.228 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 64.5 mtm -139.56 165.5 27.08 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 125.589 1.556 . . . . 0.0 112.084 -174.955 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 12.2 t -137.09 162.72 32.59 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 125.386 1.474 . . . . 0.0 112.03 175.631 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 44.4 t-105 . . . . . 0 C--O 1.254 1.325 0 C-N-CA 126.126 1.771 . . . . 0.0 112.791 -168.509 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.606 0 N-CA-C 112.197 -0.361 . . . . 0.0 112.197 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 27.9 m -125.83 27.16 6.46 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 125.102 1.361 . . . . 0.0 113.53 -171.165 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 25.3 t60 -111.24 126.25 54.68 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 125.238 1.415 . . . . 0.0 111.699 -176.689 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 26.6 ttt -155.21 137.28 14.65 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 125.09 1.356 . . . . 0.0 111.336 -176.953 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -151.44 159.55 44.16 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 113.822 1.045 . . . . 0.0 113.822 175.937 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 86.8 p -153.43 154.79 35.1 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 125.769 1.628 . . . . 0.0 112.028 -178.3 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 60.6 mtt -143.74 63.41 1.35 Allowed 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 125.253 1.421 . . . . 0.0 111.231 -175.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -130.09 110.03 16.78 Favored Pre-proline 0 CA--C 1.55 0.949 0 C-N-CA 124.75 1.22 . . . . 0.0 111.79 -173.726 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 69.3 Cg_endo -85.28 -8.52 8.69 Favored 'Trans proline' 0 C--N 1.352 0.741 0 C-N-CA 123.51 2.807 . . . . 0.0 115.179 -176.609 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 96.6 mt -111.92 48.65 0.95 Allowed 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 126.261 1.825 . . . . 0.0 111.183 -177.757 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -118.29 1.52 11.86 Favored 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 114.26 1.208 . . . . 0.0 114.26 -179.836 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -119.12 -55.84 2.13 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 124.673 1.189 . . . . 0.0 112.879 -168.402 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.1 pp -128.98 14.32 2.72 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 C-N-CA 126.414 1.886 . . . . 0.0 112.762 -173.741 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 7.7 tt -46.54 105.31 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.1 0 C-N-CA 125.346 1.458 . . . . 0.0 112.4 179.79 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -154.71 -3.29 0.16 Allowed 'General case' 0 N--CA 1.478 0.929 0 N-CA-C 114.519 1.303 . . . . 0.0 114.519 -177.406 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -84.62 12.12 7.65 Favored 'General case' 0 CA--C 1.546 0.796 0 N-CA-C 115.157 1.54 . . . . 0.0 115.157 -162.383 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 7.1 tp -147.01 29.29 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 C-N-CA 125.73 1.612 . . . . 0.0 113.32 -173.707 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 2.3 tppp? -121.09 -46.78 2.3 Favored 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 114.824 1.416 . . . . 0.0 114.824 -179.085 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 95.2 mttt 44.58 45.34 7.83 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 126.267 1.827 . . . . 0.0 114.247 -173.473 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -106.0 132.69 51.79 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.707 1.203 . . . . 0.0 111.882 179.578 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -154.64 172.03 18.53 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 125.643 1.577 . . . . 0.0 111.967 177.083 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 62.8 t30 -144.04 158.18 43.87 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 125.569 1.547 . . . . 0.0 111.035 174.02 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 56.6 t0 -145.24 106.92 4.25 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.768 1.227 . . . . 0.0 110.975 178.224 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 74.2 m -133.18 103.53 6.05 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 125.399 1.48 . . . . 0.0 110.757 -179.167 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 147.51 -20.43 1.5 Allowed Glycine 0 N--CA 1.475 1.261 0 C-N-CA 124.635 1.112 . . . . 0.0 115.309 171.253 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 7.1 p -139.71 124.08 19.56 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 C-N-CA 125.171 1.388 . . . . 0.0 110.633 174.728 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -157.21 157.85 35.11 Favored 'General case' 0 N--CA 1.478 0.972 0 N-CA-C 113.955 1.094 . . . . 0.0 113.955 178.479 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -83.02 32.49 0.44 Allowed 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 126.618 1.967 . . . . 0.0 114.78 -179.207 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -119.79 91.53 45.26 Favored Pre-proline 0 CA--C 1.546 0.816 0 C-N-CA 124.49 1.116 . . . . 0.0 112.541 -166.833 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo -77.18 -35.08 1.85 Allowed 'Trans proline' 0 CA--C 1.541 0.832 0 C-N-CA 122.298 1.999 . . . . 0.0 113.784 -178.168 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 1.8 tt -153.83 68.98 0.78 Allowed 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 124.587 1.155 . . . . 0.0 111.117 -175.558 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 1.8 t 53.65 39.44 30.17 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 125.287 1.435 . . . . 0.0 114.662 177.448 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 7.4 p -154.93 142.89 14.24 Favored Pre-proline 0 N--CA 1.475 0.782 0 C-N-CA 125.796 1.639 . . . . 0.0 109.839 -175.088 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -77.37 66.11 7.92 Favored 'Trans proline' 0 CA--C 1.547 1.149 0 C-N-CA 123.607 2.871 . . . . 0.0 111.568 176.931 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 41.5 tptt 60.1 123.1 0.02 OUTLIER Pre-proline 0 N--CA 1.478 0.973 0 C-N-CA 130.061 3.344 . . . . 0.0 114.892 -172.151 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 93.1 Cg_endo -76.27 147.24 29.14 Favored 'Trans proline' 0 CA--C 1.54 0.792 0 C-N-CA 122.791 2.327 . . . . 0.0 111.826 177.059 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 9.7 mtpm? -74.0 139.55 44.86 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.562 1.145 . . . . 0.0 111.313 177.834 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 5.0 tp -143.51 129.4 19.46 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 126.171 1.788 . . . . 0.0 109.549 -176.595 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -141.41 61.22 1.48 Allowed 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.533 1.133 . . . . 0.0 110.66 -174.138 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -124.07 80.47 1.82 Allowed 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.957 1.303 . . . . 0.0 113.059 -170.924 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 49.7 mt -126.55 157.0 39.93 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 127.1 2.16 . . . . 0.0 111.045 175.736 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 70.7 m -72.98 164.8 26.14 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 122.891 0.476 . . . . 0.0 110.255 169.794 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -55.21 -44.2 75.18 Favored 'General case' 0 N--CA 1.478 0.932 0 O-C-N 120.76 -1.213 . . . . 0.0 112.797 -176.261 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 12.8 tt0 -69.7 -42.92 73.41 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 123.552 0.741 . . . . 0.0 111.19 176.187 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 83.9 mt-30 -63.71 -39.0 93.2 Favored 'General case' 0 CA--C 1.536 0.42 0 O-C-N 121.659 -0.65 . . . . 0.0 112.12 179.183 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -61.21 -40.11 92.77 Favored 'General case' 0 N--CA 1.468 0.475 0 O-C-N 121.06 -1.025 . . . . 0.0 110.903 173.719 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 51.6 mt -69.62 -39.51 78.36 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 CA-C-O 117.789 -1.101 . . . . 0.0 111.704 175.817 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 47.3 mt -64.03 -43.28 97.53 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.947 0 CA-C-N 121.01 1.732 . . . . 0.0 110.285 176.814 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -59.5 -47.49 85.3 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.056 0.943 . . . . 0.0 110.885 176.795 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -69.44 -49.17 57.51 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 124.335 1.054 . . . . 0.0 112.86 -179.714 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -64.29 -23.14 67.19 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-N 118.91 0.777 . . . . 0.0 112.96 -176.646 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -69.4 -59.55 2.92 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 124.206 1.002 . . . . 0.0 110.72 174.309 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 50.5 mt -60.74 -34.28 58.37 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.436 0 C-N-CA 125.309 1.444 . . . . 0.0 111.492 176.95 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -67.07 -21.04 65.91 Favored 'General case' 0 CA--C 1.546 0.807 0 O-C-N 121.269 -0.895 . . . . 0.0 113.271 176.379 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -98.03 -31.27 12.23 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 124.748 1.219 . . . . 0.0 113.309 178.308 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 5.9 m -122.36 -19.21 4.36 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 N-CA-C 114.139 1.163 . . . . 0.0 114.139 -173.857 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 83.43 147.1 7.21 Favored Glycine 0 CA--C 1.532 1.096 0 C-N-CA 124.964 1.269 . . . . 0.0 112.864 -172.128 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 12.3 tp -61.63 -13.25 20.66 Favored 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 125.244 1.418 . . . . 0.0 113.81 -175.05 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 7.6 pt20 -87.8 -16.26 34.62 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 127.143 2.177 . . . . 0.0 114.134 179.437 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 76.1 m-80 -111.15 -11.66 14.22 Favored 'General case' 0 N--CA 1.476 0.858 0 N-CA-C 114.513 1.301 . . . . 0.0 114.513 -178.138 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 43.8 pt -67.92 156.87 6.64 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.614 0 C-N-CA 123.83 0.852 . . . . 0.0 111.722 168.856 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.2 p -131.21 142.24 50.15 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 125.704 1.602 . . . . 0.0 109.645 174.215 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -63.17 -25.81 68.52 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 123.769 0.828 . . . . 0.0 112.27 177.573 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.9 mp -63.29 -49.61 82.31 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 C-N-CA 125.124 1.37 . . . . 0.0 109.601 173.055 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 97.2 m -75.26 -41.7 56.77 Favored 'General case' 0 C--O 1.224 -0.289 0 C-N-CA 123.929 0.892 . . . . 0.0 110.749 -177.846 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.9 tt -67.03 -32.63 73.97 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 124.627 1.171 . . . . 0.0 111.954 177.825 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 44.5 t -53.98 -33.33 56.73 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 124.791 1.236 . . . . 0.0 113.034 165.455 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -97.87 -22.79 16.16 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 125.071 1.348 . . . . 0.0 113.667 -175.166 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 7.9 mmtm -69.04 -37.95 78.86 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 124.792 1.237 . . . . 0.0 111.386 175.924 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.4 mp -107.52 -0.98 21.76 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 125.14 1.376 . . . . 0.0 114.057 -175.577 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 16.7 m-80 57.89 48.13 14.03 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 126.133 1.773 . . . . 0.0 112.603 -175.041 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 15.3 pt -111.98 -159.19 0.14 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.632 0 C-N-CA 125.964 1.706 . . . . 0.0 110.992 -177.078 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 44.6 p -100.79 161.04 13.87 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 124.649 1.179 . . . . 0.0 111.323 168.084 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 59.6 t -61.59 -24.31 33.47 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 O-C-N 121.58 -0.7 . . . . 0.0 111.059 169.34 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -78.18 -37.02 46.73 Favored 'General case' 0 C--O 1.232 0.166 0 O-C-N 120.901 -1.124 . . . . 0.0 110.246 -178.15 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 33.5 mttm -64.71 -52.86 54.91 Favored 'General case' 0 C--N 1.347 0.498 0 CA-C-N 118.888 0.767 . . . . 0.0 110.568 167.395 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -58.99 -37.55 77.11 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.012 0.925 . . . . 0.0 112.773 -172.13 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 23.7 ttmm -77.57 -31.02 52.88 Favored 'General case' 0 CA--C 1.522 -0.123 0 C-N-CA 125.444 1.498 . . . . 0.0 111.889 177.777 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -57.09 -42.38 80.6 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 119.037 0.835 . . . . 0.0 111.531 179.596 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 39.3 m-85 -61.93 -51.5 67.88 Favored 'General case' 0 C--O 1.222 -0.389 0 C-N-CA 124.451 1.101 . . . . 0.0 109.641 178.481 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 71.3 mt -62.27 -25.07 36.69 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.875 0 C-N-CA 124.475 1.11 . . . . 0.0 111.517 -179.363 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 13.1 tppt? -87.48 -27.29 22.75 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 126.498 1.919 . . . . 0.0 113.28 -179.385 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 31.6 p30 -103.66 -33.87 8.81 Favored 'General case' 0 CA--C 1.546 0.825 0 CA-C-N 119.897 1.226 . . . . 0.0 113.401 177.88 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 11.8 p -83.67 -6.47 59.45 Favored 'General case' 0 N--CA 1.478 0.931 0 N-CA-C 115.545 1.683 . . . . 0.0 115.545 -171.086 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 24.8 p30 -67.3 9.13 0.24 Allowed 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 117.086 2.254 . . . . 0.0 117.086 -168.805 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 19.8 mmt85 -104.38 -3.5 24.03 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 125.958 1.703 . . . . 0.0 113.803 172.737 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -94.24 -47.36 6.66 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 124.858 1.263 . . . . 0.0 112.081 -177.816 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -88.55 159.47 29.51 Favored Glycine 0 CA--C 1.536 1.352 0 C-N-CA 124.346 0.974 . . . . 0.0 112.933 171.293 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER 64.85 33.4 10.11 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 126.061 1.744 . . . . 0.0 115.283 179.687 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 1.9 t -165.73 69.13 0.13 Allowed 'General case' 0 N--CA 1.478 0.965 0 CA-C-O 123.058 1.409 . . . . 0.0 109.906 179.48 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 66.1 m-80 -138.86 141.2 38.64 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 125.352 1.461 . . . . 0.0 110.451 176.605 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 22.6 t-20 -128.71 -16.03 4.31 Favored 'General case' 0 CA--C 1.547 0.844 0 N-CA-C 114.435 1.272 . . . . 0.0 114.435 -171.631 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 6.6 tp -137.9 30.44 2.52 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 124.07 0.948 . . . . 0.0 112.394 -163.824 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 60.6 tttp -83.91 -24.86 30.59 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 126.262 1.825 . . . . 0.0 111.63 -179.983 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 9.9 t -156.55 127.9 7.04 Favored 'General case' 0 C--O 1.234 0.245 0 C-N-CA 125.939 1.695 . . . . 0.0 109.732 173.976 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -142.68 2.03 0.39 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.788 0 C-N-CA 125.46 1.504 . . . . 0.0 114.014 -178.829 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 69.67 11.22 65.29 Favored Glycine 0 CA--C 1.539 1.563 0 O-C-N 120.797 -1.19 . . . . 0.0 114.627 -170.202 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . 0.267 4.2 mp 51.88 41.8 0.35 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.979 0 C-N-CA 126.814 2.046 . . . . 0.0 111.614 174.668 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 9.0 tp 52.91 24.56 3.42 Favored 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 126.632 1.973 . . . . 0.0 114.864 -179.406 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 34.4 mt-30 -133.99 55.83 1.88 Allowed 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.939 1.695 . . . . 0.0 111.479 -173.253 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -93.01 108.43 20.0 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.336 1.054 . . . . 0.0 110.302 172.835 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -133.62 65.22 1.59 Allowed 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 125.096 1.358 . . . . 0.0 111.307 -173.933 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 94.6 t -132.28 143.68 39.24 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.687 0 C-N-CA 125.061 1.344 . . . . 0.0 111.227 -179.569 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 82.8 p -147.4 -53.64 0.21 Allowed 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 173.138 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 22.6 t -149.99 113.32 4.93 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 124.634 1.173 . . . . 0.0 111.322 177.33 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 54.2 mtt 55.0 24.39 5.91 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 126.041 1.737 . . . . 0.0 115.145 -178.089 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 -82.62 67.48 8.69 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 125.33 1.452 . . . . 0.0 111.329 179.291 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -140.12 159.58 41.87 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 125.391 1.476 . . . . 0.0 112.6 -178.217 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -133.34 150.65 51.84 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 125.92 1.688 . . . . 0.0 111.993 177.901 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 51.1 m -83.6 164.42 19.75 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 125.014 1.326 . . . . 0.0 112.211 172.54 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 7.3 ttp -137.55 -175.79 4.19 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 125.421 1.489 . . . . 0.0 111.202 176.186 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 23.0 m -113.34 146.24 39.76 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 125.317 1.447 . . . . 0.0 110.872 179.71 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 27.6 m-90 . . . . . 0 C--O 1.252 1.203 0 C-N-CA 126.11 1.764 . . . . 0.0 112.372 -179.729 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.472 0 N-CA-C 111.451 -0.659 . . . . 0.0 111.451 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 49.0 m -98.47 153.02 18.91 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.937 1.295 . . . . 0.0 112.499 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 11.3 m-70 60.09 157.85 0.03 OUTLIER 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 127.028 2.131 . . . . 0.0 114.937 -168.983 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 9.9 tpt -88.0 60.17 5.7 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 124.895 1.278 . . . . 0.0 112.189 -173.552 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -146.19 157.81 43.84 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.838 1.255 . . . . 0.0 113.239 -177.721 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 20.1 t -153.3 160.5 42.73 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 126.082 1.753 . . . . 0.0 110.939 175.551 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -136.24 59.52 1.7 Allowed 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 124.882 1.273 . . . . 0.0 111.802 179.94 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 59.6 m-20 47.15 70.71 1.92 Allowed Pre-proline 0 CA--C 1.551 1.007 0 C-N-CA 127.006 2.122 . . . . 0.0 114.59 171.828 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 88.8 Cg_endo -69.35 0.39 5.4 Favored 'Trans proline' 0 CA--C 1.542 0.893 0 C-N-CA 124.21 3.274 . . . . 0.0 115.455 -173.634 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -134.93 33.14 3.17 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 126.408 1.883 . . . . 0.0 113.626 -178.65 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -99.58 -2.08 36.59 Favored 'General case' 0 N--CA 1.477 0.898 0 N-CA-C 114.407 1.262 . . . . 0.0 114.407 172.855 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -131.5 -60.78 0.93 Allowed 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 124.782 1.233 . . . . 0.0 113.458 -160.361 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.8 pp -106.45 9.66 9.35 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 C-N-CA 125.609 1.564 . . . . 0.0 112.937 -178.55 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 19.2 tt -46.11 129.06 2.45 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 124.632 1.173 . . . . 0.0 112.854 175.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -151.48 49.67 0.82 Allowed 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 125.683 1.593 . . . . 0.0 109.935 -179.646 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -115.71 15.56 16.46 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 124.347 1.059 . . . . 0.0 112.84 -170.378 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 15.9 tt -159.23 40.25 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 C-N-CA 126.692 1.997 . . . . 0.0 112.272 -175.815 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -139.92 -42.59 0.43 Allowed 'General case' 0 N--CA 1.476 0.85 0 N-CA-C 115.914 1.82 . . . . 0.0 115.914 -170.574 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 48.5 tttm -133.7 37.96 3.26 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 125.588 1.555 . . . . 0.0 112.624 -166.106 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -129.23 156.76 43.45 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 125.329 1.452 . . . . 0.0 112.95 -172.93 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -94.62 174.86 6.91 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 125.359 1.464 . . . . 0.0 113.405 179.081 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 28.4 m120 -129.26 67.52 1.43 Allowed 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.912 1.685 . . . . 0.0 111.511 -172.496 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 36.0 m-20 -85.24 39.95 0.8 Allowed 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 125.251 1.421 . . . . 0.0 113.554 -177.805 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 38.0 m -80.45 71.37 7.28 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.662 1.185 . . . . 0.0 112.816 -172.325 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 90.05 91.97 1.23 Allowed Glycine 0 CA--C 1.531 1.04 0 C-N-CA 125.693 1.615 . . . . 0.0 112.494 -178.255 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 12.8 p -146.95 137.05 17.21 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 C-N-CA 125.522 1.529 . . . . 0.0 111.073 178.358 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 10.9 m 63.11 164.01 0.11 Allowed 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 126.631 1.972 . . . . 0.0 114.568 -179.83 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -124.61 32.5 5.45 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 126.325 1.85 . . . . 0.0 114.235 -176.876 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -90.89 134.94 29.41 Favored Pre-proline 0 CA--C 1.549 0.934 0 C-N-CA 125.062 1.345 . . . . 0.0 112.339 -177.873 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -76.75 -27.73 7.03 Favored 'Trans proline' 0 CA--C 1.542 0.893 0 C-N-CA 122.953 2.435 . . . . 0.0 112.631 173.756 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 65.2 tp -149.04 -59.19 0.22 Allowed 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 125.268 1.427 . . . . 0.0 111.75 173.881 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 87.1 p -152.79 149.43 28.32 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 126.992 2.117 . . . . 0.0 110.466 178.942 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 62.6 t 59.88 144.74 0.06 OUTLIER Pre-proline 0 N--CA 1.484 1.246 0 C-N-CA 126.803 2.041 . . . . 0.0 112.155 -160.923 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 69.2 Cg_endo -68.24 75.64 0.71 Allowed 'Trans proline' 0 CA--C 1.545 1.06 0 C-N-CA 123.524 2.816 . . . . 0.0 111.907 175.234 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 57.44 90.64 0.09 OUTLIER Pre-proline 0 N--CA 1.475 0.783 0 C-N-CA 128.942 2.897 . . . . 0.0 112.555 -175.961 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo -79.11 137.76 13.85 Favored 'Trans proline' 0 CA--C 1.541 0.853 0 C-N-CA 122.644 2.229 . . . . 0.0 111.273 169.086 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 49.1 mtmt -69.71 117.41 11.28 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 123.79 0.836 . . . . 0.0 111.307 175.598 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.5 pp -148.47 149.31 31.45 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 125.537 1.535 . . . . 0.0 112.37 179.156 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 58.2 mt-10 -146.67 77.6 1.47 Allowed 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 125.725 1.61 . . . . 0.0 110.289 174.178 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -118.42 111.04 18.17 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.917 1.287 . . . . 0.0 111.988 -174.795 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 62.8 mt -141.71 161.79 37.07 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 127.364 2.266 . . . . 0.0 112.015 -178.878 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 66.0 m -71.33 164.3 26.01 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 123.295 0.638 . . . . 0.0 110.491 170.889 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -56.6 -44.72 81.4 Favored 'General case' 0 N--CA 1.477 0.901 0 O-C-N 120.633 -1.292 . . . . 0.0 112.974 -174.669 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 10.7 tt0 -68.82 -43.1 76.24 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 123.763 0.825 . . . . 0.0 110.989 175.752 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 85.0 mt-30 -61.13 -42.44 98.54 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 122.914 0.486 . . . . 0.0 111.968 178.349 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 40.1 ttmt -59.94 -39.07 84.26 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 124.073 0.949 . . . . 0.0 111.232 176.139 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 45.2 mt -68.26 -41.83 84.1 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 CA-C-O 118.121 -0.942 . . . . 0.0 111.386 174.386 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 48.3 mt -64.3 -44.66 97.32 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.982 0 CA-C-N 120.777 1.626 . . . . 0.0 110.48 178.555 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -56.02 -49.41 73.75 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 124.799 1.24 . . . . 0.0 110.195 176.54 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -65.52 -52.34 53.37 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.177 0.991 . . . . 0.0 113.024 178.185 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 19.6 mm-40 -62.24 -26.95 68.66 Favored 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 112.925 0.713 . . . . 0.0 112.925 -179.137 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -70.38 -55.28 9.48 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 123.576 0.751 . . . . 0.0 111.126 175.875 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 44.6 mt -60.57 -35.11 61.24 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.553 0 C-N-CA 124.958 1.303 . . . . 0.0 111.48 175.571 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -68.51 -21.46 64.58 Favored 'General case' 0 CA--C 1.545 0.765 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 176.761 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -95.92 -30.2 13.76 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.666 1.187 . . . . 0.0 113.029 178.963 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 6.0 m -122.27 -25.21 2.3 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.003 0 CA-C-N 119.651 1.114 . . . . 0.0 113.946 -173.966 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 94.07 142.38 12.19 Favored Glycine 0 CA--C 1.533 1.21 0 C-N-CA 125.303 1.43 . . . . 0.0 113.213 -172.694 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 55.0 tp -60.03 -16.85 34.43 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 127.046 2.139 . . . . 0.0 115.503 -171.879 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 7.9 pm0 -99.05 -10.15 22.97 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 127.732 2.413 . . . . 0.0 113.825 179.74 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 80.9 m-20 -107.18 -14.29 14.94 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.86 1.264 . . . . 0.0 114.111 178.907 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 26.5 pt -63.27 157.14 4.39 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 C-N-CA 123.267 0.627 . . . . 0.0 111.276 164.679 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -130.09 145.93 51.72 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.523 1.129 . . . . 0.0 110.035 175.28 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -61.73 -26.82 68.29 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 123.773 0.829 . . . . 0.0 112.271 177.288 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.9 mp -69.99 -40.08 78.18 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.454 0 C-N-CA 125.993 1.717 . . . . 0.0 110.519 175.857 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 90.8 m -80.78 -41.31 23.63 Favored 'General case' 0 C--O 1.223 -0.292 0 O-C-N 121.64 -0.663 . . . . 0.0 109.522 179.209 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 17.0 tp -64.77 -35.65 81.78 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 125.014 1.326 . . . . 0.0 111.946 177.026 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.404 ' HA ' HG13 ' A' ' 66' ' ' ILE . 60.2 p -60.38 -24.62 65.26 Favored 'General case' 0 N--CA 1.476 0.841 0 CA-C-N 118.893 0.77 . . . . 0.0 113.006 170.449 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -100.94 -31.03 11.32 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 125.3 1.44 . . . . 0.0 114.107 -177.119 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 54.9 mmtt -63.76 -34.51 78.06 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 125.331 1.452 . . . . 0.0 111.582 177.875 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.4 mp -117.67 4.23 12.33 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 124.987 1.315 . . . . 0.0 114.415 -175.165 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 21.6 m-80 57.58 60.96 2.62 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 126.276 1.831 . . . . 0.0 113.375 -178.591 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.404 HG13 ' HA ' ' A' ' 61' ' ' SER . 1.1 pt -133.48 174.8 12.64 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.843 0 C-N-CA 126.771 2.028 . . . . 0.0 111.946 -171.536 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.3 p -76.72 157.9 31.36 Favored 'General case' 0 N--CA 1.478 0.945 0 O-C-N 121.096 -1.003 . . . . 0.0 111.352 173.082 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 89.5 t -62.92 -28.47 45.09 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 CA-C-O 118.838 -0.601 . . . . 0.0 111.421 173.637 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 65.3 mm-40 -81.75 -36.62 28.34 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 120.307 1.412 . . . . 0.0 110.825 -178.872 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 5.2 tmtm? -62.6 -44.67 95.73 Favored 'General case' 0 N--CA 1.464 0.268 0 C-N-CA 125.456 1.503 . . . . 0.0 110.348 175.249 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -66.25 -48.74 69.51 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.989 1.716 . . . . 0.0 112.757 173.927 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -71.12 -27.95 63.95 Favored 'General case' 0 CA--C 1.515 -0.376 0 O-C-N 120.976 -1.077 . . . . 0.0 111.673 -173.388 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -60.59 -36.6 78.93 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 119.929 -0.708 . . . . 0.0 111.306 178.029 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 23.9 m-85 -61.28 -41.22 96.6 Favored 'General case' 0 N--CA 1.463 0.2 0 O-C-N 121.312 -0.867 . . . . 0.0 111.742 174.063 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 61.1 mt -70.44 -29.12 37.51 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.643 0 C-N-CA 124.683 1.193 . . . . 0.0 110.903 179.598 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 7.3 tptm -76.49 -35.16 58.54 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 125.169 1.388 . . . . 0.0 111.862 174.707 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 96.0 m-20 -85.14 -53.43 5.27 Favored 'General case' 0 N--CA 1.462 0.153 0 C-N-CA 126.405 1.882 . . . . 0.0 110.338 -172.775 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 61.2 m -99.43 107.67 19.95 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 124.96 1.304 . . . . 0.0 111.317 172.177 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 5.0 t-20 -144.34 119.97 10.45 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.133 0.973 . . . . 0.0 111.015 -171.001 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 7.1 mpt_? 55.72 -23.33 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.706 0 C-N-CA 128.327 2.651 . . . . 0.0 117.259 -169.052 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 6.9 tt -86.99 -39.97 15.19 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 126.545 1.938 . . . . 0.0 112.765 -172.32 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 70.07 -133.29 24.35 Favored Glycine 0 CA--C 1.531 1.085 0 C-N-CA 123.362 0.506 . . . . 0.0 112.46 -175.501 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.08 -56.63 4.1 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.826 0.85 . . . . 0.0 109.133 174.663 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 1.7 t -169.0 124.7 0.9 Allowed 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 126.005 1.722 . . . . 0.0 109.664 172.417 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 52.1 m-80 -138.79 151.77 47.34 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 124.935 1.294 . . . . 0.0 111.935 178.928 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 53.5 t30 -147.18 174.11 11.9 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 126.233 1.813 . . . . 0.0 110.486 -177.653 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 8.6 tp 60.02 28.59 18.15 Favored 'General case' 0 CA--C 1.551 0.986 0 C-N-CA 125.329 1.451 . . . . 0.0 113.85 179.29 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 20.0 ptmt -129.21 2.52 5.18 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 126.027 1.731 . . . . 0.0 114.68 -176.939 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 12.6 t -156.76 131.15 8.63 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 125.41 1.484 . . . . 0.0 109.966 -179.629 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -136.69 6.17 0.85 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.812 0 C-N-CA 126.358 1.863 . . . . 0.0 112.906 179.15 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 66.52 7.25 39.34 Favored Glycine 0 CA--C 1.539 1.581 0 O-C-N 120.792 -1.192 . . . . 0.0 114.709 -170.689 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 13.7 mm 52.19 36.6 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.008 0 C-N-CA 126.894 2.078 . . . . 0.0 111.623 178.062 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 54.66 25.36 6.33 Favored 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 127.004 2.121 . . . . 0.0 114.601 179.914 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 37.2 mt-30 -133.67 23.31 3.98 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 125.988 1.715 . . . . 0.0 112.626 -172.463 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -138.6 142.83 39.15 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 125.459 1.504 . . . . 0.0 111.403 -178.636 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 54.18 65.82 1.4 Allowed 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 126.094 1.758 . . . . 0.0 113.594 -179.225 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 21.0 t -130.17 72.49 0.43 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 C-N-CA 125.166 1.387 . . . . 0.0 110.428 179.272 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 45.4 t -163.82 -68.32 0.04 OUTLIER 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.766 0.826 . . . . 0.0 113.013 172.638 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 17.1 t -74.05 -31.92 63.09 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 123.611 0.765 . . . . 0.0 112.786 -175.403 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 97.2 mtp -127.29 137.25 52.8 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 125.949 1.7 . . . . 0.0 109.556 169.524 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 17.7 tt0 -153.85 41.66 0.52 Allowed 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 124.616 1.166 . . . . 0.0 111.046 -177.317 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 52.41 -141.87 0.8 Allowed 'General case' 0 CA--C 1.552 1.045 0 C-N-CA 125.233 1.413 . . . . 0.0 112.253 -165.694 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 66.9 mttm -123.37 154.42 38.99 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 125.777 1.631 . . . . 0.0 111.512 177.294 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 49.1 m -121.77 156.73 32.54 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 125.566 1.546 . . . . 0.0 112.407 -176.486 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 1.8 pmm? -142.29 161.39 38.15 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 125.583 1.553 . . . . 0.0 112.317 177.117 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 3.6 m -142.89 144.27 32.39 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 124.867 1.267 . . . . 0.0 110.371 172.453 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 8.1 t-105 . . . . . 0 C--O 1.253 1.276 0 C-N-CA 125.23 1.412 . . . . 0.0 112.716 -174.216 . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.574 0 N-CA-C 111.893 -0.483 . . . . 0.0 111.893 . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 19.6 m -66.93 -35.4 79.9 Favored 'General case' 0 N--CA 1.477 0.923 0 N-CA-C 114.639 1.348 . . . . 0.0 114.639 -169.245 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 28.3 t60 -151.96 105.7 3.12 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 124.745 1.218 . . . . 0.0 110.571 178.666 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 35.1 ttp -148.18 40.74 0.96 Allowed 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 124.16 0.984 . . . . 0.0 113.0 -177.769 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -154.75 148.35 25.31 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 113.066 0.765 . . . . 0.0 113.066 -178.593 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 30.4 t -156.46 130.69 8.64 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 125.401 1.48 . . . . 0.0 110.641 175.242 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 16.9 ttt -151.21 19.83 0.76 Allowed 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 124.636 1.174 . . . . 0.0 112.716 -177.046 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 11.6 t0 -138.97 121.68 10.56 Favored Pre-proline 0 CA--C 1.55 0.981 0 O-C-N 120.626 -1.296 . . . . 0.0 112.344 -170.053 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_endo -83.83 -2.32 10.26 Favored 'Trans proline' 0 C--N 1.352 0.726 0 C-N-CA 123.768 2.979 . . . . 0.0 114.971 179.054 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 75.7 mt -107.54 41.59 1.48 Allowed 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.867 1.667 . . . . 0.0 112.173 -176.82 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -106.91 0.83 24.13 Favored 'General case' 0 N--CA 1.476 0.873 0 N-CA-C 114.779 1.4 . . . . 0.0 114.779 178.345 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -120.05 -56.87 1.98 Allowed 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 124.396 1.079 . . . . 0.0 113.328 -167.975 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.0 pp -129.1 14.7 2.67 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.925 0 C-N-CA 126.176 1.791 . . . . 0.0 112.988 -171.888 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 14.1 tt -41.08 130.4 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.917 0 C-N-CA 125.496 1.518 . . . . 0.0 112.851 177.824 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 35.3 t30 -141.71 0.63 1.45 Allowed 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 115.332 1.604 . . . . 0.0 115.332 -176.881 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -85.1 11.25 10.08 Favored 'General case' 0 CA--C 1.546 0.805 0 N-CA-C 114.601 1.334 . . . . 0.0 114.601 -173.777 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 13.5 tt -147.97 27.17 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.913 0 C-N-CA 125.533 1.533 . . . . 0.0 113.694 -170.989 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 58.5 mtmt -122.98 -40.62 2.4 Favored 'General case' 0 N--CA 1.477 0.909 0 N-CA-C 115.311 1.597 . . . . 0.0 115.311 179.392 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 22.0 ttmm -146.75 144.74 29.61 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 125.126 1.37 . . . . 0.0 112.358 -177.755 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -109.75 60.47 0.6 Allowed 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 125.823 1.649 . . . . 0.0 110.869 179.224 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -127.43 7.29 6.38 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 125.06 1.344 . . . . 0.0 114.281 -175.393 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.5 t-20 -97.67 116.1 29.23 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 124.543 1.137 . . . . 0.0 111.645 -177.327 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 20.2 m-20 -144.69 134.61 23.81 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 125.918 1.687 . . . . 0.0 110.483 176.645 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 21.4 t -152.47 101.33 2.65 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 124.145 0.978 . . . . 0.0 111.081 173.652 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 69.37 35.09 75.5 Favored Glycine 0 N--CA 1.473 1.108 0 C-N-CA 124.543 1.068 . . . . 0.0 115.742 171.395 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 92.9 t -88.86 142.73 12.47 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.385 0 C-N-CA 125.101 1.361 . . . . 0.0 110.985 -177.863 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 2.8 t -130.38 -177.24 4.24 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 125.649 1.58 . . . . 0.0 111.809 174.503 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -74.95 25.01 0.09 Allowed 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 116.895 2.183 . . . . 0.0 116.895 -173.885 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -90.37 131.09 39.43 Favored Pre-proline 0 CA--C 1.55 0.953 0 C-N-CA 126.126 1.77 . . . . 0.0 112.512 -172.163 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -79.27 -38.69 0.39 Allowed 'Trans proline' 0 CA--C 1.541 0.84 0 C-N-CA 122.629 2.219 . . . . 0.0 112.885 178.055 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 24.7 tp -156.35 92.34 1.32 Allowed 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 125.441 1.496 . . . . 0.0 110.141 173.245 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 24.3 p 54.69 28.54 10.22 Favored 'General case' 0 N--CA 1.475 0.81 0 N-CA-C 116.949 2.203 . . . . 0.0 116.949 166.839 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 5.8 p -152.06 146.12 18.27 Favored Pre-proline 0 N--CA 1.476 0.845 0 C-N-CA 125.964 1.706 . . . . 0.0 110.623 -170.686 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_endo -75.59 60.71 5.94 Favored 'Trans proline' 0 CA--C 1.548 1.21 0 C-N-CA 123.933 3.089 . . . . 0.0 112.275 175.836 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 60.66 124.91 0.02 OUTLIER Pre-proline 0 N--CA 1.479 0.997 0 C-N-CA 129.052 2.941 . . . . 0.0 114.372 -172.873 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -84.03 165.92 13.07 Favored 'Trans proline' 0 CA--C 1.541 0.864 0 C-N-CA 123.381 2.721 . . . . 0.0 112.586 175.445 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 21.8 ptmt -99.83 126.99 46.02 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 126.038 1.735 . . . . 0.0 109.56 166.387 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 8.1 mp -118.38 150.29 39.78 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 124.832 1.253 . . . . 0.0 112.564 178.821 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -147.27 45.77 1.14 Allowed 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.632 1.573 . . . . 0.0 111.479 173.339 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -138.56 102.62 4.65 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 125.638 1.575 . . . . 0.0 112.224 -171.553 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.9 mt -129.39 154.87 46.5 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 128.548 2.739 . . . . 0.0 109.227 167.796 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 23.3 t -71.95 163.46 27.81 Favored 'General case' 0 N--CA 1.48 1.052 0 O-C-N 121.878 -0.514 . . . . 0.0 110.26 170.253 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -56.26 -45.48 80.05 Favored 'General case' 0 N--CA 1.477 0.924 0 O-C-N 120.257 -1.527 . . . . 0.0 112.863 -174.175 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 9.4 tt0 -71.18 -43.15 68.03 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 123.526 0.73 . . . . 0.0 111.553 175.675 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 89.3 mt-30 -61.29 -38.28 86.21 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 123.302 0.641 . . . . 0.0 111.885 178.587 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 41.2 ttmt -62.91 -44.23 96.65 Favored 'General case' 0 N--CA 1.464 0.249 0 C-N-CA 124.86 1.264 . . . . 0.0 110.731 175.732 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 49.8 mt -65.65 -43.97 93.7 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 CA-C-O 118.45 -0.786 . . . . 0.0 110.924 177.117 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 52.6 mt -63.97 -46.44 94.01 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 CA-C-N 120.078 1.308 . . . . 0.0 110.299 179.296 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -59.04 -48.9 79.91 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 125.14 1.376 . . . . 0.0 110.931 178.263 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -63.82 -53.04 56.98 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 124.954 1.301 . . . . 0.0 112.185 177.096 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 17.0 mm-40 -60.13 -30.45 69.3 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 119.088 0.858 . . . . 0.0 112.5 179.476 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -66.2 -58.83 4.53 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 118.988 0.813 . . . . 0.0 110.705 175.592 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 70.6 mt -62.72 -35.02 68.72 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.329 0 C-N-CA 126.573 1.949 . . . . 0.0 111.622 179.884 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -74.65 -29.42 61.25 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.05 0.94 . . . . 0.0 112.415 178.98 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -82.69 -40.0 21.23 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.778 0.831 . . . . 0.0 112.183 174.621 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.8 m -104.15 -12.55 9.15 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.086 0 N-CA-C 114.386 1.254 . . . . 0.0 114.386 -173.612 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 91.59 27.85 16.16 Favored Glycine 0 CA--C 1.534 1.253 0 C-N-CA 125.108 1.337 . . . . 0.0 115.805 164.589 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 56.13 9.08 0.45 Allowed 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 127.427 2.291 . . . . 0.0 115.027 -173.9 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 2.5 pt20 -117.92 -7.96 10.84 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 125.798 1.639 . . . . 0.0 113.435 -167.087 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 67.3 m-80 -123.28 -1.4 8.68 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 125.094 1.358 . . . . 0.0 113.305 178.339 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 21.7 pt -72.16 150.39 8.7 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 CA-C-O 121.016 0.436 . . . . 0.0 111.417 177.734 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -138.04 143.61 40.62 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 124.448 1.099 . . . . 0.0 109.398 177.687 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -61.39 -26.62 67.97 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 118.787 0.722 . . . . 0.0 112.468 -179.418 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -66.96 -42.99 89.48 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 C-N-CA 125.654 1.582 . . . . 0.0 110.548 174.601 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 81.6 m -79.77 -46.46 16.94 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 123.681 0.793 . . . . 0.0 109.192 -177.466 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 17.3 tp -62.59 -34.69 77.5 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.561 1.544 . . . . 0.0 112.511 177.563 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.412 ' HA ' HG13 ' A' ' 66' ' ' ILE . 60.2 p -61.95 -25.2 67.46 Favored 'General case' 0 N--CA 1.475 0.81 0 N-CA-C 113.222 0.823 . . . . 0.0 113.222 171.667 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -101.55 -24.67 14.1 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 125.434 1.493 . . . . 0.0 114.115 -178.112 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 21.0 mmmt -65.74 -34.87 79.19 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.9 1.28 . . . . 0.0 111.497 172.82 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 49.6 mt -115.91 -1.1 12.64 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 125.931 1.692 . . . . 0.0 113.52 -169.319 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 26.7 m-80 57.0 61.63 2.52 Favored 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 126.683 1.993 . . . . 0.0 113.542 -177.342 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.412 HG13 ' HA ' ' A' ' 61' ' ' SER . 0.6 OUTLIER -136.17 178.18 5.4 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 C-N-CA 127.118 2.167 . . . . 0.0 111.548 -171.838 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -78.25 159.13 28.67 Favored 'General case' 0 N--CA 1.478 0.975 0 O-C-N 121.047 -1.033 . . . . 0.0 111.392 172.266 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 98.6 t -63.49 -31.44 52.91 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.955 0 O-C-N 121.605 -0.685 . . . . 0.0 111.187 172.808 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -78.4 -35.95 46.44 Favored 'General case' 0 N--CA 1.471 0.584 0 O-C-N 120.895 -1.128 . . . . 0.0 110.065 -177.353 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 5.4 tmtm? -65.24 -49.96 67.65 Favored 'General case' 0 C--O 1.223 -0.292 0 C-N-CA 125.316 1.447 . . . . 0.0 110.379 174.255 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -58.53 -42.9 88.81 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 125.036 1.334 . . . . 0.0 112.605 174.23 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 34.5 ttmt -71.73 -28.13 63.46 Favored 'General case' 0 CA--C 1.519 -0.219 0 CA-C-O 118.076 -0.964 . . . . 0.0 111.577 -176.586 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -50.58 -44.6 56.89 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 118.973 0.806 . . . . 0.0 111.145 175.849 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 40.3 m-85 -65.54 -38.1 88.63 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.815 0.846 . . . . 0.0 110.782 -177.191 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 35.5 mt -69.39 -27.63 35.13 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.674 0 C-N-CA 124.916 1.286 . . . . 0.0 110.724 176.967 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 45.1 mttt -79.11 -31.88 44.35 Favored 'General case' 0 N--CA 1.47 0.563 0 O-C-N 120.393 -1.442 . . . . 0.0 114.553 176.51 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 24.7 p30 -105.09 -45.58 4.49 Favored 'General case' 0 N--CA 1.471 0.625 0 CA-C-N 119.844 1.202 . . . . 0.0 112.351 -176.155 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 2.5 t -73.01 -16.1 61.51 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 115.326 1.602 . . . . 0.0 115.326 -176.326 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 8.6 p30 -62.94 -18.25 62.92 Favored 'General case' 0 N--CA 1.478 0.931 0 O-C-N 120.121 -1.612 . . . . 0.0 114.957 -176.15 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 1.6 mpt_? -66.59 -13.48 61.12 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 125.231 1.412 . . . . 0.0 113.508 174.746 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 8.0 tp -70.86 -31.85 68.67 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 124.796 1.239 . . . . 0.0 113.306 178.5 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -85.08 -163.72 37.52 Favored Glycine 0 CA--C 1.541 1.695 0 C-N-CA 124.189 0.899 . . . . 0.0 114.55 -179.367 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 74.6 mtp85 -118.32 -101.68 0.43 Allowed 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 125.644 1.578 . . . . 0.0 111.605 177.966 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 5.7 t -155.57 120.2 4.71 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 125.592 1.557 . . . . 0.0 110.438 -179.124 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 64.9 m-80 -143.25 18.79 1.91 Allowed 'General case' 0 CA--C 1.553 1.059 0 C-N-CA 124.508 1.123 . . . . 0.0 113.654 -174.207 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 53.7 t30 -108.29 16.33 23.27 Favored 'General case' 0 CA--C 1.552 1.039 0 C-N-CA 125.166 1.386 . . . . 0.0 113.78 -169.886 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 9.7 mt -145.24 163.17 35.25 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 126.455 1.902 . . . . 0.0 111.194 -173.262 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 54.2 pttt -121.94 10.89 10.24 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 126.587 1.955 . . . . 0.0 113.362 -176.838 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 13.7 t -146.3 124.83 12.42 Favored 'General case' 0 C--O 1.233 0.219 0 C-N-CA 125.407 1.483 . . . . 0.0 109.603 174.378 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -139.37 10.46 0.62 Allowed 'Isoleucine or valine' 0 CA--C 1.548 0.867 0 C-N-CA 125.9 1.68 . . . . 0.0 113.032 -175.584 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 77.72 -12.5 15.88 Favored Glycine 0 N--CA 1.477 1.381 0 O-C-N 120.784 -1.198 . . . . 0.0 114.497 -166.326 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 4.9 mp 54.53 93.58 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.549 0 C-N-CA 127.059 2.144 . . . . 0.0 109.788 -163.696 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 74.1 mt -60.98 94.58 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.957 1.303 . . . . 0.0 112.148 -175.402 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 84.9 mt-30 -111.73 -69.11 0.89 Allowed 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 125.196 1.398 . . . . 0.0 112.22 -179.581 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 2.7 pp20? -153.68 162.43 41.26 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 125.124 1.37 . . . . 0.0 112.234 178.268 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -147.12 57.12 1.14 Allowed 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 124.155 0.982 . . . . 0.0 111.939 175.617 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 26.5 t -134.87 133.54 53.85 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.94 0 C-N-CA 124.126 0.97 . . . . 0.0 112.14 -179.361 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 9.2 t -114.38 78.37 1.15 Allowed 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 125.015 1.326 . . . . 0.0 111.294 177.025 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 6.1 t 47.37 74.52 0.16 Allowed 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 126.848 2.059 . . . . 0.0 114.364 175.821 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 91.4 mtp 54.21 61.74 2.9 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 125.743 1.617 . . . . 0.0 113.485 -176.032 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -79.05 47.31 0.76 Allowed 'General case' 0 CA--C 1.553 1.07 0 C-N-CA 125.126 1.371 . . . . 0.0 112.037 174.808 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -147.74 155.73 42.01 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 126.165 1.786 . . . . 0.0 112.02 -176.213 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 36.6 mtmm -107.78 96.03 6.1 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 125.397 1.479 . . . . 0.0 111.002 -176.976 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 48.8 m -137.59 60.24 1.64 Allowed 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 125.313 1.445 . . . . 0.0 111.449 -174.456 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 28.5 ptm -139.51 158.63 43.8 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 124.901 1.281 . . . . 0.0 113.178 -178.418 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 3.3 m -144.77 145.26 31.58 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 125.302 1.441 . . . . 0.0 110.352 172.214 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 15.6 t-105 . . . . . 0 C--O 1.254 1.3 0 C-N-CA 124.936 1.294 . . . . 0.0 112.825 -176.563 . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.482 0 N-CA-C 111.242 -0.743 . . . . 0.0 111.242 . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 33.6 t -153.04 -52.63 0.11 Allowed 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 124.275 1.03 . . . . 0.0 112.205 176.106 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 35.2 t-80 -147.74 159.34 43.91 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 125.339 1.456 . . . . 0.0 111.498 176.435 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 25.0 ttp -102.3 15.06 30.27 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 115.106 1.521 . . . . 0.0 115.106 -169.04 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -150.51 155.93 40.45 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 114.85 1.426 . . . . 0.0 114.85 -176.62 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 58.3 m -141.43 118.97 11.59 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 127.06 2.144 . . . . 0.0 108.8 -178.368 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 83.6 mtp -139.62 51.25 1.75 Allowed 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.735 1.214 . . . . 0.0 111.175 -167.338 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -119.99 148.25 46.31 Favored Pre-proline 0 CA--C 1.545 0.758 0 C-N-CA 125.552 1.541 . . . . 0.0 112.194 -170.852 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -69.24 -19.08 39.08 Favored 'Trans proline' 0 C--N 1.35 0.632 0 C-N-CA 123.284 2.656 . . . . 0.0 114.745 -175.04 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.2 pt? -95.11 12.41 28.77 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 126.271 1.828 . . . . 0.0 114.343 -179.585 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -71.05 -8.04 50.62 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 115.189 1.551 . . . . 0.0 115.189 -176.809 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -116.72 -63.31 1.46 Allowed 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 124.796 1.238 . . . . 0.0 113.243 -163.631 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.3 pp -103.15 -18.09 6.79 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.85 0 C-N-CA 124.72 1.208 . . . . 0.0 113.053 -175.875 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . 0.287 11.3 tt 35.99 48.81 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.167 0 C-N-CA 127.301 2.24 . . . . 0.0 116.332 170.903 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -126.33 88.9 2.92 Favored 'General case' 0 CA--C 1.542 0.658 0 O-C-N 120.844 -1.16 . . . . 0.0 111.911 -177.136 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -138.17 79.98 1.77 Allowed 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.84 1.256 . . . . 0.0 110.813 -178.707 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . 0.358 9.5 tt 50.31 26.23 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.205 0 C-N-CA 127.708 2.403 . . . . 0.0 115.124 179.458 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 3.8 ttpt -124.72 -21.69 4.74 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 124.949 1.299 . . . . 0.0 114.462 -178.316 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 80.8 tttt -128.69 68.93 1.38 Allowed 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 125.525 1.53 . . . . 0.0 111.727 -176.26 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 4.1 tm-20 -146.87 130.34 16.77 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 125.137 1.375 . . . . 0.0 109.886 -178.063 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -151.32 153.61 35.14 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.546 1.138 . . . . 0.0 112.96 -179.126 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 30.1 t30 -94.61 154.41 17.38 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.305 1.442 . . . . 0.0 112.576 179.859 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 31.5 m-20 -80.0 54.74 1.96 Allowed 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 125.472 1.509 . . . . 0.0 112.511 175.817 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 49.0 m -79.0 98.95 6.65 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.619 1.168 . . . . 0.0 111.803 -177.13 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 75.53 98.31 0.13 Allowed Glycine 0 CA--C 1.535 1.305 0 C-N-CA 125.319 1.438 . . . . 0.0 113.111 -179.376 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 58.2 t -132.68 131.14 59.73 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.961 0 C-N-CA 125.085 1.354 . . . . 0.0 110.482 -177.551 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 52.79 -154.8 0.2 Allowed 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 125.737 1.615 . . . . 0.0 112.694 -178.39 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 44.9 mt -112.17 24.47 12.56 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 126.411 1.885 . . . . 0.0 112.35 -175.818 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -153.49 98.56 2.68 Favored Pre-proline 0 CA--C 1.55 0.965 0 C-N-CA 125.523 1.529 . . . . 0.0 111.098 -166.068 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 90.3 Cg_endo -78.34 -15.94 13.92 Favored 'Trans proline' 0 CA--C 1.543 0.934 0 C-N-CA 123.228 2.619 . . . . 0.0 113.124 178.722 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.406 ' HG ' ' H ' ' A' ' 26' ' ' SER . 6.7 tp -144.51 -157.94 0.84 Allowed 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 127.107 2.163 . . . . 0.0 109.083 178.541 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 26' ' ' SER . . . . . 0.406 ' H ' ' HG ' ' A' ' 25' ' ' LEU . 57.3 p -75.12 35.61 0.11 Allowed 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 126.74 2.016 . . . . 0.0 114.594 178.707 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 7.9 p -156.7 142.59 12.86 Favored Pre-proline 0 CA--C 1.543 0.702 0 C-N-CA 126.561 1.944 . . . . 0.0 110.257 -172.518 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 90.5 Cg_endo -77.06 69.53 7.01 Favored 'Trans proline' 0 CA--C 1.547 1.174 0 C-N-CA 123.655 2.903 . . . . 0.0 111.978 179.156 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 53.4 tptt 61.1 109.13 0.03 OUTLIER Pre-proline 0 N--CA 1.481 1.125 0 C-N-CA 129.346 3.058 . . . . 0.0 113.597 -176.12 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -76.86 156.3 34.78 Favored 'Trans proline' 0 C--N 1.352 0.741 0 C-N-CA 122.788 2.326 . . . . 0.0 111.873 -178.847 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 20.0 pttp -64.52 150.82 45.97 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.929 0.892 . . . . 0.0 112.984 -179.946 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 42.8 tp -143.57 130.33 20.34 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 124.813 1.245 . . . . 0.0 110.88 175.695 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 5.2 mp0 -122.1 69.04 0.94 Allowed 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.233 1.413 . . . . 0.0 110.736 176.116 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -127.29 84.6 2.27 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.133 1.373 . . . . 0.0 111.707 -173.204 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.4 mt -136.3 151.74 49.95 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 127.263 2.225 . . . . 0.0 109.898 178.089 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 67.1 m -74.3 165.09 25.77 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 123.199 0.6 . . . . 0.0 110.829 171.925 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -55.06 -43.99 74.35 Favored 'General case' 0 N--CA 1.48 1.037 0 O-C-N 120.665 -1.272 . . . . 0.0 113.54 -172.983 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 8.5 pt20 -77.82 -35.21 51.5 Favored 'General case' 0 N--CA 1.472 0.625 0 O-C-N 121.56 -0.713 . . . . 0.0 112.547 174.802 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 84.6 mt-30 -65.17 -38.47 90.63 Favored 'General case' 0 N--CA 1.466 0.369 0 O-C-N 121.616 -0.678 . . . . 0.0 111.397 178.961 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 23.4 ttmm -58.99 -42.34 89.78 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 124.555 1.142 . . . . 0.0 110.879 175.173 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 41.0 mt -71.01 -42.3 76.86 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.557 0 CA-C-O 118.265 -0.874 . . . . 0.0 110.977 178.818 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 43.3 mt -63.13 -44.34 99.38 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 CA-C-N 120.412 1.46 . . . . 0.0 110.215 177.246 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -59.0 -49.11 79.15 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 125.12 1.368 . . . . 0.0 110.897 178.069 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -63.25 -52.83 60.51 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 124.858 1.263 . . . . 0.0 112.435 176.374 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -58.52 -31.48 67.94 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-N 119.28 0.945 . . . . 0.0 112.771 179.205 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -66.83 -58.44 5.04 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 118.794 0.725 . . . . 0.0 110.593 177.296 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 72.3 mt -65.82 -33.48 63.89 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.442 0 C-N-CA 126.323 1.849 . . . . 0.0 111.615 -178.638 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -72.41 -26.83 62.01 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 123.693 0.797 . . . . 0.0 112.294 177.733 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -86.21 -40.88 15.14 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.039 0.935 . . . . 0.0 112.096 174.939 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.2 m -108.4 -5.57 10.7 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.241 0 N-CA-C 114.552 1.315 . . . . 0.0 114.552 -171.918 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 86.72 26.94 30.76 Favored Glycine 0 CA--C 1.532 1.1 0 C-N-CA 124.711 1.148 . . . . 0.0 115.519 160.543 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 55.99 10.11 0.55 Allowed 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 127.479 2.312 . . . . 0.0 115.322 -173.991 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 5.1 pt20 -123.18 -3.7 8.49 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 124.946 1.298 . . . . 0.0 113.694 -168.948 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 58.8 m-80 -122.43 0.88 9.52 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 124.995 1.318 . . . . 0.0 113.191 174.638 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 18.0 pt -76.97 154.25 5.59 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 C-N-CA 123.039 0.535 . . . . 0.0 111.593 175.963 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -139.82 143.65 36.93 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 124.805 1.242 . . . . 0.0 109.634 179.623 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -60.65 -27.09 67.54 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 118.871 0.76 . . . . 0.0 112.379 179.698 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -67.14 -48.45 78.71 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.463 0 C-N-CA 125.644 1.577 . . . . 0.0 110.194 175.574 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 76.9 m -78.33 -43.65 27.25 Favored 'General case' 0 C--O 1.224 -0.257 0 C-N-CA 123.477 0.711 . . . . 0.0 109.97 -176.659 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 18.6 tp -60.17 -34.58 73.78 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 125.375 1.47 . . . . 0.0 112.082 173.713 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.428 ' HA ' HG13 ' A' ' 66' ' ' ILE . 35.1 t -52.92 -36.14 59.24 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 124.363 1.065 . . . . 0.0 112.571 168.527 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -100.66 -22.82 14.8 Favored 'General case' 0 CA--C 1.533 0.299 0 N-CA-C 114.405 1.261 . . . . 0.0 114.405 -173.088 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 66.6 mmtt -63.99 -34.64 78.46 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 124.721 1.208 . . . . 0.0 111.947 174.953 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.5 mp -117.72 2.67 12.29 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 124.866 1.266 . . . . 0.0 114.076 -174.781 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 12.9 m-80 56.57 46.4 20.52 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 125.613 1.565 . . . . 0.0 112.763 -172.917 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.428 HG13 ' HA ' ' A' ' 61' ' ' SER . 9.9 pt -105.15 -171.99 0.36 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.619 0 C-N-CA 125.913 1.685 . . . . 0.0 111.11 -179.953 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -89.33 158.16 17.91 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 123.523 0.729 . . . . 0.0 110.41 170.081 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 49.7 t -59.1 -31.23 45.41 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.119 0 O-C-N 121.595 -0.69 . . . . 0.0 111.422 170.059 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -80.41 -35.95 34.44 Favored 'General case' 0 CA--C 1.53 0.211 0 O-C-N 121.139 -0.976 . . . . 0.0 110.184 -177.111 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 26.0 tttt -65.97 -44.71 84.14 Favored 'General case' 0 C--N 1.344 0.341 0 C-N-CA 123.393 0.677 . . . . 0.0 110.731 174.06 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -58.51 -49.56 76.95 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.673 1.589 . . . . 0.0 112.35 173.923 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 35.0 ttmt -68.88 -30.0 68.41 Favored 'General case' 0 N--CA 1.463 0.18 0 O-C-N 121.11 -0.994 . . . . 0.0 111.195 -177.152 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -56.15 -37.28 69.29 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 122.97 0.508 . . . . 0.0 112.362 175.311 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 48.6 m-85 -68.55 -45.13 72.96 Favored 'General case' 0 N--CA 1.463 0.218 0 C-N-CA 125.482 1.513 . . . . 0.0 110.609 176.092 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 79.7 mt -64.33 -31.53 53.88 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 C-N-CA 124.961 1.304 . . . . 0.0 111.35 -179.535 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 47.9 mtmt -81.81 -33.65 30.66 Favored 'General case' 0 N--CA 1.469 0.521 0 N-CA-C 113.875 1.065 . . . . 0.0 113.875 -178.188 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 5.7 p30 -86.92 -41.49 13.92 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 119.417 1.008 . . . . 0.0 111.31 173.944 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 8.5 t -105.57 104.85 14.66 Favored 'General case' 0 N--CA 1.456 -0.163 0 O-C-N 123.496 0.498 . . . . 0.0 110.882 -176.963 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -152.98 129.47 10.68 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 123.666 0.786 . . . . 0.0 111.014 -172.204 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 2.0 mpt_? 54.92 1.28 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.58 0 C-N-CA 126.463 1.905 . . . . 0.0 116.026 -169.62 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 29.3 tp -122.98 -44.04 2.2 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 124.832 1.253 . . . . 0.0 113.864 -164.057 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -77.07 95.47 1.16 Allowed Glycine 0 CA--C 1.533 1.175 0 CA-C-N 118.327 0.512 . . . . 0.0 113.171 -177.01 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 40.5 ttm-85 -94.91 -79.46 0.43 Allowed 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 123.985 0.914 . . . . 0.0 113.236 -176.013 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 15.3 t -160.67 26.86 0.15 Allowed 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 124.667 1.187 . . . . 0.0 112.285 -169.752 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 69.2 m-80 -130.77 126.88 37.51 Favored 'General case' 0 N--CA 1.472 0.641 0 O-C-N 120.487 -1.383 . . . . 0.0 111.477 -175.198 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 2.5 t30 -157.34 140.82 15.66 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 125.378 1.471 . . . . 0.0 111.112 175.879 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 4.8 mp -128.39 167.98 16.23 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 127.702 2.401 . . . . 0.0 110.198 178.715 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 4.9 ptpp? -118.36 8.27 12.15 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 126.28 1.832 . . . . 0.0 113.469 -177.556 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 15.3 t -148.55 132.37 17.02 Favored 'General case' 0 C--O 1.233 0.216 0 C-N-CA 125.504 1.522 . . . . 0.0 109.668 171.517 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -144.71 11.82 0.26 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.808 0 C-N-CA 126.608 1.963 . . . . 0.0 112.822 -173.57 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 65.79 11.59 54.55 Favored Glycine 0 CA--C 1.536 1.387 0 O-C-N 120.75 -1.219 . . . . 0.0 114.532 -172.31 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . 0.3 3.1 mp 52.89 33.27 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 C-N-CA 126.768 2.027 . . . . 0.0 111.889 -178.809 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 8.9 mp 51.37 27.7 3.86 Favored 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 127.484 2.313 . . . . 0.0 114.312 175.459 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 6.9 pt20 -129.11 10.4 5.84 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 125.152 1.381 . . . . 0.0 114.289 -172.416 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -74.22 155.59 38.15 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.148 0.979 . . . . 0.0 112.331 174.273 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 57.91 49.98 11.07 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 125.498 1.519 . . . . 0.0 114.41 179.671 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 45.3 t -130.27 137.52 56.14 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.743 0 C-N-CA 125.383 1.473 . . . . 0.0 110.546 176.066 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 13.7 t -136.81 -44.13 0.58 Allowed 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 123.829 0.851 . . . . 0.0 113.131 174.71 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 21.1 t -147.42 103.36 3.55 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.048 0.939 . . . . 0.0 111.826 175.101 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 24.8 mmt 52.13 31.92 9.73 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 126.04 1.736 . . . . 0.0 114.8 178.99 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 11.7 mt-10 -83.4 48.68 1.44 Allowed 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 125.657 1.583 . . . . 0.0 113.221 -176.227 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -119.23 155.44 31.71 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 126.642 1.977 . . . . 0.0 111.787 177.35 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 8.8 mptt -124.49 119.19 28.41 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 125.091 1.357 . . . . 0.0 110.667 -178.963 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 45.3 t -158.74 -65.94 0.08 Allowed 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 124.367 1.067 . . . . 0.0 111.814 175.432 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 25.2 mtm -150.12 164.67 35.0 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 126.42 1.888 . . . . 0.0 111.661 -174.644 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 9.9 t -114.3 166.77 11.32 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 125.63 1.572 . . . . 0.0 111.809 171.763 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 6.7 t-105 . . . . . 0 C--O 1.254 1.294 0 C-N-CA 125.566 1.546 . . . . 0.0 113.177 -168.495 . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.567 0 N-CA-C 112.284 -0.326 . . . . 0.0 112.284 . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 22.8 t -72.84 -41.52 64.74 Favored 'General case' 0 N--CA 1.476 0.835 0 N-CA-C 113.092 0.775 . . . . 0.0 113.092 -176.324 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 43.5 t-80 -153.17 156.75 39.17 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 125.396 1.478 . . . . 0.0 111.414 177.685 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 22.1 ttt -146.43 134.25 21.24 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 124.603 1.161 . . . . 0.0 111.336 177.441 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -150.23 174.1 13.2 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 124.892 1.277 . . . . 0.0 112.801 -178.512 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 9.3 t -132.02 160.25 36.43 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 125.822 1.649 . . . . 0.0 111.918 176.234 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 77.6 mtm -134.52 65.14 1.58 Allowed 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 125.523 1.529 . . . . 0.0 112.184 -168.58 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -128.84 75.04 80.49 Favored Pre-proline 0 CA--C 1.551 0.986 0 C-N-CA 124.981 1.312 . . . . 0.0 112.049 176.79 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 80.3 Cg_endo -78.9 -3.83 13.51 Favored 'Trans proline' 0 C--N 1.352 0.735 0 C-N-CA 123.973 3.115 . . . . 0.0 114.909 -179.834 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 94.1 mt -108.76 41.34 1.61 Allowed 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 126.279 1.832 . . . . 0.0 112.167 -177.261 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -107.14 -5.04 18.24 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 114.472 1.286 . . . . 0.0 114.472 178.035 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.21 -58.29 2.15 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 124.296 1.038 . . . . 0.0 113.027 -162.508 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.1 pp -129.04 15.11 2.69 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 C-N-CA 126.615 1.966 . . . . 0.0 112.713 -174.981 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 10.2 tt -41.55 124.35 0.49 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.995 0 C-N-CA 125.413 1.485 . . . . 0.0 112.488 177.121 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -147.11 29.87 0.96 Allowed 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 124.027 0.931 . . . . 0.0 112.996 -175.113 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -106.19 11.57 31.1 Favored 'General case' 0 N--CA 1.476 0.841 0 O-C-N 120.899 -1.126 . . . . 0.0 113.553 -179.321 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 15.5 tt -150.13 36.78 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.477 0.876 0 C-N-CA 126.509 1.924 . . . . 0.0 111.799 -175.343 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 2.9 tppt? -136.89 -37.55 0.66 Allowed 'General case' 0 N--CA 1.478 0.935 0 N-CA-C 115.309 1.596 . . . . 0.0 115.309 -176.175 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -151.02 151.12 31.58 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 126.556 1.942 . . . . 0.0 110.783 -179.923 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -138.01 143.13 40.44 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 124.969 1.308 . . . . 0.0 110.954 173.567 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -145.55 171.8 14.15 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 125.572 1.549 . . . . 0.0 111.678 179.825 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.8 t-20 -135.47 151.34 50.29 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 125.546 1.539 . . . . 0.0 111.668 -178.566 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 19.2 m-20 -122.14 136.71 54.95 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 125.507 1.523 . . . . 0.0 112.265 -178.938 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 21.4 t -82.75 101.41 10.88 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-O 121.72 0.771 . . . . 0.0 110.294 174.558 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 97.36 114.37 3.21 Favored Glycine 0 CA--C 1.531 1.049 0 C-N-CA 125.769 1.652 . . . . 0.0 112.649 -177.607 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 61.0 t -122.3 132.48 70.98 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 C-N-CA 126.413 1.885 . . . . 0.0 109.914 173.957 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 54.97 -161.9 0.15 Allowed 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 125.923 1.689 . . . . 0.0 113.299 -175.378 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 45.4 mt -130.02 32.21 4.56 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 126.113 1.765 . . . . 0.0 112.02 -164.227 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -126.78 81.03 69.79 Favored Pre-proline 0 CA--C 1.55 0.956 0 C-N-CA 124.129 0.972 . . . . 0.0 113.547 -156.691 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_endo -76.15 -27.65 8.04 Favored 'Trans proline' 0 CA--C 1.543 0.947 0 C-N-CA 123.728 2.952 . . . . 0.0 114.168 -178.047 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 1.1 tt -150.95 52.62 0.86 Allowed 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 124.049 0.94 . . . . 0.0 112.266 -173.786 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.2 t 56.66 37.78 29.06 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 124.817 1.247 . . . . 0.0 114.018 -179.009 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 10.0 p -157.7 144.46 13.18 Favored Pre-proline 0 N--CA 1.473 0.722 0 C-N-CA 126.466 1.906 . . . . 0.0 109.141 -171.908 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_endo -78.26 60.27 7.38 Favored 'Trans proline' 0 CA--C 1.548 1.193 0 C-N-CA 123.63 2.886 . . . . 0.0 112.667 -178.675 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 59.85 115.11 0.02 OUTLIER Pre-proline 0 N--CA 1.481 1.121 0 C-N-CA 128.532 2.733 . . . . 0.0 112.927 -172.314 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -95.06 137.51 0.82 Allowed 'Trans proline' 0 CA--C 1.538 0.711 0 C-N-CA 122.814 2.343 . . . . 0.0 111.282 178.644 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 35.6 mmtt -72.52 112.38 8.52 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 124.76 1.224 . . . . 0.0 111.253 175.686 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.5 pt? -141.36 161.3 38.22 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 125.661 1.585 . . . . 0.0 113.251 168.879 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -148.8 44.27 1.0 Allowed 'General case' 0 N--CA 1.474 0.758 0 CA-C-O 123.266 1.508 . . . . 0.0 112.759 179.152 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -95.66 98.69 10.67 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 125.186 1.395 . . . . 0.0 112.007 -171.183 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 6.9 mt -124.5 150.44 45.79 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 126.424 1.89 . . . . 0.0 110.796 -179.576 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 63.4 m -75.88 165.09 25.51 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 123.302 0.641 . . . . 0.0 110.528 171.628 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -55.15 -44.46 75.15 Favored 'General case' 0 N--CA 1.48 1.042 0 O-C-N 120.72 -1.237 . . . . 0.0 113.472 -173.526 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 8.9 pt20 -75.35 -36.64 60.95 Favored 'General case' 0 N--CA 1.469 0.51 0 O-C-N 121.601 -0.687 . . . . 0.0 112.486 175.306 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 76.4 mt-30 -65.75 -36.92 84.94 Favored 'General case' 0 N--CA 1.466 0.341 0 O-C-N 121.508 -0.745 . . . . 0.0 111.595 178.9 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 40.3 ttmt -61.59 -42.17 98.49 Favored 'General case' 0 N--CA 1.465 0.307 0 C-N-CA 124.405 1.082 . . . . 0.0 111.008 174.99 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 46.2 mt -69.03 -43.14 82.15 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 CA-C-O 118.449 -0.786 . . . . 0.0 111.045 176.732 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 44.0 mt -63.01 -44.25 99.54 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 CA-C-N 120.167 1.349 . . . . 0.0 110.343 178.73 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -59.53 -49.07 79.22 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.9 1.28 . . . . 0.0 110.794 176.586 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -67.42 -51.46 51.44 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 124.364 1.065 . . . . 0.0 112.799 -179.369 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 18.9 mm-40 -61.9 -24.12 66.75 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 118.968 0.804 . . . . 0.0 113.162 -178.385 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -70.29 -60.17 2.44 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 123.891 0.876 . . . . 0.0 110.841 174.031 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 64.7 mt -59.72 -35.15 58.24 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 C-N-CA 127.003 2.121 . . . . 0.0 111.762 177.846 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -70.86 -22.57 62.28 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 123.969 0.908 . . . . 0.0 113.116 178.143 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -94.9 -32.19 13.33 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.472 1.109 . . . . 0.0 112.731 178.013 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 4.5 m -118.57 -20.61 5.05 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.916 0 CA-C-N 119.552 1.069 . . . . 0.0 113.731 -173.461 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 83.2 141.98 4.54 Favored Glycine 0 CA--C 1.531 1.061 0 C-N-CA 124.787 1.184 . . . . 0.0 112.33 -171.312 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -66.83 -9.96 42.92 Favored 'General case' 0 N--CA 1.479 0.994 0 CA-C-O 122.721 1.248 . . . . 0.0 113.93 -171.485 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 5.6 pt20 -84.96 -11.74 54.85 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 126.268 1.827 . . . . 0.0 113.854 174.753 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 73.4 m-80 -114.35 -9.4 12.79 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 114.585 1.328 . . . . 0.0 114.585 -177.877 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 21.8 pt -71.43 159.98 5.46 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 C-N-CA 123.574 0.749 . . . . 0.0 111.608 168.684 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.1 p -129.22 144.37 51.19 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 125.149 1.379 . . . . 0.0 110.014 173.805 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -63.9 -26.14 68.46 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.933 0.893 . . . . 0.0 112.169 175.875 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -63.49 -49.26 83.37 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.459 0 C-N-CA 125.291 1.436 . . . . 0.0 109.48 173.099 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 99.2 m -75.14 -43.02 54.89 Favored 'General case' 0 C--O 1.223 -0.309 0 C-N-CA 123.538 0.735 . . . . 0.0 110.156 -178.248 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 17.3 tp -62.22 -35.13 77.95 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.469 1.108 . . . . 0.0 112.093 176.23 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 47.2 t -53.79 -32.5 52.79 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.367 1.067 . . . . 0.0 113.015 168.349 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -100.74 -23.55 14.59 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 125.621 1.568 . . . . 0.0 114.008 -174.137 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 67.1 mmtt -66.05 -37.58 86.19 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 124.858 1.263 . . . . 0.0 111.343 173.977 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.3 mp -114.21 1.38 14.51 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 125.092 1.357 . . . . 0.0 114.256 -172.819 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 12.7 m-80 57.21 46.36 18.89 Favored 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 125.712 1.605 . . . . 0.0 112.868 -175.155 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 7.0 pt -106.39 -166.42 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 C-N-CA 125.974 1.709 . . . . 0.0 111.537 -178.992 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -94.5 159.41 15.11 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 123.9 0.88 . . . . 0.0 110.491 167.644 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 93.8 t -60.39 -30.1 45.66 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 O-C-N 121.563 -0.711 . . . . 0.0 111.241 172.22 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -82.68 -32.52 28.06 Favored 'General case' 0 N--CA 1.465 0.287 0 O-C-N 121.049 -1.032 . . . . 0.0 110.567 -178.194 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 15.2 tttt -70.19 -41.59 73.52 Favored 'General case' 0 C--N 1.343 0.326 0 C-N-CA 123.313 0.645 . . . . 0.0 110.855 174.502 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -60.78 -47.33 86.8 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 125.56 1.544 . . . . 0.0 112.355 171.531 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 36.7 ttmt -72.78 -28.04 62.36 Favored 'General case' 0 CA--C 1.517 -0.296 0 CA-C-O 118.004 -0.998 . . . . 0.0 111.298 -173.519 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -49.72 -47.24 50.69 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 118.833 0.742 . . . . 0.0 110.408 174.272 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 18.9 m-85 -63.56 -43.19 97.75 Favored 'General case' 0 C--O 1.223 -0.326 0 C-N-CA 123.491 0.716 . . . . 0.0 110.43 -175.593 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 48.4 mt -67.92 -28.39 41.15 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.675 0 C-N-CA 125.435 1.494 . . . . 0.0 111.637 -178.773 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 28.4 mmmt -80.46 -23.41 40.23 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 125.423 1.489 . . . . 0.0 112.369 174.941 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 90.2 m-20 -100.29 -62.85 1.19 Allowed 'General case' 0 C--O 1.234 0.244 0 C-N-CA 126.326 1.85 . . . . 0.0 111.609 -173.502 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 69.7 m -98.59 102.66 14.46 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 126.318 1.847 . . . . 0.0 110.862 177.027 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 7.9 p30 -139.13 -74.5 0.38 Allowed 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 123.608 0.763 . . . . 0.0 112.839 -177.476 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 1.2 mpp_? -65.24 -26.64 68.2 Favored 'General case' 0 N--CA 1.484 1.257 0 CA-C-N 119.482 1.037 . . . . 0.0 112.646 177.919 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -92.92 0.4 57.4 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 126.466 1.906 . . . . 0.0 113.492 176.84 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -72.77 -17.29 78.17 Favored Glycine 0 CA--C 1.538 1.492 0 O-C-N 120.89 -1.131 . . . . 0.0 115.415 -174.103 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 13.8 ttt85 -144.84 165.83 26.99 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 126.724 2.009 . . . . 0.0 109.381 170.309 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 8.9 t -49.87 107.88 0.18 Allowed 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 125.73 1.612 . . . . 0.0 113.545 178.739 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 54.7 m-80 -150.6 137.65 19.28 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 126.116 1.767 . . . . 0.0 110.301 179.615 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -153.15 88.86 1.33 Allowed 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 124.785 1.234 . . . . 0.0 109.74 170.821 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -143.57 30.47 1.36 Allowed 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 124.168 0.987 . . . . 0.0 112.027 -175.804 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 85.2 tttt -94.19 -24.2 17.6 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 125.768 1.627 . . . . 0.0 111.933 174.339 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 9.5 t -158.92 127.32 5.22 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 126.439 1.896 . . . . 0.0 109.282 179.415 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -143.25 2.26 0.35 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.786 0 C-N-CA 125.505 1.522 . . . . 0.0 113.975 -177.789 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 70.65 10.22 66.8 Favored Glycine 0 CA--C 1.541 1.669 0 O-C-N 120.728 -1.232 . . . . 0.0 114.682 -169.963 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . 0.257 4.0 mp 53.28 39.22 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.106 0 C-N-CA 126.485 1.914 . . . . 0.0 111.824 174.121 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 14.4 tp 50.93 25.03 2.02 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 127.148 2.179 . . . . 0.0 114.426 -177.758 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 33.6 mt-30 -114.2 86.5 2.43 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 126.008 1.723 . . . . 0.0 110.22 -174.655 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -133.43 147.6 51.73 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 126.791 2.036 . . . . 0.0 110.018 179.024 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -133.6 122.41 23.48 Favored 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 124.694 1.197 . . . . 0.0 110.721 -176.336 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 60.6 t -134.21 108.7 11.52 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.469 0 C-N-CA 125.375 1.47 . . . . 0.0 109.712 178.749 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 32.2 t -162.99 -79.32 0.04 OUTLIER 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 123.757 0.823 . . . . 0.0 112.126 169.014 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 42.9 m -95.3 -27.54 15.43 Favored 'General case' 0 N--CA 1.478 0.948 0 N-CA-C 114.079 1.14 . . . . 0.0 114.079 -172.588 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 65.6 mtt -137.57 110.41 7.65 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 125.419 1.488 . . . . 0.0 109.658 -179.69 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -144.52 85.98 1.8 Allowed 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 124.768 1.227 . . . . 0.0 109.145 -179.693 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -153.29 161.71 42.08 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 124.884 1.273 . . . . 0.0 112.566 -178.437 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 52.3 mmtt -116.95 -65.34 1.2 Allowed 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 125.75 1.62 . . . . 0.0 111.88 174.24 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 56.9 m -144.12 145.32 32.06 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.801 1.64 . . . . 0.0 110.954 -179.176 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 31.9 ttm -154.45 154.01 32.48 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 124.573 1.149 . . . . 0.0 111.805 179.778 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 10.6 m -100.94 142.97 31.66 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 124.811 1.244 . . . . 0.0 110.94 173.807 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 48.6 p90 . . . . . 0 C--O 1.253 1.259 0 C-N-CA 126.522 1.929 . . . . 0.0 113.655 -178.186 . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.625 0 N-CA-C 111.671 -0.572 . . . . 0.0 111.671 . . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 21.3 t -148.29 145.99 28.4 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.824 1.249 . . . . 0.0 111.626 177.884 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 69.1 m80 -141.76 151.06 42.55 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 125.822 1.649 . . . . 0.0 111.597 -178.808 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 27.9 ttt -147.6 139.0 23.76 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 125.29 1.436 . . . . 0.0 111.235 -179.815 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -85.35 152.06 23.55 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 124.05 0.94 . . . . 0.0 112.366 176.228 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 26.9 t -141.69 94.71 2.71 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.932 1.293 . . . . 0.0 109.778 177.782 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 33.9 ttm -149.75 26.28 0.83 Allowed 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 124.834 1.253 . . . . 0.0 112.518 -173.352 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 15.6 m-20 -126.96 156.23 74.47 Favored Pre-proline 0 CA--C 1.548 0.872 0 C-N-CA 125.691 1.597 . . . . 0.0 111.945 -177.001 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 91.7 Cg_endo -74.29 -0.25 9.4 Favored 'Trans proline' 0 CA--C 1.538 0.688 0 C-N-CA 123.468 2.778 . . . . 0.0 114.601 179.969 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 95.0 mt -117.28 36.69 4.14 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 125.878 1.671 . . . . 0.0 112.998 -175.296 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 27.9 m-20 -103.84 2.62 32.92 Favored 'General case' 0 N--CA 1.477 0.898 0 N-CA-C 114.301 1.223 . . . . 0.0 114.301 173.36 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -119.92 -57.17 1.97 Allowed 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 124.398 1.079 . . . . 0.0 113.525 -164.502 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.1 pp -131.36 16.39 1.87 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.94 0 C-N-CA 126.144 1.778 . . . . 0.0 112.869 -172.534 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 15.5 tt -42.03 -39.08 0.76 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.284 0 C-N-CA 126.156 1.782 . . . . 0.0 115.772 -177.164 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 15.9 m120 -121.54 108.38 13.54 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 125.514 1.526 . . . . 0.0 110.497 177.594 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 29.2 t0 -165.38 62.91 0.12 Allowed 'General case' 0 CA--C 1.533 0.29 0 CA-C-O 122.352 1.072 . . . . 0.0 110.655 -168.582 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 29.5 mt 50.08 59.36 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.742 0 C-N-CA 125.931 1.693 . . . . 0.0 110.626 -169.097 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -147.75 -51.38 0.19 Allowed 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 114.62 -1.173 . . . . 0.0 112.064 -179.814 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 61.0 mttp 54.81 177.79 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.558 0 C-N-CA 125.932 1.693 . . . . 0.0 114.495 -174.889 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -142.57 71.3 1.34 Allowed 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 124.986 1.314 . . . . 0.0 110.816 178.393 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -139.19 161.9 36.28 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 125.578 1.551 . . . . 0.0 112.048 177.36 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 29.1 t-20 -154.34 -54.28 0.1 Allowed 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 123.936 0.895 . . . . 0.0 113.092 -174.351 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 51.68 38.97 24.19 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 126.0 1.72 . . . . 0.0 115.402 176.364 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 27.1 t -69.2 109.86 4.29 Favored 'General case' 0 CA--C 1.539 0.532 0 O-C-N 121.439 -0.788 . . . . 0.0 111.377 175.567 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 75.52 105.86 0.11 Allowed Glycine 0 CA--C 1.537 1.442 0 C-N-CA 125.936 1.732 . . . . 0.0 113.947 -177.355 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 14.8 p -141.03 140.33 32.67 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.858 0 C-N-CA 125.421 1.489 . . . . 0.0 111.432 172.47 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 27.6 m 63.92 156.65 0.07 Allowed 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 127.017 2.127 . . . . 0.0 115.329 179.947 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -133.43 31.83 3.71 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 126.217 1.807 . . . . 0.0 114.575 -174.311 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -83.3 151.3 62.47 Favored Pre-proline 0 CA--C 1.549 0.917 0 C-N-CA 125.453 1.501 . . . . 0.0 112.84 -179.199 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 65.3 Cg_endo -72.73 -44.84 0.59 Allowed 'Trans proline' 0 CA--C 1.541 0.846 0 C-N-CA 122.679 2.253 . . . . 0.0 112.605 178.01 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 41.7 tp -159.04 81.32 0.78 Allowed 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 125.61 1.564 . . . . 0.0 109.53 174.063 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 60.47 175.86 0.1 Allowed 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.992 1.317 . . . . 0.0 114.16 -172.863 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 40.8 t 63.31 151.33 0.11 Allowed Pre-proline 0 N--CA 1.486 1.352 0 C-N-CA 127.04 2.136 . . . . 0.0 112.882 -172.945 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -69.59 66.14 1.68 Allowed 'Trans proline' 0 CA--C 1.548 1.224 0 C-N-CA 123.43 2.754 . . . . 0.0 112.094 169.392 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 55.95 102.79 0.03 OUTLIER Pre-proline 0 N--CA 1.478 0.965 0 C-N-CA 128.845 2.858 . . . . 0.0 113.084 -174.058 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 82.3 Cg_endo -69.11 163.09 39.09 Favored 'Trans proline' 0 CA--C 1.539 0.753 0 C-N-CA 122.309 2.006 . . . . 0.0 112.369 175.438 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 96.6 mttt -117.65 111.07 18.67 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 126.245 1.818 . . . . 0.0 110.136 178.979 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -149.29 156.04 41.47 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.264 1.426 . . . . 0.0 113.269 -176.528 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -151.1 46.71 0.84 Allowed 'General case' 0 N--CA 1.474 0.77 0 CA-C-O 123.088 1.423 . . . . 0.0 112.844 -177.791 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -106.36 83.04 1.82 Allowed 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 125.188 1.395 . . . . 0.0 112.357 -172.568 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 5.2 mt -104.65 156.06 18.31 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 126.744 2.018 . . . . 0.0 111.104 175.19 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 18.3 t -73.57 165.89 24.25 Favored 'General case' 0 N--CA 1.479 0.99 0 O-C-N 121.965 -0.459 . . . . 0.0 110.396 167.54 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -59.57 -43.18 93.68 Favored 'General case' 0 CA--C 1.542 0.656 0 O-C-N 120.461 -1.399 . . . . 0.0 112.824 -173.724 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 10.2 tt0 -73.47 -41.88 62.6 Favored 'General case' 0 N--CA 1.469 0.524 0 O-C-N 121.299 -0.875 . . . . 0.0 111.43 175.743 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 30.4 mm-40 -57.06 -43.42 82.02 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 123.894 0.877 . . . . 0.0 111.032 176.637 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 40.8 ttmt -60.14 -42.31 94.57 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 124.981 1.313 . . . . 0.0 111.651 176.733 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 47.1 mt -68.88 -40.87 81.73 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 CA-C-O 118.413 -0.803 . . . . 0.0 111.053 177.535 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 43.6 mt -63.91 -44.22 97.95 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.933 0 CA-C-N 120.307 1.412 . . . . 0.0 110.385 177.705 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -59.22 -50.07 75.44 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.681 1.193 . . . . 0.0 110.396 176.105 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -65.68 -50.68 64.04 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.346 1.058 . . . . 0.0 112.93 -179.576 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.8 mm-40 -60.89 -24.38 65.92 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 118.997 0.817 . . . . 0.0 113.13 -179.145 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -73.23 -58.17 3.5 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 123.714 0.806 . . . . 0.0 111.31 175.865 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 15.3 mt -59.91 -33.79 53.91 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.583 0 C-N-CA 125.903 1.681 . . . . 0.0 111.629 175.815 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -69.78 -22.4 63.34 Favored 'General case' 0 CA--C 1.545 0.771 0 O-C-N 121.267 -0.895 . . . . 0.0 113.293 175.372 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -93.76 -32.96 13.78 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 124.526 1.13 . . . . 0.0 112.732 178.539 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 10.5 m -120.15 -19.68 5.04 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.911 0 N-CA-C 114.005 1.113 . . . . 0.0 114.005 -174.094 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 83.58 142.56 5.02 Favored Glycine 0 CA--C 1.531 1.052 0 C-N-CA 124.802 1.192 . . . . 0.0 112.145 -171.486 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 2.2 tt -65.48 -11.19 40.94 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 114.928 1.455 . . . . 0.0 114.928 -170.219 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 38.8 mt-30 -80.18 -20.69 44.19 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.672 1.589 . . . . 0.0 112.921 174.813 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 69.5 m-80 -109.63 -7.07 15.16 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 114.4 1.259 . . . . 0.0 114.4 -171.793 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 16.5 pt -71.85 160.67 5.15 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 C-N-CA 123.676 0.791 . . . . 0.0 111.492 166.689 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.1 p -130.81 144.77 51.69 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 125.357 1.463 . . . . 0.0 109.991 173.923 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -62.98 -27.83 69.68 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 123.935 0.894 . . . . 0.0 112.239 176.679 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -62.83 -52.04 64.44 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.313 0 C-N-CA 125.41 1.484 . . . . 0.0 109.144 174.043 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 58.6 m -73.83 -42.89 60.22 Favored 'General case' 0 C--O 1.223 -0.303 0 C-N-CA 123.357 0.663 . . . . 0.0 110.442 -177.968 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 18.4 tp -59.79 -35.31 74.41 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.413 1.085 . . . . 0.0 111.996 174.819 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 47.7 t -55.39 -34.37 64.3 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 124.132 0.973 . . . . 0.0 113.124 170.156 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.1 -22.41 16.24 Favored 'General case' 0 CA--C 1.534 0.362 0 N-CA-C 114.533 1.308 . . . . 0.0 114.533 -177.448 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 68.0 mmtt -64.1 -38.44 91.06 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 119.508 1.049 . . . . 0.0 111.154 173.744 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.2 mp -112.34 -0.2 15.48 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 125.315 1.446 . . . . 0.0 114.363 -173.162 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 48.8 m-80 54.39 47.84 21.99 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 125.459 1.504 . . . . 0.0 112.84 -172.569 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 8.2 pt -104.35 -162.63 0.14 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.766 0 C-N-CA 126.456 1.902 . . . . 0.0 110.849 178.72 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -100.2 159.22 15.28 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 124.364 1.066 . . . . 0.0 110.4 167.701 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 67.7 t -60.96 -29.18 45.06 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.958 0 O-C-N 121.634 -0.666 . . . . 0.0 111.26 172.425 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 85.6 mt-10 -80.16 -34.11 37.88 Favored 'General case' 0 N--CA 1.466 0.357 0 O-C-N 120.953 -1.092 . . . . 0.0 110.092 -178.766 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 13.5 tttp -69.7 -44.38 70.52 Favored 'General case' 0 C--N 1.345 0.378 0 C-N-CA 124.287 1.035 . . . . 0.0 110.344 175.984 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -59.85 -46.75 88.3 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 125.843 1.657 . . . . 0.0 112.688 173.293 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 38.8 ttmt -75.28 -25.12 57.71 Favored 'General case' 0 CA--C 1.518 -0.28 0 C-N-CA 124.099 0.96 . . . . 0.0 111.799 -172.42 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -52.79 -50.11 64.24 Favored 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 118.138 0.426 . . . . 0.0 110.47 171.597 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 19.0 m-85 -62.15 -39.16 91.67 Favored 'General case' 0 C--N 1.34 0.183 0 C-N-CA 124.113 0.965 . . . . 0.0 111.319 -175.847 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 73.8 mt -68.04 -37.78 78.79 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.409 0 C-N-CA 123.956 0.902 . . . . 0.0 110.122 179.4 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 15.8 ttmt -73.0 -40.42 65.24 Favored 'General case' 0 C--N 1.344 0.333 0 C-N-CA 124.338 1.055 . . . . 0.0 112.533 -176.618 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 23.9 p30 -90.97 -44.32 9.41 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 123.324 0.65 . . . . 0.0 111.696 -178.035 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 1.3 t -88.28 45.14 1.25 Allowed 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 115.013 1.486 . . . . 0.0 115.013 -175.772 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -88.29 -37.58 15.88 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 115.454 1.65 . . . . 0.0 115.454 -163.527 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -108.2 -5.91 16.65 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 124.755 1.222 . . . . 0.0 113.657 175.44 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 9.4 tt -74.37 -37.67 63.39 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 124.282 1.033 . . . . 0.0 111.278 170.95 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -79.77 43.02 2.54 Favored Glycine 0 CA--C 1.537 1.42 0 C-N-CA 124.186 0.898 . . . . 0.0 114.994 179.433 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 16.7 mmt85 -127.77 -178.52 4.53 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 126.295 1.838 . . . . 0.0 112.606 -173.586 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 6.4 t -124.98 5.73 7.97 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 126.865 2.066 . . . . 0.0 113.904 -174.93 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 75.4 m-20 -85.36 54.94 3.29 Favored 'General case' 0 CA--C 1.547 0.852 0 O-C-N 120.568 -1.332 . . . . 0.0 112.988 -168.175 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 1.7 p-10 -134.71 19.1 3.55 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 126.025 1.73 . . . . 0.0 113.519 -172.845 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -144.81 45.85 1.36 Allowed 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.635 1.174 . . . . 0.0 110.984 -167.791 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 64.9 tttm -101.81 -25.31 13.86 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 125.801 1.64 . . . . 0.0 112.44 178.845 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 8.9 t -158.07 120.22 3.69 Favored 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 125.897 1.679 . . . . 0.0 109.547 -179.737 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -146.26 3.16 0.18 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.809 0 N-CA-C 114.117 1.154 . . . . 0.0 114.117 -175.543 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 69.79 7.79 59.44 Favored Glycine 0 CA--C 1.54 1.619 0 O-C-N 120.572 -1.33 . . . . 0.0 114.568 -169.288 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . 0.258 21.5 mm 56.98 24.06 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.112 0 C-N-CA 127.272 2.229 . . . . 0.0 113.021 174.756 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 11.3 tp 53.44 22.07 2.71 Favored 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 126.41 1.884 . . . . 0.0 114.306 -171.128 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 16.5 mm100 -98.2 -32.71 11.44 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 125.61 1.564 . . . . 0.0 112.505 -179.959 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -139.08 145.4 39.47 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 125.329 1.452 . . . . 0.0 111.384 177.825 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -145.47 111.04 5.39 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.792 1.237 . . . . 0.0 110.512 176.223 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 57.8 t -141.26 133.65 29.5 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 C-N-CA 125.333 1.453 . . . . 0.0 109.651 178.936 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 42.7 t -162.94 -71.43 0.05 OUTLIER 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 123.701 0.8 . . . . 0.0 112.498 175.322 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 60.8 p -85.85 -20.57 28.92 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 124.881 1.272 . . . . 0.0 113.956 -176.179 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 97.0 mtp -124.02 113.79 18.89 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 126.076 1.75 . . . . 0.0 109.199 176.035 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -142.62 74.21 1.44 Allowed 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.084 1.354 . . . . 0.0 109.757 -177.461 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -147.39 147.88 30.74 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 124.779 1.232 . . . . 0.0 112.144 -179.076 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 30.1 mtpp -138.32 142.72 39.73 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 125.946 1.698 . . . . 0.0 110.751 177.47 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 52.2 m -139.77 67.95 1.37 Allowed 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 124.794 1.238 . . . . 0.0 111.619 -171.806 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 10.3 mmt -133.37 167.58 20.15 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.217 1.407 . . . . 0.0 113.432 -179.174 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 11.6 t -140.02 160.61 39.55 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 126.71 2.004 . . . . 0.0 111.419 -178.475 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 41.2 t-105 . . . . . 0 C--O 1.253 1.249 0 C-N-CA 125.976 1.71 . . . . 0.0 112.845 -170.911 . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.523 0 N-CA-C 111.993 -0.443 . . . . 0.0 111.993 . . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 52.7 m -107.33 115.73 30.69 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 124.727 1.211 . . . . 0.0 111.585 -176.23 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 96.2 m-70 -139.16 -57.17 0.6 Allowed 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.503 1.121 . . . . 0.0 113.021 179.969 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 11.9 tpt -148.11 57.25 1.08 Allowed 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 124.347 1.059 . . . . 0.0 111.937 -174.759 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -151.0 148.37 28.29 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 124.367 1.067 . . . . 0.0 112.713 179.945 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 30.2 t -156.48 124.16 5.49 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 125.038 1.335 . . . . 0.0 110.934 175.525 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 11.2 mmt -140.29 7.01 2.16 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 125.193 1.397 . . . . 0.0 114.203 -178.819 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 46.5 t0 -148.4 108.76 3.62 Favored Pre-proline 0 CA--C 1.549 0.939 0 O-C-N 121.065 -1.022 . . . . 0.0 112.312 -178.183 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 65.2 Cg_endo -83.8 -2.09 10.21 Favored 'Trans proline' 0 C--N 1.351 0.682 0 C-N-CA 123.828 3.019 . . . . 0.0 114.712 178.333 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 96.8 mt -120.8 39.35 3.8 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 126.212 1.805 . . . . 0.0 111.78 -175.576 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -106.13 -3.58 21.31 Favored 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 114.253 1.205 . . . . 0.0 114.253 176.533 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.09 -57.06 2.31 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 124.233 1.013 . . . . 0.0 113.112 -161.017 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.9 pp -129.05 12.22 2.67 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.794 0 C-N-CA 126.389 1.876 . . . . 0.0 112.863 -175.118 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 8.4 tt -42.34 105.73 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.082 0 C-N-CA 126.0 1.72 . . . . 0.0 113.46 -176.459 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 4.3 t30 -150.52 10.94 0.67 Allowed 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 114.878 1.436 . . . . 0.0 114.878 179.87 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -81.6 5.25 18.7 Favored 'General case' 0 CA--C 1.545 0.771 0 N-CA-C 115.147 1.536 . . . . 0.0 115.147 -168.53 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 13.5 tt -148.33 27.57 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 C-N-CA 125.616 1.566 . . . . 0.0 113.975 -172.717 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 52.7 mtmt -120.04 -51.04 2.24 Favored 'General case' 0 N--CA 1.477 0.883 0 N-CA-C 113.981 1.104 . . . . 0.0 113.981 176.555 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 14.2 ptpt -168.19 136.98 2.37 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 125.259 1.424 . . . . 0.0 112.802 -174.031 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 11.7 tt0 -156.82 16.63 0.3 Allowed 'General case' 0 CA--C 1.554 1.118 0 N-CA-C 113.957 1.095 . . . . 0.0 113.957 176.378 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -140.07 158.62 43.76 Favored 'General case' 0 CA--C 1.543 0.701 0 O-C-N 120.584 -1.323 . . . . 0.0 113.675 -169.54 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 9.4 t-20 -85.56 -36.74 20.25 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 124.369 1.067 . . . . 0.0 113.407 -174.428 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 -147.11 123.51 10.99 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 125.872 1.669 . . . . 0.0 110.793 172.914 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 67.5 m -144.86 43.56 1.35 Allowed 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 125.221 1.409 . . . . 0.0 112.771 -177.431 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -156.9 57.71 0.37 Allowed Glycine 0 N--CA 1.47 0.904 0 O-C-N 121.348 -0.845 . . . . 0.0 114.395 -176.998 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 11.0 p -142.08 16.81 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 C-N-CA 125.361 1.465 . . . . 0.0 112.87 -171.592 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -138.51 149.39 45.33 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 125.107 1.363 . . . . 0.0 111.833 -169.781 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 2.3 mp -105.11 31.25 4.98 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 125.498 1.519 . . . . 0.0 113.264 -169.8 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -150.84 87.32 4.75 Favored Pre-proline 0 CA--C 1.549 0.912 0 C-N-CA 124.341 1.056 . . . . 0.0 111.234 -157.098 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -77.18 -29.65 4.87 Favored 'Trans proline' 0 CA--C 1.54 0.795 0 C-N-CA 123.122 2.548 . . . . 0.0 114.1 -169.137 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 1.9 tt -147.75 61.04 1.14 Allowed 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 125.005 1.322 . . . . 0.0 109.374 178.149 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 51.2 m 60.56 168.76 0.09 Allowed 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 125.502 1.521 . . . . 0.0 113.778 -165.203 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 70.5 t 63.41 148.53 0.1 OUTLIER Pre-proline 0 N--CA 1.483 1.186 0 C-N-CA 127.224 2.21 . . . . 0.0 113.873 -178.173 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 64.6 Cg_endo -65.98 79.38 0.29 Allowed 'Trans proline' 0 CA--C 1.544 0.997 0 C-N-CA 122.939 2.426 . . . . 0.0 110.923 165.146 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 53.8 tptt 43.44 86.99 0.12 Allowed Pre-proline 0 N--CA 1.48 1.073 0 C-N-CA 129.735 3.214 . . . . 0.0 114.568 176.44 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -67.24 155.88 68.66 Favored 'Trans proline' 0 CA--C 1.541 0.84 0 C-N-CA 123.178 2.585 . . . . 0.0 113.343 -177.641 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 59.7 pttt -60.39 151.84 26.96 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 125.111 1.365 . . . . 0.0 113.698 -176.089 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 29.6 tp -141.95 149.69 40.44 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 126.143 1.777 . . . . 0.0 110.258 179.29 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -145.13 50.07 1.25 Allowed 'General case' 0 N--CA 1.475 0.822 0 CA-C-O 122.949 1.357 . . . . 0.0 112.804 -179.233 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 25.5 mt-10 -111.68 89.16 2.98 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 125.287 1.435 . . . . 0.0 112.446 -175.757 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.1 mt -132.66 152.98 51.54 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 127.661 2.384 . . . . 0.0 109.26 170.065 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 70.0 m -71.48 164.64 25.43 Favored 'General case' 0 N--CA 1.481 1.077 0 O-C-N 121.788 -0.57 . . . . 0.0 110.5 169.559 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -55.89 -43.76 77.55 Favored 'General case' 0 N--CA 1.481 1.078 0 O-C-N 120.492 -1.38 . . . . 0.0 113.181 -174.949 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 11.6 tt0 -72.24 -41.42 66.82 Favored 'General case' 0 CA--C 1.536 0.442 0 O-C-N 121.549 -0.719 . . . . 0.0 111.537 175.47 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 86.8 mt-30 -62.4 -39.29 92.75 Favored 'General case' 0 N--CA 1.466 0.374 0 O-C-N 121.657 -0.652 . . . . 0.0 111.79 178.465 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 40.0 ttmt -60.81 -41.32 95.45 Favored 'General case' 0 N--CA 1.465 0.281 0 C-N-CA 123.987 0.915 . . . . 0.0 110.625 175.764 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 46.7 mt -67.86 -43.46 86.03 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 CA-C-O 118.332 -0.842 . . . . 0.0 111.266 176.673 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 45.5 mt -64.74 -44.78 96.48 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.956 0 CA-C-N 120.518 1.508 . . . . 0.0 110.481 179.314 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -58.63 -48.77 79.88 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.434 1.494 . . . . 0.0 110.87 176.154 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -64.0 -51.7 63.0 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 124.042 0.937 . . . . 0.0 112.333 176.939 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 13.9 mm-40 -59.75 -23.0 62.86 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 119.318 0.963 . . . . 0.0 113.394 -179.745 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -71.47 -64.15 0.98 Allowed 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 119.001 0.819 . . . . 0.0 110.824 172.905 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 27.4 mt -58.84 -34.61 52.81 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 C-N-CA 126.534 1.934 . . . . 0.0 112.019 178.862 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -71.71 -23.45 61.64 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.265 1.026 . . . . 0.0 112.996 177.721 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -91.44 -36.28 13.87 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 124.327 1.051 . . . . 0.0 112.624 176.109 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 19.4 m -112.66 -23.56 4.32 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.269 0 N-CA-C 115.326 1.602 . . . . 0.0 115.326 -174.385 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 83.86 139.16 3.89 Favored Glycine 0 CA--C 1.533 1.183 0 C-N-CA 124.916 1.246 . . . . 0.0 112.288 -167.845 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.2 tt -65.64 -7.94 17.78 Favored 'General case' 0 CA--C 1.551 0.992 0 N-CA-C 114.16 1.17 . . . . 0.0 114.16 -173.4 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 37.7 mt-30 -74.26 -19.3 60.55 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 126.411 1.884 . . . . 0.0 113.566 -178.548 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 13.5 p30 -130.7 2.34 4.47 Favored 'General case' 0 N--CA 1.476 0.868 0 N-CA-C 115.741 1.756 . . . . 0.0 115.741 -176.166 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 31.2 pt -63.01 156.98 4.33 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.655 0 CA-C-N 118.797 0.726 . . . . 0.0 111.707 164.826 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -130.63 144.79 51.67 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 125.139 1.376 . . . . 0.0 110.631 176.063 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -62.97 -26.39 68.81 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 124.005 0.922 . . . . 0.0 112.256 175.923 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -66.35 -41.07 88.27 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.502 0 C-N-CA 125.415 1.486 . . . . 0.0 110.562 174.222 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 98.7 m -80.84 -43.65 19.64 Favored 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 123.23 0.612 . . . . 0.0 109.738 -179.289 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.4 tt -66.06 -33.45 75.82 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 124.648 1.179 . . . . 0.0 112.333 178.158 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.416 ' HA ' HG13 ' A' ' 66' ' ' ILE . 60.4 p -60.91 -26.28 67.34 Favored 'General case' 0 N--CA 1.475 0.795 0 CA-C-N 119.232 0.924 . . . . 0.0 112.978 169.878 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -96.32 -31.27 12.97 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 125.026 1.33 . . . . 0.0 113.39 -178.497 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 8.3 mmtm -61.06 -36.53 79.85 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 125.255 1.422 . . . . 0.0 111.75 175.7 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.1 mt -118.22 9.31 12.53 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 125.678 1.591 . . . . 0.0 113.654 -171.1 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . 0.291 7.4 p30 47.31 60.32 3.53 Favored 'General case' 0 CA--C 1.551 0.996 0 C-N-CA 126.771 2.029 . . . . 0.0 114.132 -176.821 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.416 HG13 ' HA ' ' A' ' 61' ' ' SER . 0.6 OUTLIER -130.64 178.5 5.34 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 127.788 2.435 . . . . 0.0 111.359 -173.438 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.1 p -79.56 158.88 27.05 Favored 'General case' 0 N--CA 1.477 0.91 0 O-C-N 121.011 -1.056 . . . . 0.0 111.598 173.337 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 86.3 t -63.7 -29.94 48.59 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.029 0 O-C-N 121.628 -0.67 . . . . 0.0 111.36 172.468 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -76.68 -38.4 54.54 Favored 'General case' 0 N--CA 1.468 0.468 0 O-C-N 120.985 -1.072 . . . . 0.0 109.951 -178.344 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 5.6 tmtm? -65.06 -47.92 75.61 Favored 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 125.56 1.544 . . . . 0.0 110.771 176.359 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -60.62 -43.03 97.94 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 125.95 1.7 . . . . 0.0 113.479 174.062 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 34.8 ttmt -72.31 -27.09 62.22 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 124.633 1.173 . . . . 0.0 111.657 -179.352 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -56.91 -43.11 81.07 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-O 119.02 -0.515 . . . . 0.0 111.245 177.419 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 65.2 m-85 -60.9 -42.74 98.64 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 124.922 1.289 . . . . 0.0 111.571 175.243 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 62.5 mt -69.23 -21.05 24.85 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.765 0 C-N-CA 124.457 1.103 . . . . 0.0 111.168 -179.855 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 30.3 mmtm -92.96 -23.46 18.71 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 125.656 1.582 . . . . 0.0 113.394 178.547 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 10.3 p30 -104.05 -35.31 8.13 Favored 'General case' 0 N--CA 1.468 0.466 0 N-CA-C 113.822 1.045 . . . . 0.0 113.822 177.986 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 5.2 t -86.82 -12.18 48.74 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 114.218 1.192 . . . . 0.0 114.218 -170.974 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 20.1 p30 -64.38 -10.81 27.1 Favored 'General case' 0 CA--C 1.547 0.833 0 N-CA-C 116.366 1.988 . . . . 0.0 116.366 -170.294 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -85.58 -9.71 56.93 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.874 1.27 . . . . 0.0 113.599 179.078 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.6 tt -84.31 -46.14 12.09 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.561 1.144 . . . . 0.0 112.171 -175.489 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 71.24 -96.27 0.62 Allowed Glycine 0 CA--C 1.533 1.187 0 C-N-CA 123.701 0.667 . . . . 0.0 112.524 177.498 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -101.36 -70.82 0.73 Allowed 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 125.114 1.366 . . . . 0.0 110.706 173.813 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 2.7 t -162.57 110.14 1.3 Allowed 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 126.089 1.755 . . . . 0.0 109.302 -179.867 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 65.7 m-80 -147.03 137.95 23.82 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.992 1.317 . . . . 0.0 110.765 -174.746 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 12.3 m120 -146.93 158.01 43.8 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.284 1.434 . . . . 0.0 112.305 178.581 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 11.2 mp -88.93 -64.49 1.14 Allowed 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 113.342 0.867 . . . . 0.0 113.342 -174.506 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 14.2 pttm -144.86 26.44 1.38 Allowed 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 126.822 2.049 . . . . 0.0 113.797 -174.988 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 13.6 t -148.04 116.47 6.59 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 124.977 1.311 . . . . 0.0 110.199 -172.819 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -138.48 8.06 0.68 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.789 0 C-N-CA 124.996 1.319 . . . . 0.0 113.048 -179.572 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 74.82 -9.66 10.76 Favored Glycine 0 CA--C 1.542 1.742 0 C-N-CA 124.894 1.235 . . . . 0.0 115.311 -173.606 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . 0.273 35.2 mm 63.01 45.19 0.2 Allowed 'Isoleucine or valine' 0 CA--C 1.551 1.012 0 C-N-CA 125.715 1.606 . . . . 0.0 111.611 -176.689 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER 45.71 51.64 10.07 Favored 'General case' 0 CA--C 1.552 1.033 0 C-N-CA 127.07 2.148 . . . . 0.0 114.232 168.722 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 11.7 mt-30 -134.01 15.48 3.88 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 125.693 1.597 . . . . 0.0 112.964 -171.58 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 11.0 mp0 -99.51 43.24 1.07 Allowed 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 126.808 2.043 . . . . 0.0 112.427 -170.276 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 24.5 tt0 -126.21 45.33 2.67 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 125.162 1.385 . . . . 0.0 112.325 -174.969 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 15.2 t -140.64 68.17 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 C-N-CA 124.978 1.311 . . . . 0.0 110.691 -179.911 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 36.0 t -161.49 -72.02 0.06 Allowed 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.375 0.67 . . . . 0.0 112.636 169.946 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 46.2 m -90.19 -22.67 21.57 Favored 'General case' 0 N--CA 1.478 0.972 0 N-CA-C 113.815 1.043 . . . . 0.0 113.815 -173.391 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 7.4 tpt -144.41 136.1 25.84 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 125.668 1.587 . . . . 0.0 109.358 174.823 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 13.6 tt0 -148.52 29.18 0.86 Allowed 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 124.191 0.996 . . . . 0.0 112.009 -172.904 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -123.59 151.18 43.23 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 125.326 1.45 . . . . 0.0 112.83 -171.678 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 52.2 mtmt -93.37 137.05 33.05 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 125.474 1.509 . . . . 0.0 111.149 177.635 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 23.4 t -149.38 124.21 9.9 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 124.912 1.285 . . . . 0.0 110.575 175.632 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 60.5 mtm -146.29 164.78 31.27 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 126.319 1.848 . . . . 0.0 111.284 -174.085 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 9.9 t -121.87 163.58 18.98 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 125.235 1.414 . . . . 0.0 112.107 173.958 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 39.5 t-105 . . . . . 0 C--O 1.252 1.216 0 C-N-CA 126.15 1.78 . . . . 0.0 112.902 -170.964 . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.596 0 N-CA-C 111.79 -0.524 . . . . 0.0 111.79 . . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 23.5 m -117.1 4.94 12.73 Favored 'General case' 0 N--CA 1.481 1.115 0 N-CA-C 114.517 1.303 . . . . 0.0 114.517 -171.997 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 9.0 t60 -73.7 131.54 41.73 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.035 0.934 . . . . 0.0 111.419 -179.211 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -151.61 149.95 29.73 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.446 1.098 . . . . 0.0 111.813 -176.076 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -82.87 153.91 24.9 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 124.22 1.008 . . . . 0.0 113.508 -179.291 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 46.9 m -144.53 142.94 30.57 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 126.319 1.847 . . . . 0.0 110.912 -176.258 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 79.7 mtp -135.29 14.31 3.51 Favored 'General case' 0 N--CA 1.48 1.026 0 N-CA-C 114.083 1.142 . . . . 0.0 114.083 -174.207 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 10.9 t0 -88.2 123.69 68.06 Favored Pre-proline 0 CA--C 1.553 1.082 0 C-N-CA 124.422 1.089 . . . . 0.0 112.027 -175.49 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_endo -87.68 0.2 7.2 Favored 'Trans proline' 0 C--N 1.353 0.779 0 C-N-CA 123.607 2.871 . . . . 0.0 115.224 -178.136 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 74.8 mt -109.85 28.78 8.24 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 124.874 1.27 . . . . 0.0 113.94 -171.376 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -99.15 -5.52 29.94 Favored 'General case' 0 N--CA 1.478 0.93 0 N-CA-C 115.661 1.726 . . . . 0.0 115.661 176.889 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -130.47 -30.58 1.89 Allowed 'General case' 0 N--CA 1.481 1.109 0 N-CA-C 117.17 2.285 . . . . 0.0 117.17 -169.066 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.5 pp -135.4 17.82 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.334 0 C-N-CA 125.337 1.455 . . . . 0.0 113.601 -177.531 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 13.1 tt -51.22 135.16 11.87 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 C-N-CA 125.289 1.435 . . . . 0.0 112.876 -176.826 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -156.24 124.74 5.84 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.876 1.27 . . . . 0.0 110.097 -175.762 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 18.9 p-10 -163.23 62.82 0.18 Allowed 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 122.654 1.216 . . . . 0.0 110.793 -178.101 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 52.5 mt 53.31 59.01 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.75 0 C-N-CA 126.125 1.77 . . . . 0.0 110.378 -173.797 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 4.3 tmmm? -154.12 -42.19 0.09 Allowed 'General case' 0 N--CA 1.475 0.823 0 CA-C-N 114.807 -1.088 . . . . 0.0 113.67 -177.447 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.2 mmmt -107.97 68.19 0.7 Allowed 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 125.54 1.536 . . . . 0.0 112.44 -176.114 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -141.12 11.63 2.18 Favored 'General case' 0 N--CA 1.481 1.081 0 N-CA-C 115.735 1.754 . . . . 0.0 115.735 -174.031 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -79.6 -41.17 27.67 Favored 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 114.101 1.148 . . . . 0.0 114.101 -172.938 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 26.2 m120 -147.18 90.84 1.92 Allowed 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 125.356 1.462 . . . . 0.0 110.255 -176.429 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 12.0 m-20 -136.81 97.13 3.46 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 124.852 1.261 . . . . 0.0 110.534 -175.022 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 25.0 t -146.61 116.76 7.36 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 125.165 1.386 . . . . 0.0 110.105 175.693 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 127.02 -17.4 6.3 Favored Glycine 0 CA--C 1.535 1.294 0 C-N-CA 125.76 1.647 . . . . 0.0 114.739 177.199 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 2.6 p -117.7 100.3 9.87 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.581 0 C-N-CA 126.126 1.771 . . . . 0.0 109.444 175.192 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -154.61 169.55 23.59 Favored 'General case' 0 N--CA 1.474 0.768 0 CA-C-O 121.977 0.894 . . . . 0.0 113.132 -177.209 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 14.1 mt -86.1 18.15 3.22 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 126.59 1.956 . . . . 0.0 113.886 -167.908 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -156.78 140.69 11.57 Favored Pre-proline 0 CA--C 1.55 0.97 0 C-N-CA 127.337 2.255 . . . . 0.0 110.801 -164.133 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 69.3 Cg_endo -85.26 -24.53 1.99 Allowed 'Trans proline' 0 CA--C 1.542 0.901 0 C-N-CA 122.963 2.442 . . . . 0.0 114.0 -175.34 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.439 ' HG ' ' H ' ' A' ' 26' ' ' SER . 6.7 tp -153.94 -159.25 0.95 Allowed 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 126.521 1.928 . . . . 0.0 109.382 -175.608 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 26' ' ' SER . . . . . 0.439 ' H ' ' HG ' ' A' ' 25' ' ' LEU . 46.6 p -74.65 41.55 0.15 Allowed 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 127.341 2.256 . . . . 0.0 114.003 177.114 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 8.5 p -151.44 142.18 15.06 Favored Pre-proline 0 CA--C 1.541 0.627 0 C-N-CA 126.269 1.828 . . . . 0.0 110.547 -170.753 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -77.86 60.96 7.46 Favored 'Trans proline' 0 CA--C 1.547 1.162 0 C-N-CA 123.909 3.073 . . . . 0.0 111.774 176.511 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 21.8 tptp 62.15 125.85 0.02 OUTLIER Pre-proline 0 N--CA 1.481 1.104 0 C-N-CA 129.466 3.106 . . . . 0.0 114.3 -169.584 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_endo -74.77 152.36 41.9 Favored 'Trans proline' 0 CA--C 1.539 0.764 0 C-N-CA 122.728 2.285 . . . . 0.0 111.386 173.533 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 56.0 mtmt -80.61 143.2 33.33 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 123.97 0.908 . . . . 0.0 111.861 -179.598 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.1 tp -151.29 132.98 14.89 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 127.094 2.158 . . . . 0.0 108.374 -177.399 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 22.3 mm-40 -146.05 77.49 1.49 Allowed 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 125.766 1.626 . . . . 0.0 109.276 -176.11 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -133.35 75.49 1.62 Allowed 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 124.469 1.108 . . . . 0.0 111.902 -173.881 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.3 mt -109.29 152.73 24.86 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 126.51 1.924 . . . . 0.0 110.609 174.067 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 21.4 t -73.15 166.76 22.51 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 123.053 0.541 . . . . 0.0 110.509 166.95 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -57.52 -44.54 85.13 Favored 'General case' 0 N--CA 1.475 0.794 0 O-C-N 120.705 -1.247 . . . . 0.0 112.744 -175.131 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -74.58 -36.16 63.02 Favored 'General case' 0 N--CA 1.47 0.554 0 O-C-N 121.509 -0.744 . . . . 0.0 112.317 176.045 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 30.0 mm-40 -63.19 -41.47 99.19 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 123.669 0.788 . . . . 0.0 110.438 177.896 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 21.4 ttmm -60.02 -42.59 94.67 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 124.3 1.04 . . . . 0.0 111.159 176.18 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 46.5 mt -69.28 -42.6 81.44 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 CA-C-O 118.341 -0.838 . . . . 0.0 111.115 178.466 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 31.6 mt -63.67 -42.85 97.43 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 CA-C-N 120.586 1.539 . . . . 0.0 110.518 178.218 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -58.47 -47.69 83.23 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.629 1.172 . . . . 0.0 110.621 174.795 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -67.53 -50.42 58.82 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.569 1.147 . . . . 0.0 113.12 -179.597 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -60.46 -26.16 66.56 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-N 118.991 0.814 . . . . 0.0 113.188 -179.625 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 2.1 t80 -74.24 -54.37 7.86 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 123.606 0.762 . . . . 0.0 111.447 177.249 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 45.8 mt -58.81 -35.01 53.86 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 C-N-CA 125.053 1.341 . . . . 0.0 111.23 173.168 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -68.0 -21.07 65.06 Favored 'General case' 0 CA--C 1.547 0.835 0 N-CA-C 113.37 0.878 . . . . 0.0 113.37 175.655 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -95.34 -30.39 13.96 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.833 1.253 . . . . 0.0 113.165 178.406 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 7.7 m -124.54 -22.46 2.48 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 CA-C-N 119.695 1.134 . . . . 0.0 114.049 -173.659 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 89.12 143.96 10.14 Favored Glycine 0 CA--C 1.534 1.256 0 C-N-CA 125.56 1.552 . . . . 0.0 113.246 -172.96 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 58.2 tp -60.08 -17.96 43.49 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 125.707 1.603 . . . . 0.0 115.243 -172.218 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 1.2 pm0 -88.55 -13.4 40.21 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.13 1.372 . . . . 0.0 114.5 176.495 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 77.7 m-20 -110.83 -11.68 14.35 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 114.45 1.278 . . . . 0.0 114.45 -175.084 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 32.2 pt -64.38 156.46 5.46 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 C-N-CA 123.379 0.672 . . . . 0.0 111.205 166.101 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -126.81 144.05 51.08 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 124.752 1.221 . . . . 0.0 110.591 173.886 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -60.62 -26.73 67.23 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.723 0.809 . . . . 0.0 112.099 174.0 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 27.9 mm -63.9 -53.58 42.43 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.396 0 C-N-CA 124.831 1.252 . . . . 0.0 110.6 174.005 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 79.5 m -72.16 -41.52 67.0 Favored 'General case' 0 C--O 1.223 -0.338 0 C-N-CA 123.735 0.814 . . . . 0.0 109.895 -178.331 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 21.0 tp -62.86 -36.88 84.71 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.938 1.295 . . . . 0.0 111.868 177.052 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 43.5 t -54.04 -32.67 55.19 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 124.47 1.108 . . . . 0.0 113.143 168.724 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -100.44 -23.3 14.77 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 114.57 1.322 . . . . 0.0 114.57 -175.153 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 68.5 mmtt -65.76 -38.08 88.09 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 125.093 1.357 . . . . 0.0 111.262 172.861 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.4 mp -111.17 -0.61 16.46 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 125.342 1.457 . . . . 0.0 114.431 -173.535 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 42.7 m-80 55.21 49.51 17.12 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 125.535 1.534 . . . . 0.0 112.78 -173.513 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 6.2 pt -109.14 -163.4 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 C-N-CA 126.467 1.907 . . . . 0.0 111.022 -179.33 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.2 p -99.16 161.45 13.62 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.33 1.052 . . . . 0.0 110.538 168.435 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 92.3 t -61.05 -29.11 45.05 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 O-C-N 121.601 -0.687 . . . . 0.0 111.196 173.339 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -82.27 -34.31 28.77 Favored 'General case' 0 N--CA 1.472 0.65 0 O-C-N 120.615 -1.303 . . . . 0.0 110.868 179.489 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 4.1 tttp -80.36 -3.83 51.15 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 126.341 1.856 . . . . 0.0 113.379 178.644 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -102.88 -46.35 4.71 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 129.248 3.019 . . . . 0.0 112.84 167.69 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 36.9 ttmt -69.92 -28.77 65.86 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 124.843 1.257 . . . . 0.0 111.14 -175.307 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 42.5 p-10 -45.7 -55.05 6.92 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 123.239 0.616 . . . . 0.0 111.07 171.646 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 25.0 m-85 -55.14 -42.1 72.6 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 126.021 1.728 . . . . 0.0 112.47 -179.844 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 50.5 mt -70.25 -26.53 29.52 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.728 0 C-N-CA 125.745 1.618 . . . . 0.0 111.467 -178.866 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 30.8 mmmt -87.17 -36.31 18.1 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 125.994 1.718 . . . . 0.0 112.27 175.641 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 73.6 m-20 -76.55 -43.3 39.64 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 125.858 1.663 . . . . 0.0 108.692 -175.381 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 68.9 m -124.77 125.52 44.17 Favored 'General case' 0 C--N 1.342 0.251 0 C-N-CA 124.642 1.177 . . . . 0.0 112.678 175.363 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 7.5 t-20 -151.13 -49.16 0.12 Allowed 'General case' 0 CA--C 1.54 0.558 0 N-CA-C 114.108 1.151 . . . . 0.0 114.108 -171.457 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 53.5 mmm-85 -99.87 8.82 43.85 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 125.624 1.569 . . . . 0.0 113.957 -178.503 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 58.7 tp -123.86 -41.35 2.24 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.678 1.591 . . . . 0.0 114.126 -170.424 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -85.52 66.94 3.69 Favored Glycine 0 CA--C 1.535 1.305 0 N-CA-C 115.169 0.828 . . . . 0.0 115.169 -166.232 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 58.4 mtt85 -112.2 -79.01 0.58 Allowed 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 125.031 1.333 . . . . 0.0 112.207 178.436 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 3.3 t -158.58 123.41 4.22 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 123.685 0.794 . . . . 0.0 111.339 177.303 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 58.5 m-80 -142.25 9.54 1.87 Allowed 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 125.391 1.476 . . . . 0.0 112.768 -177.614 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -135.01 18.77 3.45 Favored 'General case' 0 CA--C 1.554 1.102 0 C-N-CA 125.367 1.467 . . . . 0.0 112.633 -167.027 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 6.2 mp -124.78 160.83 27.78 Favored 'General case' 0 CA--C 1.541 0.596 0 C-N-CA 126.141 1.776 . . . . 0.0 110.254 -176.684 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 53.1 pttt -122.02 8.52 9.86 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 126.274 1.83 . . . . 0.0 113.486 -173.717 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 13.4 t -145.7 121.86 10.81 Favored 'General case' 0 N--CA 1.463 0.202 0 C-N-CA 124.974 1.31 . . . . 0.0 109.831 170.195 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -140.27 4.74 0.55 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.814 0 C-N-CA 125.774 1.629 . . . . 0.0 113.183 -177.58 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 67.33 8.8 52.65 Favored Glycine 0 CA--C 1.539 1.561 0 O-C-N 120.751 -1.218 . . . . 0.0 114.633 -170.304 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . 0.265 2.8 mp 49.43 39.18 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 C-N-CA 127.183 2.193 . . . . 0.0 111.805 -179.928 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 9.8 tp 55.01 22.26 4.28 Favored 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 126.764 2.026 . . . . 0.0 114.91 -178.352 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 36.6 mt-30 -137.28 66.23 1.47 Allowed 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.918 1.687 . . . . 0.0 111.264 -167.254 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -98.25 153.36 18.55 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 125.065 1.346 . . . . 0.0 112.451 177.722 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -141.19 39.29 1.76 Allowed 'General case' 0 N--CA 1.479 0.982 0 N-CA-C 114.431 1.271 . . . . 0.0 114.431 -171.488 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 34.4 m -83.34 148.75 4.87 Favored 'Isoleucine or valine' 0 C--O 1.234 0.279 0 C-N-CA 124.71 1.204 . . . . 0.0 112.663 177.662 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 43.4 t -164.96 -73.36 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 124.477 1.111 . . . . 0.0 112.475 168.919 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 18.2 t -74.64 -31.2 61.89 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 123.863 0.865 . . . . 0.0 112.476 -177.98 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 62.5 mtt -128.3 151.4 49.36 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 125.914 1.685 . . . . 0.0 110.742 169.367 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 20.2 tt0 -141.4 19.65 2.22 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 125.393 1.477 . . . . 0.0 111.822 -176.451 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -119.95 105.52 11.14 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 125.257 1.423 . . . . 0.0 112.048 -170.776 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -127.54 8.79 6.48 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 125.802 1.641 . . . . 0.0 113.584 174.581 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 51.2 p -76.25 160.77 29.35 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 125.417 1.487 . . . . 0.0 112.688 175.002 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 3.5 mmt -144.09 162.2 36.85 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 125.398 1.479 . . . . 0.0 112.526 -179.709 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 10.9 t -107.55 166.23 10.82 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 125.529 1.532 . . . . 0.0 111.752 172.522 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 2.9 t-105 . . . . . 0 C--O 1.253 1.284 0 C-N-CA 125.818 1.647 . . . . 0.0 112.772 -171.751 . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.52 0 N-CA-C 111.217 -0.753 . . . . 0.0 111.217 . . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 6.8 t -145.09 56.45 1.25 Allowed 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 124.853 1.261 . . . . 0.0 111.311 179.97 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 42.2 t-80 -136.09 92.13 2.76 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 125.301 1.441 . . . . 0.0 109.972 -179.239 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 25.5 ptt? -146.12 21.72 1.39 Allowed 'General case' 0 N--CA 1.475 0.822 0 N-CA-C 114.937 1.458 . . . . 0.0 114.937 -170.898 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -153.99 134.29 13.37 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 123.553 0.741 . . . . 0.0 112.758 179.753 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 40.1 m -151.25 103.08 2.98 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 125.981 1.712 . . . . 0.0 110.294 -173.351 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 16.9 ttp -147.77 24.1 1.09 Allowed 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 124.082 0.953 . . . . 0.0 113.112 -179.565 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 -120.42 130.7 24.72 Favored Pre-proline 0 CA--C 1.547 0.833 0 C-N-CA 124.834 1.254 . . . . 0.0 111.848 -171.931 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -80.07 -15.73 11.53 Favored 'Trans proline' 0 C--N 1.352 0.75 0 C-N-CA 123.084 2.522 . . . . 0.0 114.992 -175.454 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 96.9 mt -116.78 42.05 2.57 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 126.165 1.786 . . . . 0.0 111.806 -174.884 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -113.18 1.29 15.2 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 114.307 1.225 . . . . 0.0 114.307 179.241 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -119.22 -56.0 2.11 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 124.767 1.227 . . . . 0.0 113.063 -167.762 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.1 pp -129.72 14.38 2.44 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.875 0 C-N-CA 126.407 1.883 . . . . 0.0 112.892 -173.199 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 9.4 tt -44.73 124.05 0.83 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 C-N-CA 125.12 1.368 . . . . 0.0 112.254 178.074 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -147.1 12.61 1.09 Allowed 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 113.812 1.042 . . . . 0.0 113.812 -176.62 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -88.46 7.86 30.76 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 114.696 1.369 . . . . 0.0 114.696 -171.753 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 14.2 tt -148.71 30.61 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 C-N-CA 125.763 1.625 . . . . 0.0 113.318 -172.034 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 60.0 tttp -131.87 -43.49 0.99 Allowed 'General case' 0 N--CA 1.476 0.837 0 N-CA-C 114.28 1.215 . . . . 0.0 114.28 -179.437 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 52.2 mtmt -129.32 167.83 17.15 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 126.503 1.921 . . . . 0.0 112.436 179.224 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 57.26 35.99 26.8 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 125.76 1.624 . . . . 0.0 113.189 -176.414 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -145.28 -64.17 0.33 Allowed 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 125.202 1.401 . . . . 0.0 112.515 -176.841 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 23.1 t-20 -148.62 126.84 12.15 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.327 1.451 . . . . 0.0 110.294 -177.894 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -143.28 160.46 40.44 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 125.559 1.544 . . . . 0.0 111.314 173.687 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 87.7 p -134.1 3.47 3.42 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 126.016 1.726 . . . . 0.0 114.881 -176.186 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -163.9 105.28 0.25 Allowed Glycine 0 CA--C 1.531 1.056 0 CA-C-N 119.084 0.857 . . . . 0.0 113.414 172.191 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 4.7 t -125.78 40.83 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.072 0 C-N-CA 125.644 1.578 . . . . 0.0 111.011 -174.992 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -149.98 164.45 35.45 Favored 'General case' 0 N--CA 1.478 0.937 0 N-CA-C 114.737 1.384 . . . . 0.0 114.737 -176.768 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -109.79 26.37 10.73 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 126.354 1.862 . . . . 0.0 114.923 -165.684 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -99.54 122.48 51.4 Favored Pre-proline 0 CA--C 1.55 0.95 0 C-N-CA 125.177 1.391 . . . . 0.0 111.45 -172.128 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -78.65 -23.61 8.15 Favored 'Trans proline' 0 CA--C 1.541 0.827 0 C-N-CA 123.061 2.507 . . . . 0.0 113.001 -179.828 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 7.0 tp -148.44 -156.15 0.69 Allowed 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 126.95 2.1 . . . . 0.0 108.989 178.926 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 56.2 p -75.72 37.42 0.14 Allowed 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 126.608 1.963 . . . . 0.0 114.638 179.687 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 8.8 p -157.07 139.97 10.84 Favored Pre-proline 0 CA--C 1.542 0.668 0 C-N-CA 126.219 1.807 . . . . 0.0 110.934 -169.989 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -77.88 69.09 7.55 Favored 'Trans proline' 0 CA--C 1.545 1.067 0 C-N-CA 124.001 3.134 . . . . 0.0 111.977 179.282 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 28.6 tptt 59.56 105.67 0.03 OUTLIER Pre-proline 0 N--CA 1.481 1.109 0 C-N-CA 128.981 2.912 . . . . 0.0 113.961 -177.046 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 95.6 Cg_endo -75.59 148.92 33.67 Favored 'Trans proline' 0 CA--C 1.54 0.782 0 C-N-CA 122.74 2.293 . . . . 0.0 112.055 -176.592 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 63.6 pttt -63.36 141.67 58.68 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 124.267 1.027 . . . . 0.0 113.073 -177.344 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 29.0 tp -128.01 143.06 51.07 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 125.678 1.591 . . . . 0.0 111.414 -175.129 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 76.8 mm-40 -138.63 64.07 1.5 Allowed 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 125.377 1.471 . . . . 0.0 110.555 -178.127 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 27.6 mt-10 -127.32 68.32 1.29 Allowed 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 125.021 1.329 . . . . 0.0 112.274 -175.683 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.9 mt -123.44 149.92 44.46 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 127.086 2.155 . . . . 0.0 110.044 172.371 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 17.9 m -71.41 167.56 19.33 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 123.749 0.819 . . . . 0.0 110.733 169.293 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -56.25 -45.37 80.06 Favored 'General case' 0 N--CA 1.478 0.94 0 O-C-N 120.591 -1.318 . . . . 0.0 113.357 -174.799 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 10.4 tt0 -74.61 -42.1 59.23 Favored 'General case' 0 N--CA 1.471 0.593 0 O-C-N 121.416 -0.802 . . . . 0.0 111.46 177.004 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 29.2 mm-40 -55.3 -44.94 76.21 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.079 0.952 . . . . 0.0 110.812 176.577 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt -60.55 -42.03 95.76 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 125.058 1.343 . . . . 0.0 111.396 178.457 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 45.4 mt -69.29 -40.59 80.4 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 CA-C-O 118.117 -0.944 . . . . 0.0 111.245 177.912 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 38.2 mt -64.08 -43.05 97.42 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.848 0 CA-C-N 120.256 1.389 . . . . 0.0 110.205 177.301 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -60.24 -47.67 85.01 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.372 1.069 . . . . 0.0 110.931 177.159 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -67.51 -50.29 59.53 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 124.886 1.274 . . . . 0.0 112.328 179.722 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -64.2 -26.06 68.35 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 118.999 0.818 . . . . 0.0 112.783 -176.61 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.457 ' CD1' ' HE2' ' A' ' 63' ' ' LYS . 1.1 t80 -67.61 -58.43 4.69 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 123.913 0.885 . . . . 0.0 110.509 174.421 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.0 mt -62.61 -35.63 71.25 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 C-N-CA 126.539 1.935 . . . . 0.0 111.368 179.512 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -70.96 -26.64 63.25 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 123.881 0.873 . . . . 0.0 112.617 178.25 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -88.11 -38.84 15.05 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.267 1.027 . . . . 0.0 112.541 175.329 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.5 m -108.56 -6.99 10.96 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.147 0 N-CA-C 114.529 1.307 . . . . 0.0 114.529 -172.616 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 87.52 26.46 30.09 Favored Glycine 0 CA--C 1.531 1.056 0 C-N-CA 124.695 1.141 . . . . 0.0 115.476 161.865 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 57.15 10.21 0.8 Allowed 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 127.223 2.209 . . . . 0.0 115.09 -174.957 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 4.7 pt20 -123.27 -3.78 8.44 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 125.141 1.376 . . . . 0.0 113.713 -168.561 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 59.5 m-80 -123.47 0.52 8.85 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.953 1.301 . . . . 0.0 113.196 174.75 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 19.0 pt -74.9 152.33 6.66 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.57 0 CA-C-O 121.099 0.476 . . . . 0.0 111.223 175.125 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -140.04 143.84 36.58 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 124.668 1.187 . . . . 0.0 109.581 179.625 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -60.4 -28.24 68.08 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 123.417 0.687 . . . . 0.0 112.247 179.732 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -64.78 -48.81 82.95 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 C-N-CA 125.467 1.507 . . . . 0.0 110.157 175.222 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 78.2 m -80.71 -41.43 23.65 Favored 'General case' 0 C--O 1.223 -0.326 0 C-N-CA 124.103 0.961 . . . . 0.0 110.202 -174.722 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 20.0 tp -62.51 -35.6 79.9 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 125.214 1.406 . . . . 0.0 112.265 173.448 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.414 ' HA ' HG13 ' A' ' 66' ' ' ILE . 29.6 t -54.51 -33.47 59.96 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.706 1.203 . . . . 0.0 112.366 168.781 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -94.89 -31.85 13.5 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.755 1.222 . . . . 0.0 113.68 -176.322 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.457 ' HE2' ' CD1' ' A' ' 46' ' ' TYR . 1.0 OUTLIER -62.02 -32.75 73.27 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 125.42 1.488 . . . . 0.0 112.52 178.413 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.6 mp -118.6 8.34 11.95 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.751 1.221 . . . . 0.0 114.01 -177.97 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 44.9 m-80 53.37 56.22 7.66 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 126.243 1.817 . . . . 0.0 113.304 -178.659 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.414 HG13 ' HA ' ' A' ' 61' ' ' SER . 1.5 pt -122.08 -168.33 0.5 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.701 0 C-N-CA 127.132 2.173 . . . . 0.0 110.536 -173.738 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 2.4 p -93.48 160.2 14.9 Favored 'General case' 0 N--CA 1.476 0.835 0 O-C-N 121.264 -0.898 . . . . 0.0 111.04 170.641 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 86.9 t -61.73 -29.98 47.39 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 C-N-CA 123.086 0.554 . . . . 0.0 111.271 172.527 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -79.25 -37.73 37.23 Favored 'General case' 0 N--CA 1.468 0.429 0 O-C-N 120.854 -1.154 . . . . 0.0 110.283 -178.224 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 5.2 tmtm? -67.66 -45.31 75.65 Favored 'General case' 0 C--N 1.339 0.138 0 C-N-CA 124.56 1.144 . . . . 0.0 110.741 178.275 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -60.3 -45.86 91.9 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.713 1.605 . . . . 0.0 113.278 170.877 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 33.5 ttmt -69.46 -27.12 64.96 Favored 'General case' 0 N--CA 1.466 0.373 0 O-C-N 121.005 -1.059 . . . . 0.0 111.546 -177.251 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -55.67 -43.67 76.55 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-O 119.372 -0.347 . . . . 0.0 111.334 175.806 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 30.7 m-85 -62.16 -44.35 96.8 Favored 'General case' 0 C--O 1.224 -0.263 0 C-N-CA 125.269 1.428 . . . . 0.0 111.515 177.339 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 65.0 mt -64.59 -30.34 49.94 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.586 0 C-N-CA 123.947 0.899 . . . . 0.0 110.571 178.653 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -77.24 -38.01 52.03 Favored 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 125.0 1.32 . . . . 0.0 113.368 -178.704 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 8.3 p30 -92.86 -41.86 9.83 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 119.105 0.866 . . . . 0.0 111.587 178.841 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 4.9 t -86.2 68.05 10.15 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-O 121.926 0.87 . . . . 0.0 111.252 -176.58 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -133.17 -10.92 2.92 Favored 'General case' 0 CA--C 1.543 0.697 0 N-CA-C 114.449 1.277 . . . . 0.0 114.449 -173.38 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 2.5 mpt_? -103.32 -10.03 19.01 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 125.112 1.365 . . . . 0.0 112.747 171.75 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 9.3 tt -74.36 -30.93 62.21 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.167 1.387 . . . . 0.0 112.019 174.906 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -162.87 152.35 22.48 Favored Glycine 0 CA--C 1.529 0.96 0 C-N-CA 124.558 1.075 . . . . 0.0 112.984 174.698 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 13.6 tpp85 -150.06 -70.4 0.19 Allowed 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 113.708 1.003 . . . . 0.0 113.708 -173.295 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 14.4 t -162.73 23.49 0.1 Allowed 'General case' 0 N--CA 1.483 1.178 0 CA-C-O 122.515 1.15 . . . . 0.0 112.682 -166.658 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 72.5 m-80 -100.33 77.13 1.92 Allowed 'General case' 0 CA--C 1.542 0.637 0 O-C-N 120.409 -1.432 . . . . 0.0 111.485 -171.145 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 13.7 m120 -136.94 160.05 40.05 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.209 1.404 . . . . 0.0 113.285 -178.754 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 9.4 mp -114.25 169.4 9.05 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 127.53 2.332 . . . . 0.0 109.799 178.437 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 19.2 pttp -127.74 14.01 6.94 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 126.11 1.764 . . . . 0.0 113.506 -173.146 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 14.7 t -148.77 127.35 12.41 Favored 'General case' 0 C--O 1.233 0.212 0 C-N-CA 125.459 1.503 . . . . 0.0 109.604 175.488 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -137.69 6.68 0.75 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.732 0 C-N-CA 125.858 1.663 . . . . 0.0 113.228 -176.587 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 64.1 12.81 51.16 Favored Glycine 0 CA--C 1.538 1.52 0 O-C-N 120.776 -1.203 . . . . 0.0 114.184 -169.983 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . 0.273 3.7 mp 51.78 40.83 0.34 Allowed 'Isoleucine or valine' 0 CA--C 1.548 0.875 0 C-N-CA 126.804 2.042 . . . . 0.0 111.312 179.731 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 54.59 23.61 4.79 Favored 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 127.109 2.164 . . . . 0.0 114.759 -179.413 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 35.9 mt-30 -135.53 65.64 1.54 Allowed 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.915 1.686 . . . . 0.0 110.829 -169.462 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -126.23 152.82 45.57 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 125.549 1.54 . . . . 0.0 111.858 175.937 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -83.11 88.09 6.9 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 124.226 1.01 . . . . 0.0 110.992 178.264 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 12.2 p -149.06 145.77 17.73 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 C-N-CA 124.909 1.284 . . . . 0.0 111.724 176.08 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 75.0 m -147.38 -54.19 0.22 Allowed 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 124.724 1.21 . . . . 0.0 112.814 -178.295 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 25.9 t -107.51 -46.52 3.82 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 124.521 1.128 . . . . 0.0 112.955 -175.424 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 94.8 mtp -88.86 51.49 2.18 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 125.021 1.328 . . . . 0.0 112.143 -176.162 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 21.7 tt0 -80.41 57.73 2.92 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 125.42 1.488 . . . . 0.0 112.126 -177.114 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -137.36 124.74 21.93 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.439 1.496 . . . . 0.0 111.196 -179.522 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 59.9 mtpt -138.15 -46.14 0.52 Allowed 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 125.448 1.499 . . . . 0.0 112.587 -179.029 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 73.9 p -151.38 159.19 44.38 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 125.917 1.687 . . . . 0.0 111.84 178.304 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 53.2 mtt -142.69 165.03 28.5 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 125.761 1.624 . . . . 0.0 112.14 -179.838 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 13.0 t -129.64 164.98 22.72 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 125.914 1.686 . . . . 0.0 111.465 172.332 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 30.9 t-105 . . . . . 0 C--O 1.253 1.281 0 C-N-CA 125.313 1.445 . . . . 0.0 112.921 -168.204 . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.516 0 N-CA-C 110.774 -0.93 . . . . 0.0 110.774 . . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 48.7 m -139.6 162.22 35.61 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 125.201 1.401 . . . . 0.0 112.156 -173.875 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 66.1 m80 -128.27 157.06 41.95 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 125.535 1.534 . . . . 0.0 111.891 179.754 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 2.3 mpt? -118.61 148.07 43.07 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 125.146 1.378 . . . . 0.0 111.929 -176.253 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -78.58 152.24 31.95 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.134 0.974 . . . . 0.0 112.668 178.25 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 19.2 t -81.73 137.93 35.29 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 124.271 1.029 . . . . 0.0 111.766 177.68 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 12.1 tmm? -150.26 108.04 3.69 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.679 1.192 . . . . 0.0 109.956 178.285 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 77.4 m-20 39.72 58.66 6.8 Favored Pre-proline 0 CA--C 1.555 1.135 0 C-N-CA 127.346 2.258 . . . . 0.0 115.159 177.994 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 78.7 Cg_endo -70.02 -16.53 36.48 Favored 'Trans proline' 0 C--N 1.352 0.752 0 C-N-CA 123.29 2.66 . . . . 0.0 115.365 -170.801 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -113.93 13.1 18.25 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 126.148 1.779 . . . . 0.0 115.011 -176.974 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -74.94 -2.03 25.2 Favored 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 115.166 1.543 . . . . 0.0 115.166 -175.768 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -125.65 -61.86 1.23 Allowed 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 125.407 1.483 . . . . 0.0 112.951 -163.392 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.4 pp -104.16 -14.83 8.46 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 C-N-CA 124.681 1.193 . . . . 0.0 113.53 -177.105 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . 0.291 14.2 tt 34.44 48.95 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.27 0 C-N-CA 127.502 2.321 . . . . 0.0 116.234 170.04 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -95.94 37.33 1.23 Allowed 'General case' 0 CA--C 1.547 0.83 0 O-C-N 120.418 -1.426 . . . . 0.0 113.077 -170.902 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 -109.44 10.72 25.29 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 113.851 1.056 . . . . 0.0 113.851 -176.635 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 6.9 tp -150.14 31.34 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.48 1.047 0 C-N-CA 125.013 1.325 . . . . 0.0 113.61 -173.299 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 7.0 tmtm? -137.57 -46.04 0.55 Allowed 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 123.717 0.807 . . . . 0.0 113.045 -176.827 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 52.9 mtpt -132.79 157.47 44.89 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 127.158 2.183 . . . . 0.0 112.795 -177.473 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -101.03 104.14 15.28 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 125.313 1.445 . . . . 0.0 110.201 176.985 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -156.12 173.03 17.42 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.815 1.246 . . . . 0.0 112.333 -170.111 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 26.7 t-20 -139.75 -47.54 0.45 Allowed 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 124.157 0.983 . . . . 0.0 113.506 -179.269 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 15.1 t0 -149.76 133.81 17.11 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 124.768 1.227 . . . . 0.0 110.514 178.636 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 37.8 m -127.34 25.73 6.1 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 125.213 1.405 . . . . 0.0 113.311 179.74 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 82.64 65.61 1.6 Allowed Glycine 0 CA--C 1.53 0.983 0 C-N-CA 124.587 1.089 . . . . 0.0 112.372 178.935 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 7.9 p -131.28 14.54 1.9 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.999 0 C-N-CA 125.943 1.697 . . . . 0.0 113.029 -169.866 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 3.6 m -134.37 149.67 50.85 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 124.614 1.165 . . . . 0.0 112.681 -163.007 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.405 ' H ' HD21 ' A' ' 22' ' ' LEU . 1.8 pt? -97.28 28.21 3.78 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 116.091 1.885 . . . . 0.0 116.091 -170.961 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -148.37 149.29 31.36 Favored Pre-proline 0 CA--C 1.548 0.892 0 C-N-CA 125.251 1.42 . . . . 0.0 111.773 179.88 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -78.62 -51.52 0.07 OUTLIER 'Trans proline' 0 C--N 1.352 0.717 0 C-N-CA 122.669 2.246 . . . . 0.0 112.76 -175.887 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -159.59 -52.8 0.06 Allowed 'General case' 0 N--CA 1.476 0.838 0 CA-C-O 122.06 0.933 . . . . 0.0 112.818 176.366 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 13.2 t -152.06 163.08 40.07 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 127.666 2.386 . . . . 0.0 110.312 177.864 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 40.2 t 62.05 151.23 0.1 Allowed Pre-proline 0 N--CA 1.482 1.132 0 C-N-CA 127.334 2.254 . . . . 0.0 112.728 -169.839 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -65.48 76.93 0.26 Allowed 'Trans proline' 0 CA--C 1.547 1.136 0 C-N-CA 123.456 2.771 . . . . 0.0 111.754 168.022 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 43.1 tptt 53.31 81.09 0.27 Allowed Pre-proline 0 CA--C 1.549 0.911 0 C-N-CA 129.196 2.998 . . . . 0.0 113.906 176.069 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_endo -69.85 136.47 32.84 Favored 'Trans proline' 0 C--N 1.351 0.707 0 C-N-CA 123.192 2.594 . . . . 0.0 113.036 -179.825 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.3 151.64 9.5 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 126.027 1.731 . . . . 0.0 115.209 -169.02 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 18.7 tp -138.86 145.04 39.51 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 126.488 1.915 . . . . 0.0 110.931 -171.852 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -137.69 69.39 1.4 Allowed 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 125.614 1.566 . . . . 0.0 110.167 178.084 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 25.7 mt-10 -134.02 79.0 1.79 Allowed 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 124.577 1.151 . . . . 0.0 112.83 -174.886 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.7 mt -126.18 152.86 45.44 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 126.813 2.045 . . . . 0.0 110.194 169.277 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 18.9 t -75.31 166.77 23.11 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 123.178 0.591 . . . . 0.0 110.503 169.727 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -55.83 -46.04 78.21 Favored 'General case' 0 N--CA 1.476 0.844 0 O-C-N 120.591 -1.318 . . . . 0.0 113.077 -173.017 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 11.8 tt0 -72.29 -42.22 65.77 Favored 'General case' 0 N--CA 1.47 0.566 0 O-C-N 121.53 -0.731 . . . . 0.0 111.268 176.796 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 14.8 mm100 -60.22 -42.25 94.78 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.797 0.839 . . . . 0.0 110.695 179.744 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 41.4 ttmt -60.73 -43.07 98.35 Favored 'General case' 0 N--CA 1.466 0.332 0 C-N-CA 125.194 1.398 . . . . 0.0 111.008 176.538 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 53.2 mt -67.25 -41.59 86.83 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 CA-C-O 118.179 -0.915 . . . . 0.0 111.155 177.185 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 44.1 mt -63.89 -45.38 97.14 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.928 0 CA-C-N 120.593 1.542 . . . . 0.0 110.166 178.097 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -58.18 -49.6 76.46 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.709 1.204 . . . . 0.0 110.87 176.953 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -65.59 -52.18 54.08 Favored 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 125.028 1.331 . . . . 0.0 112.677 179.515 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 -61.43 -29.21 69.8 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-N 119.169 0.895 . . . . 0.0 112.798 -179.294 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -66.83 -56.42 10.45 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 118.685 0.675 . . . . 0.0 110.849 175.342 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 81.1 mt -65.03 -32.01 56.44 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 C-N-CA 126.886 2.074 . . . . 0.0 111.763 178.856 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -73.0 -28.06 62.15 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 123.9 0.88 . . . . 0.0 112.436 176.149 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -85.29 -39.92 17.16 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.01 0.924 . . . . 0.0 112.165 176.054 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.1 m -109.94 -3.62 10.56 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.199 0 N-CA-C 114.152 1.167 . . . . 0.0 114.152 -173.761 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 86.43 19.87 55.86 Favored Glycine 0 N--CA 1.474 1.172 0 C-N-CA 125.539 1.542 . . . . 0.0 115.525 160.538 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 57.13 5.53 0.26 Allowed 'General case' 0 CA--C 1.555 1.164 0 C-N-CA 127.057 2.143 . . . . 0.0 114.706 -166.778 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 15.9 mt-30 -98.81 -14.31 19.74 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 125.901 1.681 . . . . 0.0 112.751 -173.481 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 39.2 m-80 -131.22 6.23 4.51 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 113.937 1.088 . . . . 0.0 113.937 -171.962 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 20.1 pt -77.23 154.38 5.49 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 CA-C-N 118.691 0.678 . . . . 0.0 111.81 176.123 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -133.15 144.01 49.61 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 124.374 1.069 . . . . 0.0 110.306 175.959 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -60.58 -29.17 69.01 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.959 0.904 . . . . 0.0 111.756 177.995 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.9 mp -63.43 -57.18 12.97 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.218 0 C-N-CA 124.81 1.244 . . . . 0.0 108.903 173.93 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 52.9 m -68.42 -45.67 71.98 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 123.696 0.799 . . . . 0.0 109.764 -175.138 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 19.0 tp -57.87 -35.77 71.42 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.915 1.286 . . . . 0.0 112.175 174.324 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.405 ' HA ' HG13 ' A' ' 66' ' ' ILE . 19.4 p -63.91 -20.67 66.02 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 113.883 1.068 . . . . 0.0 113.883 172.551 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 13.6 mptt -103.82 -31.4 9.82 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 125.224 1.409 . . . . 0.0 113.351 -178.287 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 7.2 mtpp -65.87 -28.98 69.36 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 120.035 1.289 . . . . 0.0 112.105 176.836 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.9 mp -115.55 4.48 14.2 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.402 1.481 . . . . 0.0 114.381 -178.653 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 31.9 m-80 56.19 59.57 3.63 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 125.998 1.719 . . . . 0.0 113.651 179.611 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.405 HG13 ' HA ' ' A' ' 61' ' ' SER . 0.9 OUTLIER -135.41 176.63 8.11 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 C-N-CA 126.607 1.963 . . . . 0.0 111.492 -169.853 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.4 p -77.09 158.73 30.3 Favored 'General case' 0 N--CA 1.479 0.985 0 O-C-N 120.947 -1.095 . . . . 0.0 111.317 172.006 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 98.8 t -64.33 -28.5 45.03 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.984 0 O-C-N 121.684 -0.635 . . . . 0.0 111.349 173.644 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -77.86 -38.13 46.72 Favored 'General case' 0 N--CA 1.469 0.475 0 O-C-N 121.183 -0.948 . . . . 0.0 110.055 179.449 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 5.5 tmtm? -67.25 -43.24 82.4 Favored 'General case' 0 N--CA 1.462 0.175 0 C-N-CA 125.138 1.375 . . . . 0.0 111.346 177.244 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -60.7 -50.0 75.25 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.861 1.264 . . . . 0.0 112.92 170.277 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 33.8 ttmt -68.44 -24.79 64.77 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 124.615 1.166 . . . . 0.0 111.846 -176.525 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -53.64 -40.05 65.49 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 123.679 0.792 . . . . 0.0 111.444 171.899 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -70.79 -42.41 70.37 Favored 'General case' 0 C--O 1.224 -0.24 0 C-N-CA 124.152 0.981 . . . . 0.0 111.633 176.593 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 42.9 mt -65.45 -30.82 51.36 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 C-N-CA 124.711 1.204 . . . . 0.0 111.414 -179.289 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 12.4 tppt? -89.47 -22.8 22.3 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.808 1.643 . . . . 0.0 113.002 179.924 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 56.6 m-20 -82.9 -47.68 11.54 Favored 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 124.942 1.297 . . . . 0.0 110.409 172.961 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 68.0 m -118.69 112.51 19.88 Favored 'General case' 0 N--CA 1.464 0.229 0 C-N-CA 124.608 1.163 . . . . 0.0 112.034 -177.609 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -146.88 -71.4 0.23 Allowed 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 113.213 0.819 . . . . 0.0 113.213 -176.733 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 3.9 mpt_? -77.43 -16.82 58.6 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 124.637 1.175 . . . . 0.0 112.818 178.901 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -98.03 24.34 7.14 Favored 'General case' 0 CA--C 1.551 0.996 0 C-N-CA 127.129 2.172 . . . . 0.0 112.604 176.373 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -72.09 -106.43 0.06 OUTLIER Glycine 0 CA--C 1.538 1.487 0 O-C-N 120.99 -1.069 . . . . 0.0 113.27 177.52 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 80.5 mtt-85 -132.74 159.99 38.1 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 124.566 1.146 . . . . 0.0 113.201 175.598 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 10.1 t -86.66 36.25 0.7 Allowed 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 127.366 2.267 . . . . 0.0 113.615 -173.162 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 69.2 m-80 -124.07 140.7 52.72 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 125.03 1.332 . . . . 0.0 111.244 -179.275 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 18.6 t-20 -138.11 152.49 48.8 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 125.303 1.441 . . . . 0.0 111.426 -178.416 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 10.7 mp -114.46 162.69 16.36 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 127.151 2.181 . . . . 0.0 110.647 -172.041 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 48.5 pttt -120.56 16.89 12.07 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 126.605 1.962 . . . . 0.0 112.753 -173.729 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 14.6 t -146.17 122.7 11.07 Favored 'General case' 0 C--O 1.233 0.205 0 C-N-CA 125.477 1.511 . . . . 0.0 109.662 174.04 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -138.87 10.28 0.65 Allowed 'Isoleucine or valine' 0 CA--C 1.548 0.893 0 C-N-CA 125.95 1.7 . . . . 0.0 112.95 -177.106 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 77.69 -12.74 14.73 Favored Glycine 0 CA--C 1.536 1.345 0 C-N-CA 124.746 1.165 . . . . 0.0 114.505 -165.561 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 4.5 mp 54.67 97.42 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.53 0 C-N-CA 127.373 2.269 . . . . 0.0 109.825 -163.015 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 32.1 tp -67.41 76.46 0.16 Allowed 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 125.733 1.613 . . . . 0.0 112.919 -172.988 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 83.7 mt-30 -92.34 -47.97 6.91 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 124.522 1.129 . . . . 0.0 112.958 178.944 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -143.62 145.43 32.48 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 125.155 1.382 . . . . 0.0 111.108 -168.755 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -99.99 97.71 8.54 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 124.49 1.116 . . . . 0.0 110.159 175.696 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 25.8 t -129.18 -67.48 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 C-N-CA 124.56 1.144 . . . . 0.0 112.589 -172.311 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 31.2 p 51.43 11.41 0.12 Allowed 'General case' 0 CA--C 1.547 0.851 0 N-CA-C 118.89 2.922 . . . . 0.0 118.89 177.31 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 27.6 t -123.79 -44.27 2.09 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 125.349 1.46 . . . . 0.0 113.318 -178.161 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 3.0 tmm? -137.36 60.05 1.66 Allowed 'General case' 0 N--CA 1.474 0.775 0 CA-C-O 123.388 1.566 . . . . 0.0 110.148 178.552 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 22.1 tt0 -82.5 53.78 2.43 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 126.022 1.729 . . . . 0.0 112.63 -170.716 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -75.5 94.01 3.07 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 124.846 1.258 . . . . 0.0 111.769 -178.741 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 20.0 mmmt -128.24 109.46 11.5 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 126.494 1.918 . . . . 0.0 109.439 -177.746 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 11.2 t -151.81 82.49 1.28 Allowed 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.107 0.963 . . . . 0.0 111.791 -178.321 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 26.6 ptt? -156.56 162.82 39.89 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 125.532 1.533 . . . . 0.0 111.605 172.016 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 4.2 m -141.75 144.33 33.95 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 124.569 1.148 . . . . 0.0 110.535 172.612 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 3.4 t-105 . . . . . 0 C--O 1.252 1.234 0 C-N-CA 125.415 1.486 . . . . 0.0 112.675 -172.908 . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.622 0 N-CA-C 111.587 -0.605 . . . . 0.0 111.587 . . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 1.6 t -137.82 22.77 2.87 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 124.626 1.171 . . . . 0.0 113.461 -176.31 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 69.0 m80 -136.51 150.3 48.6 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 125.557 1.543 . . . . 0.0 112.3 -176.092 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 45.9 ttm -102.06 61.62 0.87 Allowed 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 125.396 1.478 . . . . 0.0 110.99 178.077 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -154.61 169.62 23.43 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.135 1.374 . . . . 0.0 112.17 -178.257 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 29.8 t -122.38 141.02 52.01 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 125.302 1.441 . . . . 0.0 111.447 176.272 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 17.7 ttt -144.44 29.78 1.26 Allowed 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 125.421 1.488 . . . . 0.0 111.617 -178.076 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 -119.65 94.11 48.15 Favored Pre-proline 0 CA--C 1.545 0.778 0 C-N-CA 125.102 1.361 . . . . 0.0 111.481 -172.224 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -78.83 -13.77 14.23 Favored 'Trans proline' 0 C--N 1.351 0.658 0 C-N-CA 122.977 2.451 . . . . 0.0 114.9 -178.949 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 96.8 mt -101.71 46.07 0.95 Allowed 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 126.015 1.726 . . . . 0.0 113.189 -170.709 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -109.79 -2.66 17.19 Favored 'General case' 0 N--CA 1.479 0.975 0 N-CA-C 114.885 1.439 . . . . 0.0 114.885 171.693 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -128.63 -55.76 1.22 Allowed 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 124.303 1.041 . . . . 0.0 113.18 -166.384 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.8 pp -108.4 9.12 9.21 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 C-N-CA 125.593 1.557 . . . . 0.0 112.882 -178.201 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 10.0 tt -54.09 117.62 0.99 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.825 0 C-N-CA 123.781 0.833 . . . . 0.0 111.769 178.301 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -150.35 15.48 0.8 Allowed 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 124.131 0.972 . . . . 0.0 113.621 -178.167 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -85.2 5.2 31.12 Favored 'General case' 0 CA--C 1.545 0.763 0 N-CA-C 114.931 1.456 . . . . 0.0 114.931 -169.183 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 13.6 tt -146.77 24.4 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.805 0 C-N-CA 125.396 1.478 . . . . 0.0 114.262 -170.217 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 35.4 ttpt -118.56 -48.15 2.51 Favored 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 114.546 1.313 . . . . 0.0 114.546 177.98 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 59.2 mttp 51.29 -175.25 0.02 OUTLIER 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 126.379 1.872 . . . . 0.0 113.978 -170.904 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 28.3 mt-10 56.56 34.11 23.83 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 126.14 1.776 . . . . 0.0 114.984 171.968 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -111.02 15.29 21.78 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 125.15 1.38 . . . . 0.0 114.58 -166.416 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 64.6 t-20 -106.1 117.99 35.46 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.971 1.308 . . . . 0.0 110.958 -179.45 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 24.7 m-20 -110.71 14.46 22.28 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 125.634 1.573 . . . . 0.0 114.466 -178.432 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 74.9 m -68.2 115.59 7.84 Favored 'General case' 0 CA--C 1.535 0.387 0 O-C-N 121.215 -0.928 . . . . 0.0 112.088 177.832 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 128.51 -12.79 6.26 Favored Glycine 0 CA--C 1.534 1.235 0 C-N-CA 125.758 1.647 . . . . 0.0 115.422 175.616 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 92.3 t -131.22 127.46 60.51 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.789 0 C-N-CA 125.083 1.353 . . . . 0.0 109.875 178.182 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 21' ' ' THR . . . . . 0.445 HG23 ' H ' ' A' ' 22' ' ' LEU . 0.3 OUTLIER 58.49 -163.08 0.21 Allowed 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 125.117 1.367 . . . . 0.0 111.883 -176.968 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.445 ' H ' HG23 ' A' ' 21' ' ' THR . 1.2 pt? -134.91 33.95 3.15 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 125.445 1.498 . . . . 0.0 113.145 -179.406 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -107.61 111.92 62.5 Favored Pre-proline 0 CA--C 1.547 0.849 0 C-N-CA 124.862 1.265 . . . . 0.0 111.954 -173.21 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo -80.27 -31.08 1.8 Allowed 'Trans proline' 0 CA--C 1.54 0.791 0 C-N-CA 122.312 2.008 . . . . 0.0 113.539 -178.805 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 18.8 tp -152.53 61.6 0.81 Allowed 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.666 1.187 . . . . 0.0 111.564 -175.74 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.2 t 56.6 40.42 29.38 Favored 'General case' 0 N--CA 1.479 0.987 0 N-CA-C 114.261 1.208 . . . . 0.0 114.261 178.586 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 10.2 p -154.43 142.71 14.34 Favored Pre-proline 0 N--CA 1.473 0.718 0 C-N-CA 126.046 1.739 . . . . 0.0 109.461 -174.376 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 98.1 Cg_endo -77.76 63.32 8.03 Favored 'Trans proline' 0 CA--C 1.548 1.18 0 C-N-CA 123.588 2.858 . . . . 0.0 112.368 -178.686 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 40.3 tptt 58.87 117.71 0.02 OUTLIER Pre-proline 0 N--CA 1.48 1.052 0 C-N-CA 129.747 3.219 . . . . 0.0 113.743 -168.456 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 82.0 Cg_endo -77.09 146.96 25.99 Favored 'Trans proline' 0 CA--C 1.538 0.696 0 C-N-CA 122.751 2.301 . . . . 0.0 111.421 -178.498 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 9.5 mtpm? -67.15 131.31 45.54 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.434 0.694 . . . . 0.0 111.056 177.964 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.3 tt -147.78 132.94 18.33 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.188 1.395 . . . . 0.0 111.882 -175.561 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -136.17 116.61 13.72 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 126.479 1.912 . . . . 0.0 109.272 173.329 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -148.61 80.16 1.44 Allowed 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 124.224 1.009 . . . . 0.0 110.304 -175.662 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 36.6 mt -135.33 154.06 51.64 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 125.994 1.718 . . . . 0.0 110.885 -173.633 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 71.2 m -71.66 165.15 24.56 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 122.976 0.51 . . . . 0.0 110.412 169.741 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -53.79 -44.9 70.49 Favored 'General case' 0 N--CA 1.478 0.952 0 O-C-N 120.952 -1.092 . . . . 0.0 112.877 -176.19 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 6.9 pt20 -72.41 -36.0 68.53 Favored 'General case' 0 N--CA 1.47 0.539 0 O-C-N 121.733 -0.605 . . . . 0.0 112.211 176.683 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 86.7 mt-30 -67.87 -40.21 83.61 Favored 'General case' 0 CA--C 1.534 0.348 0 O-C-N 121.662 -0.648 . . . . 0.0 111.271 179.373 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 17.6 ttmm -59.65 -40.87 89.16 Favored 'General case' 0 N--CA 1.471 0.595 0 O-C-N 121.469 -0.769 . . . . 0.0 110.687 174.359 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 51.5 mt -69.73 -41.54 79.99 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 CA-C-O 117.865 -1.065 . . . . 0.0 111.638 176.969 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 35.9 mt -64.0 -43.08 97.53 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.943 0 CA-C-N 121.144 1.793 . . . . 0.0 110.04 177.598 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -58.12 -49.62 76.35 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.605 1.162 . . . . 0.0 110.688 177.381 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -62.77 -52.93 61.28 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 124.776 1.23 . . . . 0.0 112.834 175.78 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -59.06 -30.99 68.47 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-N 119.154 0.888 . . . . 0.0 112.729 -179.838 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -67.73 -57.31 6.56 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 123.35 0.66 . . . . 0.0 110.644 176.871 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 89.0 mt -64.15 -33.63 63.65 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 C-N-CA 126.212 1.805 . . . . 0.0 111.352 179.686 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -71.42 -27.24 63.16 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.016 0.926 . . . . 0.0 112.544 177.097 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -88.19 -37.61 15.98 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.085 0.954 . . . . 0.0 112.533 176.151 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.5 m -109.9 -4.79 10.9 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.223 0 N-CA-C 114.488 1.292 . . . . 0.0 114.488 -174.087 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 83.13 25.8 47.03 Favored Glycine 0 N--CA 1.471 1.004 0 C-N-CA 125.028 1.299 . . . . 0.0 115.049 162.203 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 57.6 6.65 0.45 Allowed 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 127.511 2.325 . . . . 0.0 115.175 -172.061 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 27.2 mt-30 -102.17 -15.34 16.71 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 125.55 1.54 . . . . 0.0 113.181 -172.637 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 42.4 m-80 -126.49 5.68 6.89 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.167 0.987 . . . . 0.0 113.569 -172.543 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 15.1 pt -79.35 152.45 4.8 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.555 0 O-C-N 121.903 -0.498 . . . . 0.0 111.309 173.978 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -139.52 144.99 38.15 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 124.55 1.14 . . . . 0.0 109.592 178.915 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -61.94 -23.16 66.19 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 119.193 0.906 . . . . 0.0 112.59 -179.255 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 2.0 mp -70.29 -55.01 16.04 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.232 0 C-N-CA 125.336 1.454 . . . . 0.0 109.091 172.662 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 91.2 m -68.92 -43.32 75.41 Favored 'General case' 0 N--CA 1.464 0.274 0 O-C-N 121.535 -0.728 . . . . 0.0 110.385 -176.895 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 13.7 tp -60.8 -34.87 75.17 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 125.665 1.586 . . . . 0.0 112.241 173.43 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.44 ' HA ' HG13 ' A' ' 66' ' ' ILE . 4.4 t -57.11 -28.82 62.99 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 124.092 0.957 . . . . 0.0 112.685 169.806 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 8.7 mptt -105.56 -23.24 12.82 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.853 1.261 . . . . 0.0 113.789 -174.949 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 58.6 mmtt -66.46 -33.69 76.26 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 124.533 1.133 . . . . 0.0 111.458 175.316 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.0 mp -119.07 5.82 11.31 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 124.831 1.252 . . . . 0.0 114.364 -175.85 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 19.1 m-80 57.84 58.12 3.82 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 126.262 1.825 . . . . 0.0 113.221 -178.733 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.44 HG13 ' HA ' ' A' ' 61' ' ' SER . 3.4 pt -134.89 168.26 23.97 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 C-N-CA 126.072 1.749 . . . . 0.0 112.49 -170.082 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 30.5 p -69.57 151.72 45.63 Favored 'General case' 0 N--CA 1.47 0.525 0 O-C-N 121.382 -0.824 . . . . 0.0 111.405 174.918 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 91.7 t -61.09 -27.06 40.92 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.861 0 C-N-CA 123.095 0.558 . . . . 0.0 111.054 171.211 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -75.6 -41.92 53.24 Favored 'General case' 0 C--O 1.235 0.323 0 O-C-N 120.96 -1.088 . . . . 0.0 110.155 -176.839 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.25 -32.01 49.47 Favored 'General case' 0 C--N 1.346 0.416 0 CA-C-N 118.311 0.505 . . . . 0.0 111.627 179.626 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -63.86 -46.75 83.59 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.797 1.239 . . . . 0.0 112.194 171.502 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 39.4 ttmt -67.94 -29.46 68.53 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 124.3 1.04 . . . . 0.0 111.334 -178.861 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -55.35 -38.94 69.44 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 122.806 0.442 . . . . 0.0 112.071 176.393 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 35.2 m-85 -65.52 -45.57 82.98 Favored 'General case' 0 C--O 1.224 -0.264 0 C-N-CA 124.699 1.2 . . . . 0.0 111.398 175.664 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 61.6 mt -65.18 -30.59 50.75 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.592 0 C-N-CA 124.115 0.966 . . . . 0.0 110.79 -178.611 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt -79.2 -36.82 39.6 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 124.713 1.205 . . . . 0.0 113.144 179.018 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 6.3 p30 -90.9 -44.85 9.12 Favored 'General case' 0 C--N 1.345 0.387 0 CA-C-N 120.019 1.282 . . . . 0.0 111.737 179.682 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 38.7 m -97.07 93.04 6.35 Favored 'General case' 0 C--O 1.231 0.115 0 C-N-CA 123.032 0.533 . . . . 0.0 110.787 179.43 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -140.77 -54.8 0.5 Allowed 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 113.481 0.919 . . . . 0.0 113.481 -179.419 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 1.6 mpp_? -76.66 -12.84 60.06 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 124.315 1.046 . . . . 0.0 113.249 176.329 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 26.9 tp -70.31 -36.08 74.07 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.893 1.277 . . . . 0.0 112.641 176.54 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -73.22 139.42 26.86 Favored Glycine 0 CA--C 1.533 1.196 0 N-CA-C 111.577 -0.609 . . . . 0.0 111.577 175.983 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 11.3 mmm-85 -120.22 146.35 46.13 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 124.332 1.053 . . . . 0.0 112.121 -171.625 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 10.8 t -66.79 106.44 1.86 Allowed 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 125.149 1.38 . . . . 0.0 111.345 177.997 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 41.8 m-80 -131.91 111.47 11.59 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 125.436 1.494 . . . . 0.0 109.55 178.977 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 10.3 m120 -144.85 158.95 43.61 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.048 1.339 . . . . 0.0 112.244 -174.785 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 10.7 mp -88.79 163.8 15.53 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 125.53 1.532 . . . . 0.0 110.889 174.647 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 19.3 ptmt -126.13 13.08 7.77 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 126.764 2.026 . . . . 0.0 112.998 -172.014 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 15.2 t -147.3 123.1 10.6 Favored 'General case' 0 C--O 1.233 0.204 0 C-N-CA 125.758 1.623 . . . . 0.0 109.431 173.665 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -133.63 -6.31 1.35 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 C-N-CA 125.757 1.623 . . . . 0.0 111.904 177.419 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 69.23 19.16 73.87 Favored Glycine 0 CA--C 1.533 1.177 0 C-N-CA 124.679 1.133 . . . . 0.0 113.698 -165.571 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -130.55 -27.49 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.302 0 N-CA-C 114.866 1.432 . . . . 0.0 114.866 -173.766 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 17.4 tp -73.49 50.2 0.31 Allowed 'General case' 0 CA--C 1.551 0.985 0 CA-C-N 113.937 -1.483 . . . . 0.0 111.293 166.885 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 18.3 mt-30 -92.25 -9.93 40.34 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 128.091 2.556 . . . . 0.0 114.42 -170.804 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -79.12 108.32 12.53 Favored 'General case' 0 CA--C 1.544 0.726 0 O-C-N 121.101 -0.999 . . . . 0.0 111.225 178.14 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -149.4 71.37 1.11 Allowed 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 124.658 1.183 . . . . 0.0 110.912 -179.784 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 28.0 t -139.7 80.69 0.35 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 124.836 1.254 . . . . 0.0 110.1 177.519 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 47.5 t -163.23 -76.86 0.04 OUTLIER 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 123.935 0.894 . . . . 0.0 112.329 169.375 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 55.5 p -88.74 -29.14 20.04 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 125.028 1.331 . . . . 0.0 113.321 -176.744 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 43.9 mtt -126.61 142.41 51.55 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 126.465 1.906 . . . . 0.0 109.752 167.809 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -157.86 90.78 1.09 Allowed 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.839 1.655 . . . . 0.0 107.823 172.829 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -146.33 157.78 43.82 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 124.3 1.04 . . . . 0.0 113.273 -171.858 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -92.19 71.38 5.36 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 125.907 1.683 . . . . 0.0 111.776 -174.894 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 7.5 t -134.27 166.15 23.47 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 124.773 1.229 . . . . 0.0 112.662 177.348 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 28.1 ttt -133.38 93.57 3.18 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 126.45 1.9 . . . . 0.0 109.885 -179.662 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER 58.44 24.64 12.01 Favored 'General case' 0 N--CA 1.485 1.313 0 N-CA-C 115.149 1.537 . . . . 0.0 115.149 173.515 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 1.3 t-105 . . . . . 0 C--O 1.253 1.263 0 C-N-CA 126.598 1.959 . . . . 0.0 113.106 -179.574 . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.503 0 N-CA-C 111.452 -0.659 . . . . 0.0 111.452 . . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 63.1 p -86.15 -13.8 46.02 Favored 'General case' 0 N--CA 1.477 0.9 0 N-CA-C 115.15 1.537 . . . . 0.0 115.15 -174.085 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 48.5 t-80 -72.98 135.41 44.98 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 124.061 0.945 . . . . 0.0 112.82 -176.524 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 59.1 tpp -155.11 137.67 15.1 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 125.67 1.588 . . . . 0.0 110.697 -179.377 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -149.87 127.69 11.77 Favored 'General case' 0 CA--C 1.542 0.64 0 N-CA-C 113.077 0.769 . . . . 0.0 113.077 171.564 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 39.2 m -154.1 71.64 0.86 Allowed 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 126.349 1.86 . . . . 0.0 110.43 -172.415 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.2 ttt -137.66 30.65 2.57 Favored 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 124.429 1.092 . . . . 0.0 113.388 -170.539 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 8.6 t0 -101.85 123.01 45.37 Favored Pre-proline 0 CA--C 1.551 1.012 0 C-N-CA 124.471 1.109 . . . . 0.0 112.156 -176.614 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 69.1 Cg_endo -82.67 -3.42 11.27 Favored 'Trans proline' 0 C--N 1.352 0.725 0 C-N-CA 123.501 2.8 . . . . 0.0 115.147 179.437 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 81.8 mt -108.24 43.58 1.21 Allowed 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.799 1.64 . . . . 0.0 112.314 -175.793 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -104.81 0.5 28.17 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 115.013 1.486 . . . . 0.0 115.013 178.633 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -120.52 -57.72 1.89 Allowed 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 124.408 1.083 . . . . 0.0 113.489 -166.751 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.1 pp -129.71 15.87 2.44 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 C-N-CA 126.249 1.819 . . . . 0.0 112.76 -172.188 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 16.9 tt -38.88 120.66 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 C-N-CA 125.825 1.65 . . . . 0.0 113.369 178.027 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 1.9 m120 -165.01 108.1 0.85 Allowed 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.584 1.154 . . . . 0.0 109.685 179.372 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 23.3 t0 -166.44 81.91 0.26 Allowed 'General case' 0 N--CA 1.466 0.353 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 -178.82 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 46.1 mm 53.0 63.21 0.21 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.831 0 CA-C-O 123.169 1.461 . . . . 0.0 111.096 -170.463 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 1.3 mmmt -150.99 -39.39 0.13 Allowed 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 124.781 1.233 . . . . 0.0 113.968 179.595 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 50.8 tttm 43.04 61.29 2.19 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 126.606 1.962 . . . . 0.0 113.205 -177.762 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -123.04 133.56 54.33 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.699 1.2 . . . . 0.0 111.15 -178.144 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -153.35 169.81 22.2 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 125.032 1.333 . . . . 0.0 111.769 176.805 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 -146.91 147.46 30.81 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.6 1.16 . . . . 0.0 111.478 -179.655 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 33.1 m-20 -100.21 96.99 7.84 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 124.526 1.131 . . . . 0.0 111.052 -179.624 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 23.3 t -119.68 105.45 11.19 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 124.808 1.243 . . . . 0.0 110.982 178.676 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 63.13 37.03 94.25 Favored Glycine 0 N--CA 1.472 1.097 0 C-N-CA 124.889 1.233 . . . . 0.0 115.491 175.604 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 47.0 t -80.05 147.37 6.58 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 C-N-CA 125.006 1.323 . . . . 0.0 111.035 -177.833 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 35.2 m -48.82 149.6 1.74 Allowed 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 125.72 1.608 . . . . 0.0 113.696 168.976 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -142.66 34.07 1.43 Allowed 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.895 1.678 . . . . 0.0 114.171 -171.187 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -113.62 96.33 40.07 Favored Pre-proline 0 CA--C 1.551 0.983 0 C-N-CA 124.822 1.249 . . . . 0.0 111.89 -174.316 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_endo -79.42 -19.74 10.07 Favored 'Trans proline' 0 CA--C 1.542 0.878 0 C-N-CA 123.215 2.61 . . . . 0.0 113.346 178.81 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 6.3 tp -143.09 -158.23 0.85 Allowed 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 127.104 2.162 . . . . 0.0 108.758 -177.961 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 3.2 t -77.0 42.91 0.33 Allowed 'General case' 0 N--CA 1.479 0.992 0 O-C-N 120.761 -1.212 . . . . 0.0 113.205 175.356 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 7.8 p -159.0 141.14 10.05 Favored Pre-proline 0 CA--C 1.543 0.682 0 C-N-CA 126.398 1.879 . . . . 0.0 110.484 -176.097 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_endo -78.09 65.96 8.32 Favored 'Trans proline' 0 CA--C 1.548 1.184 0 C-N-CA 123.958 3.105 . . . . 0.0 111.358 174.061 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 30.3 tptt 64.27 124.58 0.02 OUTLIER Pre-proline 0 CA--C 1.554 1.099 0 C-N-CA 129.447 3.099 . . . . 0.0 114.137 -172.933 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -80.72 116.52 3.2 Favored 'Trans proline' 0 C--N 1.351 0.71 0 C-N-CA 122.558 2.172 . . . . 0.0 112.279 -179.838 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 10.1 mtpm? -55.07 141.87 32.73 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 124.371 1.068 . . . . 0.0 113.349 -172.073 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -143.59 132.57 22.84 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 126.411 1.884 . . . . 0.0 109.976 -174.809 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 33.4 mp0 -131.65 70.16 1.47 Allowed 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 125.312 1.445 . . . . 0.0 111.308 -178.345 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -109.58 73.18 0.83 Allowed 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.61 1.164 . . . . 0.0 113.357 -170.774 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 86.9 mt -138.97 148.23 43.23 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 126.282 1.833 . . . . 0.0 111.294 178.841 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 26.8 m -72.04 169.51 15.84 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 124.32 1.048 . . . . 0.0 110.871 169.889 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -57.33 -43.54 83.44 Favored 'General case' 0 CA--C 1.545 0.773 0 O-C-N 120.427 -1.421 . . . . 0.0 113.324 -173.46 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 12.6 tt0 -74.69 -43.3 55.87 Favored 'General case' 0 N--CA 1.472 0.661 0 O-C-N 121.129 -0.982 . . . . 0.0 111.696 176.856 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 11.7 mm-40 -53.46 -45.32 69.48 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.0 1.32 . . . . 0.0 111.449 174.521 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 41.0 ttmt -60.45 -38.12 83.12 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 125.31 1.444 . . . . 0.0 111.761 176.889 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 49.9 mt -76.16 -35.81 29.17 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 CA-C-O 118.075 -0.964 . . . . 0.0 111.93 178.565 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 48.8 mt -60.51 -40.97 86.01 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.035 0 CA-C-N 120.766 1.621 . . . . 0.0 109.825 172.752 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -59.45 -52.4 65.75 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.177 0.991 . . . . 0.0 110.649 175.0 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -65.36 -49.27 70.0 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 124.419 1.088 . . . . 0.0 113.42 -177.662 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 18.8 mm-40 -62.46 -25.05 67.78 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 123.941 0.896 . . . . 0.0 113.065 -179.297 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -71.87 -54.82 8.88 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 123.367 0.667 . . . . 0.0 110.999 175.883 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 52.7 mt -59.35 -36.17 62.4 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 C-N-CA 125.134 1.374 . . . . 0.0 111.262 174.202 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -67.84 -20.86 65.2 Favored 'General case' 0 CA--C 1.546 0.791 0 N-CA-C 113.266 0.839 . . . . 0.0 113.266 176.771 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -96.41 -29.72 13.78 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.882 1.273 . . . . 0.0 113.228 178.358 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 5.3 m -123.19 -22.79 2.77 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.993 0 CA-C-N 119.791 1.178 . . . . 0.0 114.068 -173.815 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 89.92 143.51 10.43 Favored Glycine 0 CA--C 1.534 1.251 0 C-N-CA 125.531 1.539 . . . . 0.0 113.082 -172.017 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 30.6 tp -59.89 -17.19 35.12 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 126.116 1.766 . . . . 0.0 114.932 -173.377 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 37.6 mt-30 -89.55 -18.99 25.55 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 126.474 1.91 . . . . 0.0 112.923 179.753 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 57.9 m-80 -108.67 -9.11 15.3 Favored 'General case' 0 N--CA 1.472 0.648 0 N-CA-C 114.35 1.241 . . . . 0.0 114.35 -173.748 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 30.5 pt -65.62 159.49 4.14 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.471 0 C-N-CA 123.787 0.835 . . . . 0.0 111.134 162.396 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -132.43 143.14 49.6 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 125.494 1.518 . . . . 0.0 109.904 175.612 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -59.44 -26.65 65.38 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 123.826 0.851 . . . . 0.0 112.219 174.679 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 27.7 mm -66.07 -44.33 92.01 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.495 0 C-N-CA 125.286 1.434 . . . . 0.0 111.686 175.36 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 56.2 m -83.4 -38.85 21.4 Favored 'General case' 0 C--O 1.222 -0.364 0 C-N-CA 123.175 0.59 . . . . 0.0 109.461 -178.515 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 14.3 tp -62.64 -37.82 87.84 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 125.0 1.32 . . . . 0.0 111.538 175.651 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.418 ' HA ' HG13 ' A' ' 66' ' ' ILE . 53.1 p -61.26 -25.76 67.3 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 113.2 0.815 . . . . 0.0 113.2 171.747 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -99.38 -28.29 13.35 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 125.092 1.357 . . . . 0.0 114.234 -177.196 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 51.9 mmtt -64.65 -36.47 84.36 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 125.806 1.642 . . . . 0.0 111.506 175.701 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.0 mp -115.31 3.64 14.26 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 125.408 1.483 . . . . 0.0 114.054 -174.0 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 42.3 m-80 56.13 61.13 2.87 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 126.347 1.859 . . . . 0.0 113.291 -179.171 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.418 HG13 ' HA ' ' A' ' 61' ' ' SER . 0.9 OUTLIER -134.82 178.11 5.9 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.715 0 C-N-CA 127.64 2.376 . . . . 0.0 111.226 -171.979 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.3 p -80.54 159.97 25.33 Favored 'General case' 0 N--CA 1.48 1.044 0 O-C-N 120.82 -1.175 . . . . 0.0 111.656 173.175 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 84.3 t -62.3 -29.13 45.98 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 C-N-CA 123.384 0.674 . . . . 0.0 111.303 172.943 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -81.28 -36.87 29.32 Favored 'General case' 0 N--CA 1.468 0.458 0 O-C-N 120.917 -1.114 . . . . 0.0 110.433 -179.436 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 9.7 tmtt? -64.08 -45.26 89.51 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 125.129 1.372 . . . . 0.0 110.702 175.922 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -60.0 -49.69 76.67 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 125.877 1.671 . . . . 0.0 113.008 170.335 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 34.7 ttmt -71.44 -23.14 61.79 Favored 'General case' 0 N--CA 1.466 0.332 0 O-C-N 121.003 -1.061 . . . . 0.0 111.876 -174.353 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -52.9 -40.34 63.44 Favored 'General case' 0 CA--C 1.546 0.796 0 CA-C-N 118.211 0.459 . . . . 0.0 111.324 172.039 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 27.8 m-85 -68.78 -40.72 79.52 Favored 'General case' 0 C--O 1.224 -0.238 0 C-N-CA 123.781 0.832 . . . . 0.0 111.486 179.5 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 61.2 mt -69.71 -26.85 31.53 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.676 0 C-N-CA 125.471 1.509 . . . . 0.0 111.121 179.666 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 71.2 mmtt -82.03 -32.0 30.69 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 125.016 1.326 . . . . 0.0 112.78 172.843 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 38.6 m-20 -82.11 -45.79 14.72 Favored 'General case' 0 C--O 1.232 0.161 0 C-N-CA 124.42 1.088 . . . . 0.0 111.082 -177.522 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 7.9 t -118.25 125.71 50.67 Favored 'General case' 0 N--CA 1.464 0.234 0 N-CA-C 113.225 0.824 . . . . 0.0 113.225 169.656 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 7.5 t-20 -148.87 -44.42 0.15 Allowed 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 114.046 1.128 . . . . 0.0 114.046 -170.264 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 1.3 mpp_? -115.14 18.72 16.11 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 126.005 1.722 . . . . 0.0 112.696 174.547 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 7.2 tt -127.71 -55.12 1.32 Allowed 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 124.8 1.24 . . . . 0.0 112.988 -173.817 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 55.4 -122.29 25.86 Favored Glycine 0 CA--C 1.535 1.313 0 N-CA-C 114.867 0.707 . . . . 0.0 114.867 178.571 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 13.0 mmt180 -132.19 163.94 27.44 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 126.464 1.906 . . . . 0.0 111.523 174.063 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 5.0 t -84.45 16.04 3.35 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 126.699 2.0 . . . . 0.0 114.672 -175.517 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 16.1 m120 -80.28 22.91 0.51 Allowed 'General case' 0 CA--C 1.55 0.962 0 O-C-N 120.059 -1.651 . . . . 0.0 114.681 -169.945 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 6.9 p-10 -106.0 11.12 31.96 Favored 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 126.18 1.792 . . . . 0.0 114.305 -173.956 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -125.94 22.63 7.35 Favored 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 125.004 1.322 . . . . 0.0 114.236 -166.409 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.23 -11.92 27.17 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 124.302 1.041 . . . . 0.0 113.583 178.234 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 15.0 t -153.37 121.97 6.34 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 125.161 1.384 . . . . 0.0 110.205 175.745 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -143.44 6.68 0.34 Allowed 'Isoleucine or valine' 0 CA--C 1.549 0.929 0 C-N-CA 125.294 1.438 . . . . 0.0 113.554 -175.525 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 77.26 -8.35 32.74 Favored Glycine 0 N--CA 1.476 1.312 0 O-C-N 120.74 -1.225 . . . . 0.0 114.899 -168.573 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 4.5 mp 53.69 84.64 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.638 0 C-N-CA 127.221 2.208 . . . . 0.0 110.088 -170.057 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 41.9 tp -58.5 92.36 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 126.295 1.838 . . . . 0.0 112.773 -168.951 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 88.2 mt-30 -138.65 -59.34 0.61 Allowed 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 124.919 1.288 . . . . 0.0 112.548 -179.108 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 63.5 mm-40 -144.77 162.15 37.46 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 125.495 1.518 . . . . 0.0 112.247 -175.364 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -123.09 101.53 7.46 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 125.308 1.443 . . . . 0.0 110.244 174.219 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 8.5 p -149.94 131.54 5.34 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 C-N-CA 124.982 1.313 . . . . 0.0 110.874 177.814 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 45.4 t -162.8 -64.93 0.05 OUTLIER 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 124.135 0.974 . . . . 0.0 112.247 173.697 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 11.1 t -89.31 -27.84 20.26 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 124.09 0.956 . . . . 0.0 113.336 -175.303 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 65.5 mtt -130.89 134.66 46.98 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 125.67 1.588 . . . . 0.0 110.259 173.359 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -136.5 5.26 2.93 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 125.449 1.5 . . . . 0.0 113.924 -175.364 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -114.64 159.49 20.42 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.871 1.669 . . . . 0.0 113.003 -174.595 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 9.5 mtpm? -112.17 108.2 17.38 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 125.739 1.616 . . . . 0.0 110.309 179.666 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 6.8 t -149.58 61.44 1.01 Allowed 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 124.851 1.26 . . . . 0.0 111.107 -178.106 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 55.6 mtt -132.54 164.89 25.62 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 125.891 1.676 . . . . 0.0 112.016 179.59 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 10.0 t -124.81 159.23 31.47 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 125.304 1.442 . . . . 0.0 112.626 179.206 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 1.5 m-90 . . . . . 0 C--O 1.253 1.28 0 C-N-CA 126.812 2.045 . . . . 0.0 111.944 -179.016 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 64.6 ttp . . . . . 0 N--CA 1.471 0.606 0 CA-C-O 120.837 0.351 . . . . 0.0 111.247 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -141.24 159.17 62.25 Favored Pre-proline 0 CA--C 1.547 0.861 0 C-N-CA 126.181 1.792 . . . . 0.0 111.098 178.167 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -71.17 -13.07 30.91 Favored 'Trans proline' 0 C--N 1.35 0.658 0 C-N-CA 122.777 2.318 . . . . 0.0 114.624 176.556 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 97.8 mt -107.64 45.96 0.97 Allowed 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 126.186 1.795 . . . . 0.0 112.918 -173.414 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 37.3 m-20 -105.49 -0.57 25.8 Favored 'General case' 0 N--CA 1.48 1.036 0 N-CA-C 114.67 1.359 . . . . 0.0 114.67 173.421 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -126.92 -58.8 1.29 Allowed 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 124.165 0.986 . . . . 0.0 113.625 -164.99 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.6 pp -109.19 5.37 9.24 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.786 0 C-N-CA 125.767 1.627 . . . . 0.0 113.227 -175.947 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 14.1 tt -45.57 -45.62 4.39 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.085 0 N-CA-C 115.398 1.629 . . . . 0.0 115.398 -170.638 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -144.74 22.86 1.6 Allowed 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 124.874 1.27 . . . . 0.0 112.892 -168.407 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -83.05 12.72 4.68 Favored 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 115.526 1.676 . . . . 0.0 115.526 -161.441 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 12.9 tt -146.23 26.51 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.913 0 C-N-CA 125.538 1.535 . . . . 0.0 113.7 -178.715 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 87.6 tttt . . . . . 0 N--CA 1.476 0.871 0 N-CA-C 114.195 1.183 . . . . 0.0 114.195 177.936 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 65.0 mt . . . . . 0 CA--C 1.541 0.618 0 N-CA-C 112.17 0.433 . . . . 0.0 112.17 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 18.8 t -73.21 168.4 19.2 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 123.579 0.752 . . . . 0.0 110.642 170.938 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -57.76 -46.94 83.84 Favored 'General case' 0 N--CA 1.475 0.791 0 O-C-N 120.49 -1.381 . . . . 0.0 112.657 -175.465 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 10.4 tt0 -70.79 -42.42 70.36 Favored 'General case' 0 N--CA 1.47 0.529 0 O-C-N 121.5 -0.75 . . . . 0.0 111.105 177.985 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 31.1 mm-40 -57.37 -45.71 84.13 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.952 0.901 . . . . 0.0 111.095 176.297 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 41.3 ttmt -61.49 -40.59 95.12 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 124.514 1.126 . . . . 0.0 111.292 177.966 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 56.4 mt -66.85 -40.42 85.81 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 CA-C-O 118.103 -0.951 . . . . 0.0 111.327 175.261 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 42.7 mt -63.51 -45.29 98.18 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.98 0 CA-C-N 120.828 1.649 . . . . 0.0 110.468 177.343 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -58.75 -48.91 79.57 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.359 1.064 . . . . 0.0 110.917 176.328 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -67.21 -52.1 45.3 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.97 1.308 . . . . 0.0 112.978 -179.19 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.9 mm-40 -60.84 -27.65 68.24 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-N 119.104 0.866 . . . . 0.0 112.793 -179.247 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -68.04 -58.15 4.96 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 123.392 0.677 . . . . 0.0 110.967 175.061 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 79.7 mt -62.6 -34.11 63.36 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.453 0 C-N-CA 126.649 1.979 . . . . 0.0 111.447 178.987 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -70.39 -25.86 63.44 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.105 0.962 . . . . 0.0 112.791 176.808 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -89.75 -39.11 13.35 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.26 1.024 . . . . 0.0 112.214 175.954 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.3 m -111.12 -5.2 11.21 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.147 0 N-CA-C 114.541 1.312 . . . . 0.0 114.541 -172.02 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 86.98 26.13 32.4 Favored Glycine 0 N--CA 1.473 1.117 0 C-N-CA 124.641 1.115 . . . . 0.0 115.737 159.508 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 55.9 10.98 0.63 Allowed 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 127.42 2.288 . . . . 0.0 115.18 -175.013 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 5.2 pt20 -124.06 -3.99 8.02 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 125.338 1.455 . . . . 0.0 113.573 -170.453 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 61.9 m-80 -122.01 0.4 9.66 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.09 1.356 . . . . 0.0 113.034 174.377 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 18.8 pt -76.86 154.52 5.63 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 C-N-CA 123.219 0.608 . . . . 0.0 111.597 176.364 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -139.16 145.05 38.89 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 125.045 1.338 . . . . 0.0 109.59 179.417 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -62.01 -27.58 68.97 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 118.875 0.761 . . . . 0.0 112.049 179.35 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -65.26 -49.94 76.15 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.432 0 C-N-CA 125.241 1.416 . . . . 0.0 109.888 175.179 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 76.5 m -78.49 -43.0 28.1 Favored 'General case' 0 C--O 1.222 -0.394 0 C-N-CA 123.685 0.794 . . . . 0.0 109.967 -175.04 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 24.2 tp -61.13 -34.35 74.85 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 124.962 1.305 . . . . 0.0 112.045 174.085 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.471 ' HA ' HG13 ' A' ' 66' ' ' ILE . 47.0 t -56.05 -31.51 63.23 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.149 0.98 . . . . 0.0 113.179 168.368 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -101.93 -19.06 15.4 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 125.254 1.422 . . . . 0.0 114.441 -175.565 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 68.8 mmtt -66.89 -40.35 87.74 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 124.386 1.074 . . . . 0.0 110.5 171.551 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.7 mp -106.74 -2.4 21.6 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.254 1.422 . . . . 0.0 114.438 -175.159 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 50.6 m-80 54.79 49.05 18.77 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 125.521 1.528 . . . . 0.0 112.457 -172.947 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.471 HG13 ' HA ' ' A' ' 61' ' ' SER . 15.3 pt -107.05 -162.01 0.15 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.662 0 C-N-CA 126.419 1.887 . . . . 0.0 110.994 -179.309 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 47.0 p -97.02 159.75 14.73 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 124.508 1.123 . . . . 0.0 111.316 167.125 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 93.5 t -62.06 -23.78 32.63 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.876 0 O-C-N 121.574 -0.704 . . . . 0.0 111.21 169.559 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 13.7 mp0 -81.43 -32.24 32.77 Favored 'General case' 0 CA--C 1.531 0.236 0 O-C-N 120.689 -1.257 . . . . 0.0 110.298 -176.654 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 41.0 mttm -66.79 -52.99 37.6 Favored 'General case' 0 C--N 1.346 0.43 0 CA-C-N 118.634 0.652 . . . . 0.0 110.256 165.044 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -57.8 -41.5 82.3 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 124.052 0.941 . . . . 0.0 112.362 -172.393 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt -73.36 -27.65 61.61 Favored 'General case' 0 N--CA 1.463 0.184 0 C-N-CA 125.489 1.516 . . . . 0.0 111.976 179.347 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -60.74 -45.37 94.57 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 118.067 0.394 . . . . 0.0 111.571 176.929 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 66.2 m-85 -59.96 -44.98 94.08 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 124.875 1.27 . . . . 0.0 111.046 179.153 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 95.3 mt -64.39 -29.58 47.75 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.709 0 C-N-CA 124.459 1.104 . . . . 0.0 111.308 -178.572 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 50.0 mmtt -83.21 -36.57 24.53 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 125.472 1.509 . . . . 0.0 113.509 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 5.7 p30 . . . . . 0 N--CA 1.466 0.341 0 CA-C-N 119.976 1.262 . . . . 0.0 112.004 -179.915 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 . . . . . 0 N--CA 1.475 0.783 0 N-CA-C 112.404 0.52 . . . . 0.0 112.404 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 55.79 48.13 18.88 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 125.951 1.701 . . . . 0.0 114.885 -179.128 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 20.8 t -131.52 135.89 58.36 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 C-N-CA 124.929 1.292 . . . . 0.0 111.434 178.221 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 50.1 m 52.72 31.96 11.24 Favored 'General case' 0 N--CA 1.483 1.184 0 N-CA-C 116.018 1.859 . . . . 0.0 116.018 170.053 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 32.3 t -149.54 -46.44 0.14 Allowed 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 124.354 1.062 . . . . 0.0 112.614 178.812 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 62.5 mtt -127.02 51.94 1.83 Allowed 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 125.414 1.486 . . . . 0.0 111.163 179.741 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -77.96 50.87 0.91 Allowed 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 125.9 1.68 . . . . 0.0 112.488 -178.485 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -135.87 166.11 24.06 Favored 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 125.989 1.716 . . . . 0.0 112.943 -172.852 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 65.2 pttt . . . . . 0 N--CA 1.476 0.855 0 C-N-CA 125.902 1.681 . . . . 0.0 112.589 176.297 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 58.6 ttm . . . . . 0 CA--C 1.538 0.495 0 N-CA-C 109.954 -0.387 . . . . 0.0 109.954 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 -136.68 153.58 75.93 Favored Pre-proline 0 CA--C 1.547 0.857 0 C-N-CA 125.049 1.34 . . . . 0.0 112.05 179.019 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 96.1 Cg_endo -79.56 -0.68 10.9 Favored 'Trans proline' 0 C--N 1.35 0.651 0 C-N-CA 123.581 2.854 . . . . 0.0 114.909 -178.718 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 89.1 mt -112.27 42.57 1.77 Allowed 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.899 1.68 . . . . 0.0 112.535 -174.584 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -112.6 0.8 15.54 Favored 'General case' 0 N--CA 1.478 0.969 0 N-CA-C 114.652 1.353 . . . . 0.0 114.652 175.761 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -117.4 -55.67 2.29 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 124.311 1.044 . . . . 0.0 113.175 -168.453 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -130.07 17.7 2.26 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.767 0 C-N-CA 126.138 1.775 . . . . 0.0 112.928 -175.301 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 9.9 tt -46.25 125.62 1.54 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 C-N-CA 124.461 1.105 . . . . 0.0 112.282 177.304 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -145.99 5.86 1.01 Allowed 'General case' 0 CA--C 1.545 0.759 0 N-CA-C 113.83 1.048 . . . . 0.0 113.83 -179.467 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -83.19 10.23 8.81 Favored 'General case' 0 CA--C 1.547 0.831 0 N-CA-C 114.553 1.316 . . . . 0.0 114.553 -172.55 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 7.1 tp -143.64 28.39 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.775 0 C-N-CA 126.607 1.963 . . . . 0.0 112.434 -177.416 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 88.8 tttt . . . . . 0 N--CA 1.472 0.668 0 N-CA-C 114.523 1.305 . . . . 0.0 114.523 -178.438 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 27.3 mt . . . . . 0 CA--C 1.541 0.627 0 CA-C-O 120.755 0.312 . . . . 0.0 111.032 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 19.2 t -72.0 170.52 13.66 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.29 0.636 . . . . 0.0 110.417 167.341 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -58.95 -47.37 85.32 Favored 'General case' 0 N--CA 1.473 0.678 0 O-C-N 120.479 -1.388 . . . . 0.0 112.404 -175.9 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 12.0 tt0 -70.06 -41.27 74.38 Favored 'General case' 0 N--CA 1.471 0.575 0 O-C-N 121.494 -0.754 . . . . 0.0 111.256 178.454 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 38.4 mm-40 -58.55 -44.23 89.57 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.831 1.252 . . . . 0.0 111.301 175.45 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 19.7 ttmm -63.14 -41.89 99.37 Favored 'General case' 0 N--CA 1.471 0.604 0 O-C-N 121.056 -1.028 . . . . 0.0 111.065 175.106 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 57.3 mt -67.61 -40.86 84.93 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 CA-C-O 117.713 -1.137 . . . . 0.0 111.879 178.583 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 34.8 mt -63.82 -43.89 98.02 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 CA-C-N 121.384 1.902 . . . . 0.0 109.954 176.967 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -59.39 -45.95 90.05 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.651 1.18 . . . . 0.0 110.91 177.214 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -66.45 -51.59 55.26 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.949 1.3 . . . . 0.0 112.984 176.55 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -58.18 -31.34 67.2 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 119.289 0.949 . . . . 0.0 112.752 179.716 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -66.5 -56.36 11.27 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 118.516 0.598 . . . . 0.0 110.748 177.492 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 84.1 mt -63.32 -33.26 60.12 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.417 0 C-N-CA 126.758 2.023 . . . . 0.0 111.478 177.72 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -71.54 -27.72 63.37 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 123.873 0.869 . . . . 0.0 112.552 176.825 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -87.54 -39.72 14.9 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.317 1.047 . . . . 0.0 112.206 176.47 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.4 m -108.27 -4.16 10.4 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.161 0 N-CA-C 114.221 1.193 . . . . 0.0 114.221 -173.854 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 84.47 23.03 52.41 Favored Glycine 0 N--CA 1.471 1.01 0 C-N-CA 125.134 1.35 . . . . 0.0 115.345 160.972 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 58.33 5.0 0.37 Allowed 'General case' 0 CA--C 1.554 1.126 0 C-N-CA 127.382 2.273 . . . . 0.0 115.104 -171.028 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 29.1 mt-30 -101.5 -16.22 16.87 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 125.66 1.584 . . . . 0.0 112.857 -172.964 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 42.3 m-80 -125.88 5.74 7.33 Favored 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 113.804 1.038 . . . . 0.0 113.804 -172.789 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 21.1 pt -77.61 154.09 5.36 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 O-C-N 121.776 -0.578 . . . . 0.0 111.781 174.678 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -140.02 142.74 36.21 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 124.777 1.231 . . . . 0.0 109.427 177.999 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -59.47 -26.3 65.12 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 119.252 0.933 . . . . 0.0 112.597 -179.121 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.9 mp -69.71 -42.31 80.25 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 C-N-CA 126.101 1.76 . . . . 0.0 110.864 175.95 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 95.9 m -80.9 -42.31 21.61 Favored 'General case' 0 C--O 1.224 -0.288 0 C-N-CA 123.472 0.709 . . . . 0.0 109.777 -179.133 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 14.5 tp -61.97 -37.96 86.73 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 125.978 1.711 . . . . 0.0 111.523 175.324 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.446 ' HA ' HG13 ' A' ' 66' ' ' ILE . 57.3 p -62.28 -23.81 66.93 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 113.363 0.875 . . . . 0.0 113.363 172.119 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 66.5 mttm -101.72 -28.48 12.45 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 125.221 1.409 . . . . 0.0 114.278 -176.432 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 10.7 mmtm -63.13 -33.23 75.02 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 125.396 1.479 . . . . 0.0 111.846 174.548 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.9 mt -118.75 0.81 11.52 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 126.531 1.932 . . . . 0.0 113.011 -169.497 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 42.5 m-80 53.69 59.07 4.56 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 126.222 1.809 . . . . 0.0 113.028 -178.288 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.446 HG13 ' HA ' ' A' ' 61' ' ' SER . 0.8 OUTLIER -131.47 175.39 11.35 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.717 0 C-N-CA 126.93 2.092 . . . . 0.0 111.693 -172.277 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -74.6 154.84 38.38 Favored 'General case' 0 N--CA 1.473 0.706 0 O-C-N 121.408 -0.807 . . . . 0.0 111.144 172.748 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 69.3 t -64.89 -27.65 42.94 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 C-N-CA 123.816 0.846 . . . . 0.0 111.565 171.406 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -79.69 -29.77 40.88 Favored 'General case' 0 N--CA 1.466 0.366 0 O-C-N 121.086 -1.008 . . . . 0.0 110.822 179.768 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 4.7 ttmm -72.82 -46.21 54.31 Favored 'General case' 0 C--N 1.341 0.201 0 C-N-CA 124.225 1.01 . . . . 0.0 110.717 171.619 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -60.49 -49.04 79.14 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 125.059 1.344 . . . . 0.0 112.621 178.355 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 18.3 ptmt -69.43 -27.03 64.91 Favored 'General case' 0 N--CA 1.469 0.475 0 O-C-N 121.165 -0.96 . . . . 0.0 111.471 -177.463 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -57.16 -36.3 70.59 Favored 'General case' 0 CA--C 1.549 0.909 0 CA-C-N 118.152 0.433 . . . . 0.0 112.135 177.539 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 29.5 m-85 -68.2 -45.17 74.1 Favored 'General case' 0 C--O 1.225 -0.19 0 C-N-CA 125.084 1.353 . . . . 0.0 110.744 175.659 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 56.1 mt -65.55 -33.6 64.73 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.562 0 C-N-CA 124.47 1.108 . . . . 0.0 111.145 -179.702 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 72.6 mmtt -75.49 -38.25 59.65 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 124.205 1.002 . . . . 0.0 112.609 -178.033 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 6.7 p30 . . . . . 0 C--N 1.344 0.341 0 CA-C-N 119.514 1.052 . . . . 0.0 110.703 176.471 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 . . . . . 0 CA--C 1.543 0.696 0 N-CA-C 112.528 0.566 . . . . 0.0 112.528 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -82.73 60.28 5.2 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 125.78 1.632 . . . . 0.0 112.72 -174.304 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 88.8 t -137.64 148.24 25.81 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 C-N-CA 125.838 1.655 . . . . 0.0 110.524 -178.792 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 10.7 t 65.44 -54.65 0.34 Allowed 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 128.061 2.544 . . . . 0.0 115.735 179.03 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 50.0 m -65.56 -33.08 75.07 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 124.159 0.984 . . . . 0.0 112.316 176.629 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 22.4 mmt -138.6 143.67 39.45 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 126.759 2.024 . . . . 0.0 109.419 165.003 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 15.1 tt0 -146.55 3.37 0.86 Allowed 'General case' 0 CA--C 1.551 1.001 0 N-CA-C 113.573 0.953 . . . . 0.0 113.573 -179.332 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -81.96 153.24 26.36 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 124.767 1.227 . . . . 0.0 113.044 -177.996 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 75.8 mmtt . . . . . 0 N--CA 1.483 1.183 0 C-N-CA 125.816 1.646 . . . . 0.0 113.99 179.551 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 52.0 ttm . . . . . 0 N--CA 1.469 0.523 0 N-CA-C 109.98 -0.378 . . . . 0.0 109.98 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -152.17 138.49 11.85 Favored Pre-proline 0 CA--C 1.551 1.002 0 C-N-CA 124.645 1.178 . . . . 0.0 111.749 -173.42 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 81.6 Cg_endo -82.8 -2.57 10.95 Favored 'Trans proline' 0 C--N 1.352 0.732 0 C-N-CA 123.287 2.658 . . . . 0.0 115.919 -176.993 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 67.3 mt -109.54 38.99 2.19 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 125.366 1.466 . . . . 0.0 113.227 -174.066 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -104.68 -0.49 27.44 Favored 'General case' 0 N--CA 1.48 1.035 0 N-CA-C 115.387 1.625 . . . . 0.0 115.387 175.454 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -115.68 -56.28 2.35 Favored 'General case' 0 N--CA 1.484 1.231 0 N-CA-C 113.598 0.962 . . . . 0.0 113.598 -167.534 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.9 pp -129.3 12.68 2.59 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.896 0 C-N-CA 126.005 1.722 . . . . 0.0 112.963 -171.599 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 12.9 tt -40.95 123.84 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.947 0 C-N-CA 125.646 1.579 . . . . 0.0 113.902 -177.419 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -153.67 120.85 5.76 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.452 1.501 . . . . 0.0 108.787 172.473 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 30.1 t0 -161.96 70.7 0.33 Allowed 'General case' 0 N--CA 1.469 0.51 0 CA-C-O 122.352 1.072 . . . . 0.0 109.148 -178.81 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 54.7 mt 53.41 63.01 0.21 Allowed 'Isoleucine or valine' 0 CA--C 1.548 0.867 0 C-N-CA 125.699 1.6 . . . . 0.0 110.414 -169.922 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 4.0 tmmm? . . . . . 0 N--CA 1.478 0.944 0 C-N-CA 124.882 1.273 . . . . 0.0 112.325 176.245 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 70.5 mt . . . . . 0 CA--C 1.537 0.447 0 N-CA-C 112.705 0.631 . . . . 0.0 112.705 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 28.1 m -73.43 166.94 22.28 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 124.2 1.0 . . . . 0.0 110.332 170.982 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -54.37 -43.63 71.52 Favored 'General case' 0 N--CA 1.474 0.765 0 O-C-N 121.132 -0.98 . . . . 0.0 113.052 -175.246 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 8.3 pt20 -75.06 -35.46 61.85 Favored 'General case' 0 N--CA 1.471 0.621 0 O-C-N 121.472 -0.767 . . . . 0.0 112.532 176.603 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 15.6 mm-40 -66.73 -41.09 88.44 Favored 'General case' 0 CA--C 1.537 0.445 0 O-C-N 121.686 -0.634 . . . . 0.0 110.487 179.789 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 15.3 ttmm -59.5 -41.68 90.46 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 123.867 0.867 . . . . 0.0 111.114 174.116 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 56.8 mt -68.41 -39.5 80.89 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.656 0 CA-C-O 117.856 -1.069 . . . . 0.0 111.388 176.945 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 27.5 mt -66.58 -42.42 89.91 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.976 0 CA-C-N 121.254 1.843 . . . . 0.0 110.629 178.003 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -55.47 -48.57 74.33 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 124.092 0.957 . . . . 0.0 110.017 175.004 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -67.55 -52.28 40.67 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.763 1.225 . . . . 0.0 113.659 178.649 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 52.8 mt-10 -60.15 -29.06 68.41 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-N 119.077 0.853 . . . . 0.0 112.889 -179.048 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -69.11 -54.04 17.08 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 118.613 0.642 . . . . 0.0 111.216 177.149 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 46.5 mt -61.01 -33.92 57.77 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.537 0 C-N-CA 125.281 1.432 . . . . 0.0 111.342 174.281 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -70.21 -22.83 62.88 Favored 'General case' 0 CA--C 1.546 0.816 0 O-C-N 121.211 -0.931 . . . . 0.0 113.064 175.982 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -93.03 -32.78 14.37 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.794 1.237 . . . . 0.0 112.916 178.644 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 4.7 m -121.9 -19.09 4.61 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.953 0 CA-C-N 119.595 1.089 . . . . 0.0 113.832 -174.006 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 86.18 142.19 6.59 Favored Glycine 0 CA--C 1.532 1.154 0 C-N-CA 125.247 1.404 . . . . 0.0 112.7 -171.787 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 46.4 tp -57.84 -19.75 31.19 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 125.484 1.514 . . . . 0.0 114.406 -177.432 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 35.9 mt-30 -80.75 -17.01 52.36 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 126.911 2.084 . . . . 0.0 113.033 -179.884 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 68.9 m-80 -115.81 -8.68 11.96 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 114.837 1.421 . . . . 0.0 114.837 -173.402 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 20.9 pt -68.21 156.8 6.75 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.546 0 C-N-CA 123.388 0.675 . . . . 0.0 111.736 169.871 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -131.25 149.61 52.5 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 124.269 1.027 . . . . 0.0 111.175 177.028 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -64.3 -27.07 68.78 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 123.645 0.778 . . . . 0.0 111.939 178.442 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -66.57 -50.21 68.5 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.399 0 C-N-CA 124.6 1.16 . . . . 0.0 109.13 173.882 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 82.9 m -73.01 -43.2 62.41 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 123.373 0.669 . . . . 0.0 110.868 -176.743 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 20.2 tp -63.95 -34.92 79.07 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.14 1.376 . . . . 0.0 111.862 176.101 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.508 ' HA ' HG13 ' A' ' 66' ' ' ILE . 25.7 t -55.8 -30.21 60.98 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 124.836 1.255 . . . . 0.0 112.727 169.629 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 11.8 mptt -100.52 -28.7 12.76 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 125.373 1.469 . . . . 0.0 113.51 -175.531 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 15.9 mmtm -64.46 -38.13 89.96 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.932 1.293 . . . . 0.0 111.373 177.868 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.3 mp -111.37 7.72 21.03 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 125.013 1.325 . . . . 0.0 113.823 -178.988 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 17.0 t30 55.01 57.01 5.96 Favored 'General case' 0 CA--C 1.552 1.052 0 CA-C-O 122.393 1.092 . . . . 0.0 111.605 177.185 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.508 HG13 ' HA ' ' A' ' 61' ' ' SER . 3.4 pt -127.57 -168.8 0.58 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.772 0 C-N-CA 126.617 1.967 . . . . 0.0 110.424 -173.627 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 41.7 p -89.25 160.63 16.83 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 123.935 0.894 . . . . 0.0 111.594 171.446 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 64.7 t -64.5 -23.67 33.92 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.944 0 O-C-N 121.658 -0.651 . . . . 0.0 111.209 168.406 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 26.3 mm-40 -78.61 -35.06 46.19 Favored 'General case' 0 N--CA 1.464 0.267 0 O-C-N 120.815 -1.178 . . . . 0.0 110.387 -177.481 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 35.2 mttm -65.05 -54.18 34.18 Favored 'General case' 0 C--N 1.346 0.432 0 CA-C-N 118.446 0.566 . . . . 0.0 110.587 166.836 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -56.75 -45.19 82.18 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.931 1.292 . . . . 0.0 112.311 -173.022 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 22.5 ttmm -68.65 -32.34 72.11 Favored 'General case' 0 CA--C 1.519 -0.228 0 C-N-CA 124.537 1.135 . . . . 0.0 111.203 178.459 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -63.34 -37.97 89.33 Favored 'General case' 0 CA--C 1.546 0.806 0 CA-C-O 118.793 -0.622 . . . . 0.0 112.578 179.575 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 79.5 m-85 -62.9 -42.91 99.95 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.52 1.128 . . . . 0.0 110.749 174.648 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 87.4 mt -71.03 -22.66 22.91 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.755 0 C-N-CA 125.057 1.343 . . . . 0.0 111.24 179.36 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 75.7 tttt -89.65 -32.96 16.83 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 125.572 1.549 . . . . 0.0 112.721 -177.885 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 8.9 p30 . . . . . 0 N--CA 1.467 0.384 0 CA-C-N 118.938 0.79 . . . . 0.0 111.617 170.918 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 22.1 mm-40 . . . . . 0 N--CA 1.477 0.887 0 N-CA-C 113.051 0.76 . . . . 0.0 113.051 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . 0.256 35.9 mt-10 52.65 38.96 27.41 Favored 'General case' 0 N--CA 1.48 1.062 0 N-CA-C 116.868 2.173 . . . . 0.0 116.868 172.139 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 33.1 t -81.7 146.82 6.74 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.327 0 C-N-CA 124.841 1.257 . . . . 0.0 111.671 -176.253 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 50.8 m 57.44 26.63 12.82 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 126.694 1.997 . . . . 0.0 115.252 177.721 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 23.2 t -149.65 -41.82 0.14 Allowed 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.559 1.144 . . . . 0.0 112.79 176.337 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 30.3 tpp -123.95 37.32 4.43 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 125.298 1.439 . . . . 0.0 111.889 -179.536 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -76.54 75.23 3.26 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 125.339 1.455 . . . . 0.0 111.504 -176.584 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -144.44 162.86 35.45 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 126.342 1.857 . . . . 0.0 111.979 -178.187 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 67.3 mttm . . . . . 0 N--CA 1.478 0.941 0 C-N-CA 125.643 1.577 . . . . 0.0 111.53 178.292 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.8 ttt . . . . . 0 N--CA 1.47 0.555 0 CA-C-O 120.532 0.206 . . . . 0.0 111.018 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 -141.24 147.02 45.29 Favored Pre-proline 0 CA--C 1.549 0.916 0 C-N-CA 125.241 1.417 . . . . 0.0 112.277 -175.955 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_endo -79.79 -22.42 7.66 Favored 'Trans proline' 0 C--N 1.35 0.641 0 C-N-CA 123.303 2.669 . . . . 0.0 115.199 -175.762 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 96.9 mt -113.17 42.43 1.92 Allowed 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.981 1.713 . . . . 0.0 112.084 -173.566 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -109.13 0.28 19.73 Favored 'General case' 0 N--CA 1.474 0.728 0 N-CA-C 114.661 1.356 . . . . 0.0 114.661 -177.927 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -126.26 -56.1 1.43 Allowed 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 124.574 1.149 . . . . 0.0 113.423 -164.308 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.9 pp -124.39 13.05 4.78 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 C-N-CA 126.223 1.809 . . . . 0.0 112.772 -173.478 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 11.4 tt -44.23 109.87 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.48 1.068 0 C-N-CA 125.693 1.597 . . . . 0.0 113.345 -177.602 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -150.95 14.95 0.73 Allowed 'General case' 0 N--CA 1.476 0.84 0 N-CA-C 115.173 1.546 . . . . 0.0 115.173 -177.373 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -86.3 8.84 19.77 Favored 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 115.15 1.537 . . . . 0.0 115.15 -170.346 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 6.8 tp -143.45 22.35 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.96 0 C-N-CA 125.547 1.539 . . . . 0.0 114.26 -173.153 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 50.1 mtmt . . . . . 0 N--CA 1.476 0.853 0 N-CA-C 114.508 1.299 . . . . 0.0 114.508 179.333 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.8 mt . . . . . 0 CA--C 1.543 0.681 0 N-CA-C 110.517 -0.179 . . . . 0.0 110.517 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 26.0 p -68.98 169.76 11.1 Favored 'General case' 0 N--CA 1.478 0.969 0 O-C-N 121.82 -0.55 . . . . 0.0 111.159 167.713 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -56.85 -44.36 82.05 Favored 'General case' 0 N--CA 1.473 0.71 0 O-C-N 120.909 -1.12 . . . . 0.0 111.766 176.377 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 9.3 tt0 -70.89 -44.91 65.32 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 123.587 0.755 . . . . 0.0 111.44 177.53 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 90.6 mt-30 -63.79 -37.19 86.43 Favored 'General case' 0 CA--C 1.534 0.363 0 O-C-N 121.722 -0.612 . . . . 0.0 111.777 179.433 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 23.6 ttmm -62.21 -43.5 98.68 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 123.805 0.842 . . . . 0.0 111.105 174.053 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 51.5 mt -65.24 -44.81 95.05 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 CA-C-N 119.021 0.828 . . . . 0.0 111.176 176.722 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 49.3 mt -64.81 -45.26 95.56 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 CA-C-N 120.095 1.316 . . . . 0.0 110.352 -179.711 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -57.09 -49.03 77.13 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 124.783 1.233 . . . . 0.0 110.357 176.838 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -65.94 -52.62 48.2 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 124.436 1.094 . . . . 0.0 112.601 179.116 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 18.7 mm-40 -60.96 -26.04 67.26 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 119.161 0.891 . . . . 0.0 113.089 -179.375 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.493 ' CE2' HG22 ' A' ' 55' ' ' ILE . 1.6 t80 -70.99 -59.12 2.96 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 123.979 0.912 . . . . 0.0 111.228 175.075 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 54.2 mt -60.12 -34.48 57.0 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 C-N-CA 126.229 1.812 . . . . 0.0 111.984 177.051 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -69.68 -24.82 63.65 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 123.953 0.901 . . . . 0.0 112.775 176.899 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -92.87 -29.41 15.95 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.497 1.119 . . . . 0.0 113.184 179.182 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 5.1 m -123.74 -22.82 2.6 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.981 0 N-CA-C 114.202 1.186 . . . . 0.0 114.202 -174.597 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 86.86 144.34 8.39 Favored Glycine 0 CA--C 1.534 1.275 0 C-N-CA 125.183 1.373 . . . . 0.0 113.373 -172.851 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -69.41 -5.37 23.2 Favored 'General case' 0 N--CA 1.478 0.967 0 N-CA-C 114.706 1.372 . . . . 0.0 114.706 -166.588 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -101.54 -6.06 24.38 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 125.415 1.486 . . . . 0.0 114.087 173.63 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 76.4 m-20 -107.5 -12.08 15.36 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 124.57 1.148 . . . . 0.0 113.759 175.935 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' ILE . . . . . 0.493 HG22 ' CE2' ' A' ' 46' ' ' TYR . 40.5 pt -68.07 157.49 6.28 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 C-N-CA 123.949 0.899 . . . . 0.0 111.27 164.691 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.3 p -124.54 144.24 50.24 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 125.002 1.321 . . . . 0.0 110.292 174.299 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -61.81 -30.77 71.05 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 124.182 0.993 . . . . 0.0 111.103 175.892 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -61.42 -58.33 8.06 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.256 0 C-N-CA 124.772 1.229 . . . . 0.0 108.565 174.811 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 46.7 m -69.91 -41.35 74.81 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 123.255 0.622 . . . . 0.0 110.649 -174.413 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 24.4 tp -60.94 -36.38 79.21 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 123.631 0.772 . . . . 0.0 112.032 174.197 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.468 ' HA ' HG13 ' A' ' 66' ' ' ILE . 10.8 p -62.21 -19.63 63.34 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 113.859 1.059 . . . . 0.0 113.859 173.667 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -105.21 -25.19 12.56 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 125.244 1.418 . . . . 0.0 114.665 176.299 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 22.1 mmtt -62.35 -35.8 80.24 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-N 119.778 1.172 . . . . 0.0 110.951 172.404 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 85.8 mt -113.8 -1.33 13.94 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 125.92 1.688 . . . . 0.0 114.029 -171.324 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 32.2 m-80 56.7 61.51 2.62 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 126.066 1.746 . . . . 0.0 113.386 -177.089 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.468 HG13 ' HA ' ' A' ' 61' ' ' SER . 0.5 OUTLIER -135.97 176.64 7.84 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.907 0 C-N-CA 126.486 1.915 . . . . 0.0 112.118 -171.0 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -71.22 154.19 41.86 Favored 'General case' 0 N--CA 1.476 0.829 0 O-C-N 121.307 -0.871 . . . . 0.0 111.535 173.007 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 86.3 t -65.13 -24.47 35.38 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 C-N-CA 124.084 0.954 . . . . 0.0 111.839 175.35 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 75.4 mm-40 -85.97 -35.36 20.47 Favored 'General case' 0 N--CA 1.469 0.484 0 O-C-N 120.907 -1.12 . . . . 0.0 110.67 176.942 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 45.3 tttt -65.01 -42.52 94.36 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 123.521 0.728 . . . . 0.0 111.117 177.904 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -58.56 -40.31 82.73 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 125.095 1.358 . . . . 0.0 112.296 170.617 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 23.0 ttpt -70.0 -32.17 70.22 Favored 'General case' 0 C--O 1.224 -0.261 0 C-N-CA 124.672 1.189 . . . . 0.0 111.29 -178.943 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -57.53 -37.69 73.48 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 123.168 0.587 . . . . 0.0 112.511 179.921 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 63.5 m-85 -66.25 -44.26 84.2 Favored 'General case' 0 N--CA 1.464 0.227 0 C-N-CA 125.088 1.355 . . . . 0.0 110.424 178.151 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 74.6 mt -64.62 -45.86 94.19 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.437 0 C-N-CA 124.751 1.22 . . . . 0.0 109.51 178.371 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 22.7 mmmt -65.72 -32.47 74.04 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 125.449 1.5 . . . . 0.0 112.712 -175.746 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 6.5 p30 . . . . . 0 CA--C 1.538 0.485 0 CA-C-N 119.259 0.936 . . . . 0.0 111.763 176.539 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 63.2 mm-40 . . . . . 0 N--CA 1.477 0.877 0 N-CA-C 113.165 0.802 . . . . 0.0 113.165 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 42.6 59.44 2.76 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 127.082 2.153 . . . . 0.0 115.09 175.46 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 12.3 t -77.23 61.04 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 C-N-CA 126.385 1.874 . . . . 0.0 112.277 -172.017 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 27.5 t -165.39 -42.73 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 125.375 1.47 . . . . 0.0 112.112 176.809 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 46.3 m -126.01 -22.71 4.07 Favored 'General case' 0 N--CA 1.479 0.999 0 N-CA-C 115.055 1.502 . . . . 0.0 115.055 -173.066 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 60.9 mtt -137.53 40.16 2.42 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 124.798 1.239 . . . . 0.0 111.72 -176.244 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 28.5 tt0 -77.2 70.39 3.59 Favored 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 126.168 1.787 . . . . 0.0 112.001 -176.202 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -143.84 149.78 37.48 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.153 1.381 . . . . 0.0 112.706 -178.922 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 67.2 mttm . . . . . 0 N--CA 1.483 1.189 0 N-CA-C 114.943 1.461 . . . . 0.0 114.943 -179.936 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 95.2 mtp . . . . . 0 N--CA 1.474 0.741 0 N-CA-C 110.815 -0.069 . . . . 0.0 110.815 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 17.6 m-20 -143.3 119.77 6.64 Favored Pre-proline 0 CA--C 1.549 0.924 0 C-N-CA 124.813 1.245 . . . . 0.0 111.405 178.252 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_endo -84.47 -12.1 7.92 Favored 'Trans proline' 0 C--N 1.351 0.661 0 C-N-CA 123.417 2.745 . . . . 0.0 115.173 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -107.9 29.66 7.06 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 125.549 1.539 . . . . 0.0 114.387 -166.601 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -104.66 -6.72 20.17 Favored 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 116.149 1.907 . . . . 0.0 116.149 -173.124 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.14 -28.55 1.71 Allowed 'General case' 0 N--CA 1.481 1.088 0 N-CA-C 117.059 2.244 . . . . 0.0 117.059 -169.482 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.3 pp -134.63 14.14 1.18 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.338 0 C-N-CA 125.545 1.538 . . . . 0.0 113.682 -178.036 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -56.1 114.02 0.59 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.848 0 C-N-CA 124.987 1.315 . . . . 0.0 111.792 -173.213 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -146.91 0.26 0.73 Allowed 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 113.862 1.06 . . . . 0.0 113.862 179.692 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -81.37 2.85 26.58 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 115.372 1.619 . . . . 0.0 115.372 -163.923 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 13.1 tt -145.31 24.71 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 C-N-CA 125.907 1.683 . . . . 0.0 113.637 -176.804 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 41.4 ttmt . . . . . 0 N--CA 1.472 0.671 0 C-N-CA 123.835 0.854 . . . . 0.0 113.125 174.158 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 5.0 mt . . . . . 0 CA--C 1.542 0.644 0 N-CA-C 110.136 -0.32 . . . . 0.0 110.136 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 73.4 m -72.95 164.02 27.29 Favored 'General case' 0 N--CA 1.479 1.009 0 O-C-N 121.869 -0.519 . . . . 0.0 110.514 170.162 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -55.42 -44.06 75.89 Favored 'General case' 0 N--CA 1.48 1.027 0 O-C-N 120.674 -1.266 . . . . 0.0 113.347 -172.832 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 6.1 pt20 -74.67 -36.75 62.81 Favored 'General case' 0 N--CA 1.47 0.565 0 O-C-N 121.482 -0.761 . . . . 0.0 112.486 174.953 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 89.7 mt-30 -63.81 -38.7 92.07 Favored 'General case' 0 N--CA 1.466 0.353 0 O-C-N 121.609 -0.682 . . . . 0.0 111.329 177.963 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 40.8 ttmt -61.91 -42.44 99.09 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 124.29 1.036 . . . . 0.0 111.063 176.763 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 44.5 mt -69.34 -42.44 81.23 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 CA-C-O 118.378 -0.82 . . . . 0.0 111.064 176.868 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 45.6 mt -63.6 -45.5 97.42 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.002 0 CA-C-N 120.278 1.399 . . . . 0.0 110.069 178.32 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -58.51 -48.65 80.11 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 125.301 1.44 . . . . 0.0 110.753 178.099 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -64.05 -52.63 58.51 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 124.461 1.104 . . . . 0.0 112.822 176.156 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.6 mm-40 -60.48 -32.15 71.14 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 118.964 0.802 . . . . 0.0 112.52 -179.456 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.5 t80 -65.71 -55.86 15.12 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 118.716 0.689 . . . . 0.0 110.642 176.939 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 66.6 mt -64.21 -34.59 69.97 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.251 0 C-N-CA 126.786 2.035 . . . . 0.0 111.739 179.205 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -68.82 -38.64 80.0 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 123.486 0.714 . . . . 0.0 111.336 175.705 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -77.42 -38.55 49.45 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.506 0.722 . . . . 0.0 112.548 179.525 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.3 m -108.64 -6.14 10.86 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.162 0 N-CA-C 114.25 1.204 . . . . 0.0 114.25 -174.206 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 86.75 26.02 33.42 Favored Glycine 0 N--CA 1.473 1.161 0 C-N-CA 124.775 1.179 . . . . 0.0 115.316 161.973 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 54.49 11.22 0.4 Allowed 'General case' 0 CA--C 1.554 1.115 0 C-N-CA 127.602 2.361 . . . . 0.0 115.32 -173.118 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 4.7 pt20 -121.47 -2.34 9.48 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 125.237 1.415 . . . . 0.0 113.546 -170.956 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 53.8 m-80 -125.59 2.73 7.58 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.03 1.332 . . . . 0.0 113.21 174.753 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 18.1 pt -75.16 152.19 6.55 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 CA-C-N 118.443 0.565 . . . . 0.0 111.459 175.214 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -138.81 145.06 39.64 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 124.327 1.051 . . . . 0.0 109.724 178.481 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -60.6 -26.66 67.14 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 119.259 0.936 . . . . 0.0 112.38 -179.296 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -70.27 -41.35 78.67 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.463 0 C-N-CA 126.086 1.754 . . . . 0.0 110.745 175.869 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 73.7 m -81.14 -44.57 17.71 Favored 'General case' 0 C--O 1.222 -0.365 0 O-C-N 121.81 -0.556 . . . . 0.0 109.53 -178.591 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 14.2 tp -61.15 -37.25 82.18 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.76 1.624 . . . . 0.0 111.682 176.214 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.446 ' HA ' HG13 ' A' ' 66' ' ' ILE . 59.7 p -61.42 -24.04 66.25 Favored 'General case' 0 N--CA 1.477 0.879 0 N-CA-C 113.488 0.922 . . . . 0.0 113.488 171.645 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -104.04 -26.54 12.56 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 125.489 1.515 . . . . 0.0 114.236 -175.149 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 60.0 mmtt -64.66 -35.04 79.75 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 125.336 1.454 . . . . 0.0 111.48 173.305 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 6.9 mt -116.39 -2.07 12.15 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 126.274 1.83 . . . . 0.0 112.908 -166.702 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 26.4 m-80 56.11 61.75 2.63 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 126.744 2.018 . . . . 0.0 113.282 -176.547 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.446 HG13 ' HA ' ' A' ' 61' ' ' SER . 0.6 OUTLIER -134.11 176.3 9.21 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 C-N-CA 126.875 2.07 . . . . 0.0 111.441 -173.137 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.4 p -78.72 158.78 28.22 Favored 'General case' 0 N--CA 1.479 1.007 0 O-C-N 121.069 -1.019 . . . . 0.0 111.231 172.943 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 92.0 t -63.88 -28.56 45.2 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.045 0 O-C-N 121.509 -0.744 . . . . 0.0 111.416 172.863 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -78.74 -38.76 38.01 Favored 'General case' 0 N--CA 1.469 0.497 0 O-C-N 120.923 -1.11 . . . . 0.0 109.722 -177.644 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 5.0 tmtm? -66.54 -47.28 73.38 Favored 'General case' 0 N--CA 1.463 0.213 0 C-N-CA 125.737 1.615 . . . . 0.0 110.615 175.245 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -58.24 -47.71 82.68 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.072 1.349 . . . . 0.0 112.9 172.514 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 35.0 ttmt -69.54 -25.35 63.97 Favored 'General case' 0 N--CA 1.464 0.252 0 O-C-N 120.993 -1.067 . . . . 0.0 111.473 -176.866 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -55.21 -41.44 72.04 Favored 'General case' 0 CA--C 1.545 0.753 0 CA-C-N 118.097 0.408 . . . . 0.0 111.576 173.886 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 53.4 m-85 -65.18 -45.61 84.18 Favored 'General case' 0 C--O 1.221 -0.408 0 C-N-CA 124.68 1.192 . . . . 0.0 111.03 176.089 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 65.3 mt -65.27 -24.87 35.94 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.7 0 C-N-CA 124.128 0.971 . . . . 0.0 111.363 -178.706 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 72.8 mmtt -87.57 -24.87 23.88 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 125.404 1.482 . . . . 0.0 114.547 179.637 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 10.6 p30 . . . . . 0 N--CA 1.47 0.537 0 CA-C-N 120.463 1.483 . . . . 0.0 112.103 169.087 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 . . . . . 0 CA--C 1.543 0.694 0 CA-C-O 120.977 0.418 . . . . 0.0 111.706 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -135.3 113.7 11.52 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 124.844 1.258 . . . . 0.0 110.43 -179.017 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 7.7 t -142.64 151.46 17.81 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 C-N-CA 125.621 1.568 . . . . 0.0 109.95 -174.301 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 38.4 t -138.13 -64.06 0.54 Allowed 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 124.1 0.96 . . . . 0.0 112.456 176.989 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 15.8 t -65.85 -31.94 73.18 Favored 'General case' 0 N--CA 1.478 0.96 0 O-C-N 121.455 -0.778 . . . . 0.0 113.009 -177.948 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 98.4 mmm -107.25 18.43 21.66 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.891 1.676 . . . . 0.0 113.106 179.003 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 24.3 tt0 -79.79 53.46 1.64 Allowed 'General case' 0 CA--C 1.553 1.063 0 C-N-CA 124.757 1.223 . . . . 0.0 112.373 -176.144 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 56.32 -179.4 0.04 OUTLIER 'General case' 0 CA--C 1.552 1.05 0 C-N-CA 127.0 2.12 . . . . 0.0 114.713 -170.867 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.477 0.924 0 C-N-CA 125.757 1.623 . . . . 0.0 112.081 177.495 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 95.8 mtp . . . . . 0 N--CA 1.474 0.726 0 CA-C-O 120.983 0.421 . . . . 0.0 110.151 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 -142.51 149.41 50.76 Favored Pre-proline 0 CA--C 1.549 0.905 0 C-N-CA 124.772 1.229 . . . . 0.0 112.422 -174.241 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -78.48 -2.93 12.92 Favored 'Trans proline' 0 C--N 1.353 0.766 0 C-N-CA 124.05 3.167 . . . . 0.0 114.61 178.048 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 94.7 mt -107.86 44.16 1.13 Allowed 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 126.218 1.807 . . . . 0.0 111.526 179.787 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -101.56 -19.04 15.65 Favored 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 114.648 1.351 . . . . 0.0 114.648 176.986 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.7 -32.37 5.18 Favored 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 115.94 1.83 . . . . 0.0 115.94 -166.267 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.2 pp -132.88 12.06 1.5 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.237 0 C-N-CA 125.011 1.324 . . . . 0.0 113.979 -176.957 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 14.9 tt -51.44 125.79 5.59 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 C-N-CA 124.805 1.242 . . . . 0.0 112.773 -173.717 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -146.52 -1.71 0.7 Allowed 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 114.154 1.168 . . . . 0.0 114.154 -179.399 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -88.06 9.98 20.69 Favored 'General case' 0 CA--C 1.544 0.715 0 N-CA-C 114.754 1.39 . . . . 0.0 114.754 -169.34 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 14.2 tt -144.08 23.2 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 C-N-CA 126.428 1.891 . . . . 0.0 113.065 -175.181 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 38.1 ttpt . . . . . 0 N--CA 1.471 0.603 0 N-CA-C 115.108 1.521 . . . . 0.0 115.108 -173.287 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.1 mt . . . . . 0 CA--C 1.545 0.766 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 71.1 m -73.38 165.13 25.63 Favored 'General case' 0 N--CA 1.48 1.059 0 O-C-N 121.883 -0.511 . . . . 0.0 110.644 169.879 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -55.77 -43.48 76.79 Favored 'General case' 0 N--CA 1.48 1.058 0 O-C-N 120.588 -1.32 . . . . 0.0 113.382 -174.586 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 12.7 tt0 -73.64 -41.44 62.75 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 123.374 0.67 . . . . 0.0 111.464 175.111 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 85.8 mt-30 -62.78 -37.89 88.47 Favored 'General case' 0 CA--C 1.535 0.37 0 O-C-N 121.648 -0.658 . . . . 0.0 111.967 179.334 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 19.8 ttmm -59.4 -41.47 89.5 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 124.355 1.062 . . . . 0.0 110.978 174.348 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 43.3 mt -70.01 -42.37 79.5 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.561 0 CA-C-O 118.234 -0.889 . . . . 0.0 111.099 177.715 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 42.6 mt -64.71 -43.88 96.56 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.891 0 CA-C-N 120.467 1.485 . . . . 0.0 110.35 177.999 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -57.24 -49.18 76.85 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.955 1.302 . . . . 0.0 110.254 177.386 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -65.45 -52.22 54.66 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 124.256 1.022 . . . . 0.0 112.854 177.272 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.0 mm-40 -60.58 -27.56 67.8 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 119.165 0.893 . . . . 0.0 113.038 -178.91 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.452 ' CE2' HG22 ' A' ' 55' ' ' ILE . 1.6 t80 -70.89 -57.4 4.63 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 123.714 0.806 . . . . 0.0 111.153 176.186 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 75.6 mt -60.3 -34.26 56.81 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.49 0 C-N-CA 126.657 1.983 . . . . 0.0 111.338 176.744 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -70.69 -24.42 62.67 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 124.12 0.968 . . . . 0.0 113.111 176.032 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -91.25 -32.41 15.76 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.396 1.078 . . . . 0.0 112.621 178.375 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 5.3 m -121.0 -19.81 4.66 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.981 0 N-CA-C 113.992 1.108 . . . . 0.0 113.992 -173.3 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 83.58 141.47 4.58 Favored Glycine 0 CA--C 1.531 1.085 0 C-N-CA 125.034 1.302 . . . . 0.0 112.205 -171.092 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -65.06 -12.82 54.87 Favored 'General case' 0 N--CA 1.477 0.921 0 CA-C-O 122.986 1.374 . . . . 0.0 113.859 -172.611 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 35.3 mt-30 -78.98 -15.78 57.81 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 126.01 1.724 . . . . 0.0 112.976 175.229 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 60.6 m-80 -116.22 -6.16 11.86 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 114.713 1.375 . . . . 0.0 114.713 -173.061 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' ILE . . . . . 0.452 HG22 ' CE2' ' A' ' 46' ' ' TYR . 15.5 pt -72.82 160.72 5.2 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 C-N-CA 123.753 0.821 . . . . 0.0 111.644 167.988 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -133.38 146.89 51.67 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 125.025 1.33 . . . . 0.0 110.577 176.004 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -63.05 -28.22 69.94 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.806 0.843 . . . . 0.0 112.135 177.672 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -64.04 -48.8 84.35 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.513 0 C-N-CA 125.275 1.43 . . . . 0.0 109.689 174.574 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 99.3 m -77.68 -40.02 42.91 Favored 'General case' 0 C--O 1.224 -0.277 0 C-N-CA 123.77 0.828 . . . . 0.0 110.721 -176.765 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 17.3 tp -63.44 -37.07 85.89 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.632 1.173 . . . . 0.0 111.774 173.611 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.442 ' HA ' HG13 ' A' ' 66' ' ' ILE . 40.1 t -55.2 -29.56 58.17 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.849 1.259 . . . . 0.0 112.753 169.341 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 59.5 mttm -95.41 -36.33 11.39 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 125.007 1.323 . . . . 0.0 113.569 -178.036 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 10.3 mmtm -61.94 -35.66 79.1 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 125.486 1.514 . . . . 0.0 112.193 -178.856 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.2 mp -115.53 6.67 14.72 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 114.113 1.153 . . . . 0.0 114.113 -176.987 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 13.9 m-80 57.21 59.11 3.53 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 126.431 1.893 . . . . 0.0 113.214 -179.327 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.442 HG13 ' HA ' ' A' ' 61' ' ' SER . 0.9 OUTLIER -125.67 -168.06 0.53 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.789 0 C-N-CA 126.755 2.022 . . . . 0.0 110.982 -172.427 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.5 p -96.35 160.11 14.59 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.311 1.044 . . . . 0.0 110.85 171.052 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 63.9 t -63.66 -28.75 45.63 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.893 0 O-C-N 121.748 -0.595 . . . . 0.0 111.417 173.801 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 44.4 mm-40 -78.55 -39.57 37.39 Favored 'General case' 0 N--CA 1.468 0.431 0 O-C-N 121.046 -1.034 . . . . 0.0 110.123 -179.16 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 5.4 tmtm? -64.38 -47.19 80.18 Favored 'General case' 0 N--CA 1.463 0.181 0 C-N-CA 125.245 1.418 . . . . 0.0 110.604 176.271 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -58.68 -48.14 82.11 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 125.687 1.595 . . . . 0.0 113.233 172.264 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 20.0 ttmm -68.34 -27.64 66.45 Favored 'General case' 0 N--CA 1.466 0.348 0 O-C-N 120.941 -1.1 . . . . 0.0 111.251 -177.928 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -56.96 -38.75 73.4 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 122.898 0.479 . . . . 0.0 112.152 176.403 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 68.1 m-85 -64.42 -45.43 87.61 Favored 'General case' 0 N--CA 1.464 0.272 0 C-N-CA 125.215 1.406 . . . . 0.0 110.956 175.091 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 81.5 mt -69.53 -26.81 31.92 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.649 0 C-N-CA 125.205 1.402 . . . . 0.0 111.468 -177.319 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 53.9 mtmt -79.56 -37.64 35.94 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.595 1.158 . . . . 0.0 113.21 177.168 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 5.9 p30 . . . . . 0 C--N 1.342 0.275 0 CA-C-N 119.431 1.014 . . . . 0.0 111.915 177.642 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 . . . . . 0 CA--C 1.548 0.872 0 CA-C-O 120.915 0.388 . . . . 0.0 111.608 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -108.03 109.61 21.1 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 124.885 1.274 . . . . 0.0 111.563 -176.643 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 53.4 t -127.86 91.41 1.7 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 C-N-CA 125.671 1.589 . . . . 0.0 109.099 174.939 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 38.0 t -169.77 -36.54 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 124.777 1.231 . . . . 0.0 111.949 176.658 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 28.1 t -139.82 130.22 25.46 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 125.142 1.377 . . . . 0.0 111.247 177.211 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 76.3 mtm 51.64 46.06 27.13 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 126.438 1.895 . . . . 0.0 113.835 173.987 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -85.51 4.92 33.64 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 126.328 1.851 . . . . 0.0 114.431 -177.809 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -74.3 163.22 28.07 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 125.529 1.532 . . . . 0.0 114.078 -177.333 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 62.3 mtpt . . . . . 0 N--CA 1.479 0.989 0 C-N-CA 126.344 1.858 . . . . 0.0 112.041 177.202 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 52.0 tpp . . . . . 0 N--CA 1.474 0.743 0 CA-C-O 121.87 0.843 . . . . 0.0 111.073 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -136.61 149.67 67.95 Favored Pre-proline 0 CA--C 1.547 0.861 0 C-N-CA 125.282 1.433 . . . . 0.0 112.023 -176.428 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_endo -81.84 -12.22 11.02 Favored 'Trans proline' 0 C--N 1.351 0.669 0 C-N-CA 123.297 2.665 . . . . 0.0 114.827 178.326 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 89.0 mt -101.01 47.01 0.92 Allowed 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.748 1.619 . . . . 0.0 113.285 -170.248 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 -105.51 -3.1 22.83 Favored 'General case' 0 N--CA 1.479 1.017 0 N-CA-C 114.795 1.406 . . . . 0.0 114.795 172.988 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -130.54 -57.32 1.06 Allowed 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 124.339 1.055 . . . . 0.0 113.356 -165.773 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.9 pp -109.1 12.16 8.82 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 C-N-CA 125.923 1.689 . . . . 0.0 112.837 -176.617 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 15.7 tt -46.96 130.09 3.33 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.777 0 C-N-CA 124.817 1.247 . . . . 0.0 112.314 176.113 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -148.79 49.33 1.0 Allowed 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.533 1.133 . . . . 0.0 111.756 -170.895 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 -106.06 11.12 31.84 Favored 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 114.005 1.113 . . . . 0.0 114.005 -175.303 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 7.2 tp -148.98 32.57 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.919 0 C-N-CA 125.589 1.556 . . . . 0.0 113.458 -172.96 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 3.1 tmtm? . . . . . 0 N--CA 1.474 0.768 0 C-N-CA 123.854 0.861 . . . . 0.0 113.042 -179.449 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.2 mt . . . . . 0 CA--C 1.545 0.775 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 22.8 t -71.48 164.71 25.29 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 123.006 0.523 . . . . 0.0 110.805 170.655 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -56.74 -44.53 81.78 Favored 'General case' 0 N--CA 1.477 0.906 0 O-C-N 120.388 -1.445 . . . . 0.0 113.155 -174.04 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 7.5 pt20 -76.64 -34.72 58.3 Favored 'General case' 0 N--CA 1.47 0.568 0 O-C-N 121.626 -0.671 . . . . 0.0 112.251 174.59 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 89.2 mt-30 -66.0 -39.44 90.3 Favored 'General case' 0 CA--C 1.53 0.207 0 O-C-N 121.693 -0.629 . . . . 0.0 111.535 -179.947 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 40.8 ttmt -59.6 -42.27 92.23 Favored 'General case' 0 N--CA 1.464 0.248 0 C-N-CA 124.749 1.22 . . . . 0.0 110.621 176.034 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 48.0 mt -68.56 -42.3 83.46 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.481 0 CA-C-O 118.256 -0.878 . . . . 0.0 111.06 177.286 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 40.2 mt -64.47 -44.36 96.97 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 CA-C-N 120.601 1.546 . . . . 0.0 110.335 178.668 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -60.61 -48.78 80.27 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 125.114 1.366 . . . . 0.0 111.128 177.366 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -64.27 -51.36 63.96 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 124.794 1.237 . . . . 0.0 112.49 177.27 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 17.0 mm-40 -61.17 -28.82 69.4 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-N 118.991 0.814 . . . . 0.0 112.545 179.246 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -65.3 -58.55 5.65 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-N 118.944 0.793 . . . . 0.0 110.47 174.434 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.3 mt -62.37 -35.58 70.28 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.363 0 C-N-CA 126.796 2.038 . . . . 0.0 111.796 179.394 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -72.08 -28.04 63.05 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.021 0.928 . . . . 0.0 112.389 178.551 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -86.71 -38.08 17.32 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.146 0.978 . . . . 0.0 112.555 175.429 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.5 m -108.5 -7.06 10.95 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.15 0 N-CA-C 114.664 1.357 . . . . 0.0 114.664 -173.197 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 86.21 27.77 29.84 Favored Glycine 0 CA--C 1.531 1.09 0 C-N-CA 124.732 1.158 . . . . 0.0 115.336 162.488 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 55.38 14.18 1.06 Allowed 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 127.224 2.21 . . . . 0.0 114.895 -176.165 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 5.1 pt20 -124.12 -6.94 7.73 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 125.147 1.379 . . . . 0.0 113.969 -170.449 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 57.2 m-80 -118.74 0.53 11.47 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 124.766 1.226 . . . . 0.0 113.264 174.414 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 23.0 pt -75.96 152.37 6.15 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 C-N-CA 123.271 0.628 . . . . 0.0 112.012 177.519 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -141.48 146.53 36.57 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 125.524 1.529 . . . . 0.0 109.354 176.442 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -62.94 -28.23 69.93 Favored 'General case' 0 C--O 1.222 -0.36 0 C-N-CA 123.743 0.817 . . . . 0.0 112.025 178.455 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -63.55 -43.38 98.25 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.471 0 C-N-CA 125.193 1.397 . . . . 0.0 109.864 174.15 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 81.9 m -83.53 -43.0 16.2 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 123.867 0.867 . . . . 0.0 110.296 -174.18 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 6.2 mt -59.13 -37.19 76.65 Favored 'General case' 0 CA--C 1.539 0.532 0 O-C-N 121.447 -0.783 . . . . 0.0 111.977 169.954 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.482 ' HA ' HG13 ' A' ' 66' ' ' ILE . 28.7 t -52.31 -33.82 44.09 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 124.055 0.942 . . . . 0.0 111.938 173.179 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -99.2 -29.53 12.78 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 124.729 1.212 . . . . 0.0 113.986 -174.774 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 18.7 mmmt -62.49 -29.13 70.32 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 125.108 1.363 . . . . 0.0 112.817 177.593 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.9 mp -127.34 14.62 7.18 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 124.865 1.266 . . . . 0.0 113.901 -177.51 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . 0.278 8.1 p30 47.12 51.18 13.36 Favored 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 126.211 1.805 . . . . 0.0 113.712 -176.257 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.482 HG13 ' HA ' ' A' ' 61' ' ' SER . 2.7 pt -110.46 -174.88 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 C-N-CA 126.905 2.082 . . . . 0.0 111.253 -177.168 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -84.96 158.55 20.49 Favored 'General case' 0 N--CA 1.477 0.912 0 O-C-N 121.227 -0.92 . . . . 0.0 110.999 170.881 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 95.5 t -63.67 -31.05 51.56 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 O-C-N 121.809 -0.557 . . . . 0.0 111.199 170.901 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -74.94 -35.31 62.16 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 119.783 1.174 . . . . 0.0 110.367 178.511 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 22.2 tttt -65.56 -48.9 70.83 Favored 'General case' 0 C--N 1.342 0.257 0 C-N-CA 123.279 0.631 . . . . 0.0 110.833 175.489 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -58.28 -41.46 84.42 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.917 1.687 . . . . 0.0 113.087 175.942 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 37.2 ttmt -74.13 -30.4 62.28 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 125.472 1.509 . . . . 0.0 111.6 -178.714 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -56.54 -42.92 79.31 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 122.85 0.46 . . . . 0.0 111.772 177.242 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 53.5 m-85 -64.53 -42.57 95.66 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 125.006 1.323 . . . . 0.0 111.004 178.495 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 74.0 mt -65.56 -38.98 83.69 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.477 0 C-N-CA 124.05 0.94 . . . . 0.0 110.672 178.817 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 71.3 mmtt -72.6 -40.72 66.32 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 124.761 1.224 . . . . 0.0 112.969 -177.403 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 4.7 p30 . . . . . 0 CA--C 1.532 0.284 0 CA-C-N 118.636 0.653 . . . . 0.0 111.208 -178.949 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 . . . . . 0 CA--C 1.544 0.731 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -146.23 31.47 1.01 Allowed 'General case' 0 N--CA 1.479 0.984 0 N-CA-C 115.503 1.668 . . . . 0.0 115.503 -166.593 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 52.6 t -135.65 117.9 21.43 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 C-N-CA 123.684 0.794 . . . . 0.0 111.937 -175.962 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 37.8 t -160.54 -72.69 0.07 Allowed 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 123.931 0.892 . . . . 0.0 112.618 176.605 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 25.5 m -73.0 -21.63 60.8 Favored 'General case' 0 N--CA 1.48 1.058 0 N-CA-C 113.806 1.039 . . . . 0.0 113.806 -176.422 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -132.61 136.62 46.64 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 125.957 1.703 . . . . 0.0 110.109 168.257 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -147.47 100.83 3.3 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.791 1.636 . . . . 0.0 108.463 175.814 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -137.59 149.91 47.03 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.757 1.223 . . . . 0.0 112.15 179.569 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 67.4 mttm . . . . . 0 N--CA 1.475 0.812 0 C-N-CA 125.694 1.598 . . . . 0.0 109.732 175.52 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 10.4 tpt . . . . . 0 CA--C 1.543 0.707 0 CA-C-O 121.039 0.447 . . . . 0.0 110.852 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 48.2 m-20 -95.84 148.87 35.24 Favored Pre-proline 0 CA--C 1.549 0.911 0 C-N-CA 124.329 1.051 . . . . 0.0 113.097 -179.745 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 65.4 Cg_endo -84.39 -5.97 10.1 Favored 'Trans proline' 0 C--N 1.351 0.703 0 C-N-CA 123.872 3.048 . . . . 0.0 114.516 174.58 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 97.8 mt -97.72 44.66 1.04 Allowed 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.153 1.381 . . . . 0.0 113.437 -172.414 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -111.33 -1.67 15.94 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 124.729 1.212 . . . . 0.0 114.235 171.298 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.67 -56.21 1.14 Allowed 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 124.489 1.116 . . . . 0.0 113.191 -165.211 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.7 pp -110.74 10.04 8.67 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.784 0 C-N-CA 125.848 1.659 . . . . 0.0 112.914 -178.134 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 13.3 tt -50.32 133.73 10.24 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 C-N-CA 124.189 0.996 . . . . 0.0 112.392 176.424 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 6.5 t30 -140.17 12.39 2.4 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 124.99 1.316 . . . . 0.0 113.195 -176.732 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -79.57 10.17 4.2 Favored 'General case' 0 CA--C 1.546 0.805 0 N-CA-C 115.029 1.492 . . . . 0.0 115.029 -169.468 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 13.9 tt -139.68 20.57 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 C-N-CA 127.247 2.219 . . . . 0.0 112.579 176.672 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 1.5 tmtp? . . . . . 0 N--CA 1.472 0.65 0 C-N-CA 124.367 1.067 . . . . 0.0 113.603 -176.112 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 2.1 mt . . . . . 0 CA--C 1.543 0.71 0 N-CA-C 110.085 -0.339 . . . . 0.0 110.085 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 15.5 m -72.18 166.66 21.93 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.397 0.679 . . . . 0.0 111.707 176.257 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -57.04 -36.44 70.49 Favored 'General case' 0 N--CA 1.477 0.887 0 N-CA-C 113.951 1.093 . . . . 0.0 113.951 -172.697 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 11.3 tt0 -87.23 -40.9 14.13 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 123.857 0.863 . . . . 0.0 112.253 173.7 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 24.7 mm-40 -53.75 -44.3 69.86 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 124.322 1.049 . . . . 0.0 111.475 176.943 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 13.7 ptmt -66.0 -32.67 74.29 Favored 'General case' 0 N--CA 1.469 0.507 0 O-C-N 121.561 -0.712 . . . . 0.0 111.926 -179.262 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 49.3 mt -72.82 -43.71 59.93 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 CA-C-N 119.124 0.874 . . . . 0.0 110.864 175.907 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 50.2 mt -60.47 -43.36 94.03 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.978 0 CA-C-N 119.706 1.139 . . . . 0.0 110.362 176.737 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -61.6 -48.54 80.47 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 124.966 1.306 . . . . 0.0 110.958 175.278 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -67.47 -48.84 65.99 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 124.081 0.952 . . . . 0.0 113.033 -178.218 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -61.79 -23.68 66.36 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.707 0.803 . . . . 0.0 113.061 -179.032 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -73.09 -58.72 3.11 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 123.971 0.909 . . . . 0.0 111.141 174.564 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 67.6 mt -57.96 -35.41 51.88 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 C-N-CA 126.869 2.068 . . . . 0.0 111.476 176.267 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -70.21 -22.56 62.91 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 124.256 1.022 . . . . 0.0 113.317 176.644 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -93.72 -31.86 14.26 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.689 1.196 . . . . 0.0 112.719 178.22 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 6.3 m -121.72 -20.65 4.01 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 N-CA-C 113.971 1.101 . . . . 0.0 113.971 -172.991 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 84.42 142.89 5.69 Favored Glycine 0 CA--C 1.531 1.059 0 C-N-CA 125.047 1.308 . . . . 0.0 112.24 -171.341 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -67.22 -5.89 15.81 Favored 'General case' 0 N--CA 1.479 0.999 0 CA-C-O 122.688 1.232 . . . . 0.0 114.24 -171.207 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 38.8 mt-30 -90.3 -16.25 29.63 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 126.476 1.91 . . . . 0.0 112.753 176.512 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 58.5 m-80 -111.06 -6.03 14.7 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.831 1.252 . . . . 0.0 114.119 -176.336 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 15.5 pt -73.3 161.26 4.97 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 C-N-CA 124.07 0.948 . . . . 0.0 111.42 166.189 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.1 p -131.75 145.49 51.64 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 125.162 1.385 . . . . 0.0 110.495 175.953 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -61.65 -29.88 70.35 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 123.976 0.91 . . . . 0.0 111.844 177.748 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -63.0 -49.07 85.02 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.499 0 C-N-CA 125.316 1.446 . . . . 0.0 109.977 175.261 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 58.5 m -78.48 -42.98 28.2 Favored 'General case' 0 C--O 1.222 -0.357 0 C-N-CA 123.711 0.804 . . . . 0.0 109.854 -175.275 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 20.2 tp -61.5 -36.43 80.5 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.435 1.094 . . . . 0.0 112.17 174.874 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.476 ' HA ' HG13 ' A' ' 66' ' ' ILE . 38.4 t -54.03 -30.72 48.85 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 124.765 1.226 . . . . 0.0 112.725 169.041 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -102.21 -23.98 13.96 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.435 1.494 . . . . 0.0 114.373 -174.724 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 69.9 mmtt -61.5 -39.4 90.84 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 124.582 1.153 . . . . 0.0 110.993 170.429 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 9.2 mt -115.03 4.34 14.68 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 126.666 1.986 . . . . 0.0 113.209 -166.665 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . 0.292 7.4 p30 46.29 57.95 4.92 Favored 'General case' 0 CA--C 1.55 0.943 0 C-N-CA 126.803 2.041 . . . . 0.0 114.085 -175.266 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.476 HG13 ' HA ' ' A' ' 61' ' ' SER . 0.9 OUTLIER -120.83 -168.23 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 C-N-CA 127.386 2.274 . . . . 0.0 111.359 -175.756 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -88.68 156.88 18.75 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.131 0.972 . . . . 0.0 110.867 169.5 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 87.6 t -62.6 -31.58 52.53 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 123.209 0.604 . . . . 0.0 111.345 173.27 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 10.7 mp0 -79.53 -34.41 41.12 Favored 'General case' 0 CA--C 1.532 0.27 0 O-C-N 120.744 -1.222 . . . . 0.0 110.037 -178.317 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 12.2 tmtt? -68.67 -41.82 78.74 Favored 'General case' 0 C--N 1.343 0.304 0 C-N-CA 123.375 0.67 . . . . 0.0 111.306 177.239 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -58.71 -43.53 90.12 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.39 1.476 . . . . 0.0 112.661 169.188 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 37.6 ttpt -69.26 -27.52 65.51 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 125.004 1.322 . . . . 0.0 111.951 -179.346 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -61.47 -34.36 75.32 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 123.321 0.648 . . . . 0.0 112.462 177.661 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 55.9 m-85 -67.18 -45.71 76.13 Favored 'General case' 0 N--CA 1.466 0.348 0 C-N-CA 124.369 1.067 . . . . 0.0 110.528 171.057 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 73.9 mt -65.17 -24.84 36.04 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.834 0 O-C-N 121.135 -0.978 . . . . 0.0 111.675 -179.859 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.42 ' HA ' ' HE3' ' A' ' 76' ' ' LYS . 0.0 OUTLIER -81.78 -37.51 27.04 Favored 'General case' 0 N--CA 1.472 0.655 0 O-C-N 120.248 -1.533 . . . . 0.0 113.291 175.983 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 3.7 p30 . . . . . 0 N--CA 1.467 0.401 0 CA-C-N 119.807 1.185 . . . . 0.0 112.509 -176.776 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 . . . . . 0 CA--C 1.543 0.697 0 N-CA-C 112.726 0.639 . . . . 0.0 112.726 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -99.4 105.56 17.53 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 124.595 1.158 . . . . 0.0 110.493 177.397 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 57.3 t -133.9 100.62 3.42 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.574 0 C-N-CA 125.199 1.4 . . . . 0.0 109.526 174.134 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 43.1 t -166.54 -73.1 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.428 1.091 . . . . 0.0 111.834 171.779 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 18.1 t -84.94 -32.69 22.94 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 124.095 0.958 . . . . 0.0 112.838 -176.502 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -126.06 125.46 42.65 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 125.836 1.654 . . . . 0.0 110.274 175.807 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -152.64 105.91 3.03 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 125.653 1.581 . . . . 0.0 108.254 173.47 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -144.78 -41.49 0.25 Allowed 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 116.009 1.855 . . . . 0.0 116.009 179.388 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 46.8 mmtm . . . . . 0 N--CA 1.484 1.249 0 C-N-CA 126.611 1.964 . . . . 0.0 113.204 -173.443 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.473 0.678 0 CA-C-O 120.731 0.3 . . . . 0.0 110.635 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 58.7 m-20 38.11 55.61 4.47 Favored Pre-proline 0 CA--C 1.555 1.154 0 C-N-CA 127.721 2.409 . . . . 0.0 115.183 -177.711 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_endo -80.42 -7.5 13.82 Favored 'Trans proline' 0 C--N 1.351 0.683 0 C-N-CA 123.034 2.489 . . . . 0.0 114.907 -170.53 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -133.65 23.62 3.99 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 125.307 1.443 . . . . 0.0 114.594 -173.633 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -111.27 0.3 16.67 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 114.59 1.33 . . . . 0.0 114.59 -168.92 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -136.69 -30.13 0.91 Allowed 'General case' 0 N--CA 1.477 0.886 0 N-CA-C 116.442 2.016 . . . . 0.0 116.442 -164.726 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.2 pp -136.93 11.78 0.83 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.29 0 C-N-CA 125.427 1.491 . . . . 0.0 113.848 -177.833 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 19.0 tt -45.89 107.39 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.926 0 C-N-CA 126.246 1.818 . . . . 0.0 114.654 -163.596 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 21.7 t-20 -161.58 104.48 1.23 Allowed 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 125.683 1.593 . . . . 0.0 110.537 175.793 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -149.4 9.56 0.74 Allowed 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 114.477 1.288 . . . . 0.0 114.477 175.786 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 12.7 tt -151.06 27.65 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.164 0 C-N-CA 124.548 1.139 . . . . 0.0 113.83 -169.827 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 58.1 tttp . . . . . 0 N--CA 1.473 0.715 0 C-N-CA 124.353 1.061 . . . . 0.0 113.362 -177.467 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.2 mp . . . . . 0 CA--C 1.544 0.715 0 CA-C-O 120.689 0.281 . . . . 0.0 110.909 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 19.3 t -70.04 165.4 21.95 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 122.781 0.432 . . . . 0.0 110.472 170.547 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -56.45 -46.09 80.5 Favored 'General case' 0 N--CA 1.476 0.84 0 O-C-N 120.388 -1.445 . . . . 0.0 112.933 -173.188 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 9.2 tt0 -72.93 -43.0 62.9 Favored 'General case' 0 CA--C 1.539 0.523 0 O-C-N 121.41 -0.806 . . . . 0.0 111.418 177.686 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 36.7 mm-40 -55.1 -44.44 74.94 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.659 1.184 . . . . 0.0 111.233 175.664 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 42.0 ttmt -62.95 -44.0 97.26 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 125.171 1.388 . . . . 0.0 111.58 177.53 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 54.0 mt -65.95 -41.97 90.9 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 CA-C-N 119.12 0.873 . . . . 0.0 111.134 178.031 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 37.9 mt -66.67 -42.26 89.38 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.885 0 CA-C-N 120.291 1.405 . . . . 0.0 110.512 179.001 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -60.11 -47.26 86.64 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.033 0.933 . . . . 0.0 110.898 175.614 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -68.01 -49.85 59.08 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 124.819 1.248 . . . . 0.0 112.217 -179.931 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -64.27 -23.49 67.32 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 119.209 0.913 . . . . 0.0 112.976 -176.953 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -71.31 -59.68 2.64 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.388 1.075 . . . . 0.0 110.792 173.226 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 62.9 mt -62.5 -34.68 66.09 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.256 0 C-N-CA 127.417 2.287 . . . . 0.0 111.953 -179.625 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -68.58 -33.46 74.1 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 123.784 0.834 . . . . 0.0 111.989 176.933 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -85.36 -38.18 19.04 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.696 0.799 . . . . 0.0 112.3 179.068 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.0 m -108.39 -5.45 10.68 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.126 0 N-CA-C 114.013 1.116 . . . . 0.0 114.013 -173.909 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 87.79 24.63 34.83 Favored Glycine 0 N--CA 1.472 1.09 0 C-N-CA 125.047 1.308 . . . . 0.0 115.73 159.639 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 56.23 10.67 0.66 Allowed 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 127.146 2.178 . . . . 0.0 114.848 -174.014 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 5.2 pt20 -124.87 -5.91 7.41 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 125.564 1.546 . . . . 0.0 113.573 -169.873 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 59.4 m-80 -121.38 2.33 10.24 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.34 1.456 . . . . 0.0 112.577 173.294 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 23.2 pt -74.97 154.19 6.44 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.583 0 C-N-CA 123.048 0.539 . . . . 0.0 111.147 173.958 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -136.77 142.58 42.99 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 124.972 1.309 . . . . 0.0 109.177 177.465 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -61.57 -26.88 68.24 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 118.958 0.799 . . . . 0.0 112.494 -179.766 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -65.36 -47.69 86.06 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.559 0 C-N-CA 125.313 1.445 . . . . 0.0 109.989 174.3 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 72.5 m -77.75 -43.11 31.84 Favored 'General case' 0 C--O 1.221 -0.402 0 N-CA-C 109.411 -0.589 . . . . 0.0 109.411 -176.814 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 16.5 tp -60.71 -37.55 82.07 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 125.105 1.362 . . . . 0.0 112.155 175.143 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.458 ' HA ' HG13 ' A' ' 66' ' ' ILE . 24.3 p -63.11 -20.39 65.32 Favored 'General case' 0 N--CA 1.475 0.797 0 N-CA-C 113.567 0.951 . . . . 0.0 113.567 172.095 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 24.0 mtpp -106.89 -23.36 12.39 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 126.108 1.763 . . . . 0.0 114.474 -176.127 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 65.7 mmtt -66.48 -35.27 79.86 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 125.33 1.452 . . . . 0.0 111.125 170.381 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 14.3 mt -117.65 1.47 12.22 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 126.917 2.087 . . . . 0.0 113.099 -168.621 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 18.6 t30 55.08 61.99 2.7 Favored 'General case' 0 CA--C 1.553 1.066 0 C-N-CA 124.701 1.2 . . . . 0.0 112.296 176.655 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.458 HG13 ' HA ' ' A' ' 61' ' ' SER . 0.6 OUTLIER -137.91 178.08 4.81 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.782 0 C-N-CA 127.304 2.241 . . . . 0.0 111.302 -171.378 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 2.6 p -78.09 157.55 29.47 Favored 'General case' 0 N--CA 1.48 1.045 0 O-C-N 120.98 -1.075 . . . . 0.0 111.447 171.806 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 99.3 t -63.38 -29.67 47.84 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 C-N-CA 123.264 0.626 . . . . 0.0 111.365 173.54 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -78.89 -38.72 36.86 Favored 'General case' 0 N--CA 1.468 0.452 0 O-C-N 120.988 -1.07 . . . . 0.0 110.078 -177.794 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 4.1 tmtm? -66.27 -44.91 82.29 Favored 'General case' 0 C--N 1.339 0.137 0 C-N-CA 124.808 1.243 . . . . 0.0 110.856 176.399 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -59.21 -48.8 80.28 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 124.863 1.265 . . . . 0.0 112.738 171.195 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 36.6 ttmt -69.32 -27.42 65.36 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 124.403 1.081 . . . . 0.0 111.4 -175.225 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -53.01 -43.83 66.82 Favored 'General case' 0 CA--C 1.543 0.705 0 CA-C-N 118.154 0.434 . . . . 0.0 111.459 174.227 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 24.8 m-85 -63.05 -42.0 99.61 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 123.432 0.693 . . . . 0.0 111.458 177.944 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 13.7 mt -66.59 -26.26 37.0 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.651 0 C-N-CA 124.477 1.111 . . . . 0.0 110.996 177.859 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 68.9 mmtt -83.33 -25.63 31.3 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 125.774 1.629 . . . . 0.0 114.711 178.249 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 25.7 p30 . . . . . 0 N--CA 1.475 0.823 0 CA-C-N 120.131 1.332 . . . . 0.0 113.513 -178.521 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 . . . . . 0 N--CA 1.474 0.739 0 N-CA-C 112.976 0.732 . . . . 0.0 112.976 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -134.01 110.29 9.56 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 125.115 1.366 . . . . 0.0 110.354 174.275 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 48.6 t -141.69 127.24 18.32 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 C-N-CA 125.038 1.335 . . . . 0.0 110.229 178.291 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 9.7 t -98.94 83.38 2.9 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 124.792 1.237 . . . . 0.0 111.355 175.997 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 49.2 m 48.87 73.65 0.22 Allowed 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 126.456 1.902 . . . . 0.0 114.569 173.918 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 20.4 mmt 56.35 56.19 5.96 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 125.244 1.417 . . . . 0.0 112.296 -173.066 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 75.0 tt0 -72.42 96.3 1.88 Allowed 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 125.558 1.543 . . . . 0.0 110.284 174.106 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -139.49 159.47 42.1 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 125.309 1.444 . . . . 0.0 112.382 -174.838 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 14.0 mmmm . . . . . 0 N--CA 1.475 0.791 0 C-N-CA 125.65 1.58 . . . . 0.0 110.826 -177.446 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 76.6 mtm . . . . . 0 N--CA 1.47 0.565 0 CA-C-O 120.555 0.217 . . . . 0.0 110.535 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -147.12 136.47 11.64 Favored Pre-proline 0 CA--C 1.552 1.032 0 C-N-CA 124.897 1.279 . . . . 0.0 111.838 -176.596 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -81.49 -7.91 12.66 Favored 'Trans proline' 0 C--N 1.352 0.714 0 C-N-CA 123.388 2.725 . . . . 0.0 115.688 -177.98 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 83.3 mt -102.2 39.21 1.52 Allowed 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.303 1.441 . . . . 0.0 113.276 -173.994 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 12.6 m-20 -101.93 -3.16 28.29 Favored 'General case' 0 N--CA 1.478 0.962 0 N-CA-C 114.705 1.372 . . . . 0.0 114.705 168.335 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.74 -58.61 1.23 Allowed 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 124.297 1.039 . . . . 0.0 113.445 -164.82 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.8 pp -107.33 9.1 9.42 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 C-N-CA 125.495 1.518 . . . . 0.0 112.906 -177.748 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 10.5 tt -52.42 126.44 8.15 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.727 0 C-N-CA 123.825 0.85 . . . . 0.0 112.13 177.151 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -146.93 -1.25 0.68 Allowed 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 124.386 1.075 . . . . 0.0 113.497 -178.279 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -88.63 12.41 14.78 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 114.818 1.414 . . . . 0.0 114.818 -162.297 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 7.1 tp -143.89 21.95 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 125.62 1.568 . . . . 0.0 113.891 -171.337 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 29.4 mtpp . . . . . 0 N--CA 1.479 1.005 0 N-CA-C 115.396 1.628 . . . . 0.0 115.396 -179.974 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 5.2 mt . . . . . 0 CA--C 1.543 0.694 0 N-CA-C 110.397 -0.223 . . . . 0.0 110.397 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 19.8 t -71.77 166.96 20.93 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 122.759 0.424 . . . . 0.0 110.388 167.271 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -57.0 -45.88 82.71 Favored 'General case' 0 N--CA 1.475 0.796 0 O-C-N 120.571 -1.331 . . . . 0.0 112.589 -175.213 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 10.2 tt0 -72.51 -42.42 64.83 Favored 'General case' 0 N--CA 1.469 0.517 0 O-C-N 121.528 -0.732 . . . . 0.0 111.341 177.416 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 34.7 mm-40 -57.03 -43.11 81.57 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 124.082 0.953 . . . . 0.0 111.109 176.782 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 21.8 ttmm -61.65 -43.0 99.68 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.626 1.17 . . . . 0.0 111.288 177.12 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 49.7 mt -67.37 -40.4 84.65 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 CA-C-O 118.197 -0.906 . . . . 0.0 111.097 177.601 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 35.0 mt -65.46 -44.19 94.33 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.956 0 CA-C-N 120.652 1.569 . . . . 0.0 110.721 177.976 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -56.56 -48.35 77.54 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.27 1.028 . . . . 0.0 110.544 174.589 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -66.97 -51.9 49.42 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.454 1.101 . . . . 0.0 112.926 -179.7 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -59.12 -27.26 65.44 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 119.25 0.932 . . . . 0.0 113.118 179.849 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -70.95 -58.74 3.28 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 123.415 0.686 . . . . 0.0 111.26 176.469 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 55.5 mt -59.24 -34.54 54.12 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.61 0 C-N-CA 126.26 1.824 . . . . 0.0 111.314 176.481 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -70.19 -22.44 62.94 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 124.209 1.003 . . . . 0.0 113.256 176.146 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -96.14 -29.91 13.81 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.591 1.157 . . . . 0.0 113.097 178.907 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 7.8 m -121.96 -19.13 4.57 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.002 0 N-CA-C 114.121 1.156 . . . . 0.0 114.121 -175.487 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 82.36 142.06 4.04 Favored Glycine 0 CA--C 1.532 1.146 0 C-N-CA 124.77 1.176 . . . . 0.0 112.199 -171.171 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -65.76 -12.1 51.19 Favored 'General case' 0 N--CA 1.479 0.99 0 O-C-N 121.059 -1.259 . . . . 0.0 113.898 -171.709 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 35.9 mt-30 -77.68 -16.85 58.22 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 126.257 1.823 . . . . 0.0 112.969 174.94 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 67.0 m-80 -114.37 -6.5 12.92 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 114.642 1.349 . . . . 0.0 114.642 -173.058 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 13.8 pt -74.93 159.63 5.45 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.656 0 C-N-CA 124.09 0.956 . . . . 0.0 111.869 170.097 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.4 p -135.16 145.07 47.43 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 125.248 1.419 . . . . 0.0 110.142 175.284 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -60.47 -30.2 69.53 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 124.044 0.938 . . . . 0.0 112.176 179.041 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -61.95 -42.32 94.31 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.513 0 C-N-CA 125.352 1.461 . . . . 0.0 110.264 175.105 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 86.8 m -88.1 -40.84 13.47 Favored 'General case' 0 C--O 1.223 -0.336 0 C-N-CA 125.152 1.381 . . . . 0.0 109.699 -172.351 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 24.7 tp -60.57 -36.97 79.79 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.915 1.286 . . . . 0.0 111.543 170.994 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.501 ' HA ' HG13 ' A' ' 66' ' ' ILE . 40.8 t -53.99 -34.09 58.85 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 124.865 1.266 . . . . 0.0 113.154 168.927 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -97.52 -27.05 14.6 Favored 'General case' 0 C--N 1.329 -0.326 0 C-N-CA 124.578 1.151 . . . . 0.0 113.743 -174.205 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 19.8 mttp -69.36 -33.4 73.02 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 124.219 1.007 . . . . 0.0 112.448 174.374 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 4.5 mp -108.02 -0.85 21.0 Favored 'General case' 0 CA--C 1.541 0.596 0 N-CA-C 114.385 1.254 . . . . 0.0 114.385 -178.641 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 33.8 m-80 54.92 43.91 29.16 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 125.336 1.455 . . . . 0.0 112.587 -173.58 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.501 HG13 ' HA ' ' A' ' 61' ' ' SER . 9.9 pt -103.16 -171.89 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.674 0 C-N-CA 126.218 1.807 . . . . 0.0 111.246 -178.644 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 43.9 p -85.62 159.44 19.85 Favored 'General case' 0 N--CA 1.471 0.625 0 O-C-N 121.473 -0.767 . . . . 0.0 111.057 165.711 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 58.0 t -60.6 -27.31 40.18 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.978 0 O-C-N 121.407 -0.808 . . . . 0.0 111.398 169.943 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 4.9 tm-20 -80.57 -40.78 25.23 Favored 'General case' 0 CA--C 1.531 0.249 0 O-C-N 120.609 -1.307 . . . . 0.0 110.168 -173.86 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . 0.367 0.0 OUTLIER -86.94 7.79 25.94 Favored 'General case' 0 C--N 1.348 0.502 0 N-CA-C 113.175 0.806 . . . . 0.0 113.175 173.589 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -94.61 -45.12 7.52 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.827 1.251 . . . . 0.0 111.557 158.071 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt -74.47 -27.86 60.77 Favored 'General case' 0 CA--C 1.519 -0.234 0 C-N-CA 124.86 1.264 . . . . 0.0 111.84 -172.927 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 31.2 p-10 -56.21 -37.85 70.21 Favored 'General case' 0 CA--C 1.545 0.765 0 N-CA-C 112.906 0.706 . . . . 0.0 112.906 175.813 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 28.7 m-85 -65.86 -48.97 69.79 Favored 'General case' 0 C--O 1.222 -0.372 0 C-N-CA 126.791 2.036 . . . . 0.0 109.889 176.449 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 76.7 mt -64.2 -38.72 83.23 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 C-N-CA 123.859 0.864 . . . . 0.0 110.374 -179.619 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 28.4 mmtm -63.41 -31.41 72.55 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 125.668 1.587 . . . . 0.0 113.448 177.509 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 8.9 p30 . . . . . 0 CA--C 1.539 0.553 0 CA-C-N 119.817 1.19 . . . . 0.0 112.463 174.98 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 . . . . . 0 N--CA 1.48 1.026 0 N-CA-C 113.722 1.008 . . . . 0.0 113.722 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -103.51 53.05 0.76 Allowed 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 125.648 1.579 . . . . 0.0 113.084 -169.19 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 59.5 t -139.1 140.72 37.72 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 C-N-CA 125.502 1.521 . . . . 0.0 110.491 -179.825 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 21.9 t -130.41 -62.8 0.91 Allowed 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 124.461 1.104 . . . . 0.0 113.157 178.185 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 75.0 m -138.7 102.28 4.54 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 124.5 1.12 . . . . 0.0 111.429 -176.764 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 69.4 mtm 51.37 31.06 6.7 Favored 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 125.869 1.668 . . . . 0.0 113.933 -177.457 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -96.69 -2.29 44.84 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.242 1.417 . . . . 0.0 113.244 -168.093 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -75.27 160.12 30.72 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.246 1.419 . . . . 0.0 112.893 178.758 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 44.7 mmtm . . . . . 0 N--CA 1.475 0.805 0 C-N-CA 125.171 1.388 . . . . 0.0 110.431 173.314 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 62.7 mtt . . . . . 0 N--CA 1.473 0.676 0 N-CA-C 110.111 -0.329 . . . . 0.0 110.111 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -132.91 57.4 27.92 Favored Pre-proline 0 CA--C 1.555 1.169 0 C-N-CA 124.54 1.136 . . . . 0.0 113.432 -174.909 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_endo -78.12 -4.92 14.78 Favored 'Trans proline' 0 C--N 1.353 0.803 0 C-N-CA 123.391 2.727 . . . . 0.0 115.285 -176.105 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -132.77 35.68 3.56 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.839 1.656 . . . . 0.0 114.018 -175.022 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -104.6 -1.21 26.76 Favored 'General case' 0 N--CA 1.478 0.945 0 N-CA-C 114.547 1.314 . . . . 0.0 114.547 176.302 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -130.07 -58.56 1.07 Allowed 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 124.369 1.068 . . . . 0.0 113.515 -164.124 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.8 pp -107.77 10.2 9.17 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.786 0 C-N-CA 125.631 1.572 . . . . 0.0 113.033 -178.07 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 17.7 tt -47.97 125.5 2.32 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 C-N-CA 124.775 1.23 . . . . 0.0 113.18 179.507 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 21.3 t30 -147.43 0.34 0.68 Allowed 'General case' 0 CA--C 1.543 0.693 0 N-CA-C 114.511 1.3 . . . . 0.0 114.511 -179.788 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -85.31 10.85 11.43 Favored 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 115.02 1.489 . . . . 0.0 115.02 -167.792 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 16.0 tt -144.19 34.59 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 C-N-CA 126.543 1.937 . . . . 0.0 112.049 -177.612 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 33.3 ttmt . . . . . 0 N--CA 1.471 0.578 0 N-CA-C 114.522 1.304 . . . . 0.0 114.522 -173.817 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 5.9 mt . . . . . 0 CA--C 1.542 0.643 0 CA-C-O 120.725 0.298 . . . . 0.0 111.607 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 22.7 t -72.16 166.28 22.67 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 123.31 0.644 . . . . 0.0 110.545 167.074 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -55.57 -43.71 76.19 Favored 'General case' 0 N--CA 1.476 0.831 0 O-C-N 120.83 -1.169 . . . . 0.0 112.495 -177.809 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 13.1 tt0 -73.49 -41.76 62.71 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 123.561 0.744 . . . . 0.0 111.315 176.22 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 84.4 mt-30 -63.07 -38.35 90.84 Favored 'General case' 0 N--CA 1.466 0.335 0 O-C-N 121.698 -0.626 . . . . 0.0 111.94 179.58 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 20.9 ttmm -59.3 -42.19 90.74 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 123.975 0.91 . . . . 0.0 110.748 174.171 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 46.2 mt -69.61 -42.12 80.45 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 CA-C-O 118.036 -0.983 . . . . 0.0 111.361 178.129 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 40.4 mt -64.47 -43.84 96.95 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 CA-C-N 120.644 1.565 . . . . 0.0 110.174 177.997 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -57.98 -47.51 82.76 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.886 1.275 . . . . 0.0 110.336 177.281 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -67.22 -52.19 44.14 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.645 1.178 . . . . 0.0 113.429 177.574 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.7 mm-40 -61.18 -26.42 67.7 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-N 119.1 0.864 . . . . 0.0 113.101 -177.947 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.476 ' CE2' HG22 ' A' ' 55' ' ' ILE . 1.6 t80 -71.93 -55.71 6.99 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 123.981 0.912 . . . . 0.0 111.21 175.492 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 55.8 mt -58.5 -35.82 56.31 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.589 0 C-N-CA 125.387 1.475 . . . . 0.0 111.168 174.436 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -68.02 -20.78 65.03 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 124.104 0.962 . . . . 0.0 113.326 177.078 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -96.33 -28.15 14.62 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.812 1.245 . . . . 0.0 113.231 178.437 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 9.2 m -126.36 -21.61 2.16 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 N-CA-C 114.376 1.25 . . . . 0.0 114.376 -174.038 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 88.84 141.69 8.17 Favored Glycine 0 CA--C 1.534 1.242 0 C-N-CA 125.633 1.587 . . . . 0.0 112.788 -172.205 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 62.5 tp -60.74 -16.58 41.45 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 125.497 1.519 . . . . 0.0 114.561 -175.395 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -82.83 -18.68 39.56 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.763 1.625 . . . . 0.0 113.079 177.095 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 63.6 m-20 -114.58 -7.69 12.77 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 114.651 1.352 . . . . 0.0 114.651 -170.066 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' ILE . . . . . 0.476 HG22 ' CE2' ' A' ' 46' ' ' TYR . 26.6 pt -67.32 158.52 5.41 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.42 0 C-N-CA 123.675 0.79 . . . . 0.0 111.265 167.099 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -126.01 146.22 49.98 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 125.086 1.354 . . . . 0.0 111.444 174.916 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -61.68 -27.46 68.7 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.025 0.93 . . . . 0.0 111.975 172.927 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 29.9 mm -63.85 -52.58 55.09 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.444 0 C-N-CA 124.797 1.239 . . . . 0.0 110.567 174.556 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 54.1 m -75.18 -39.33 60.32 Favored 'General case' 0 C--O 1.223 -0.334 0 C-N-CA 123.264 0.625 . . . . 0.0 110.088 -177.749 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 18.1 tp -63.18 -37.04 85.66 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.437 1.095 . . . . 0.0 111.854 175.402 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.444 ' HA ' HG13 ' A' ' 66' ' ' ILE . 44.1 t -53.87 -32.57 53.64 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.951 1.3 . . . . 0.0 112.25 169.411 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -96.98 -31.89 12.3 Favored 'General case' 0 CA--C 1.534 0.351 0 N-CA-C 113.881 1.067 . . . . 0.0 113.881 -176.015 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 47.6 mmtt -60.17 -39.54 86.79 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 125.703 1.601 . . . . 0.0 111.839 178.407 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.3 mp -114.07 15.7 18.3 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 124.753 1.221 . . . . 0.0 113.631 -177.374 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . 0.278 7.5 p30 46.56 55.5 7.52 Favored 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 126.536 1.934 . . . . 0.0 114.037 -177.706 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.444 HG13 ' HA ' ' A' ' 61' ' ' SER . 1.8 pt -119.4 -165.5 0.37 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.761 0 C-N-CA 127.156 2.182 . . . . 0.0 110.958 -174.249 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 5.7 p -98.64 160.38 14.31 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 124.661 1.184 . . . . 0.0 110.901 171.583 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 71.4 t -62.72 -29.66 47.53 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 C-N-CA 123.085 0.554 . . . . 0.0 110.952 173.68 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 58.4 mp0 -77.28 -39.91 46.41 Favored 'General case' 0 CA--C 1.53 0.195 0 O-C-N 121.017 -1.052 . . . . 0.0 109.928 -178.685 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 10.8 tmtt? -66.92 -44.38 80.83 Favored 'General case' 0 C--N 1.341 0.236 0 C-N-CA 124.952 1.301 . . . . 0.0 110.941 178.866 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -58.98 -50.24 74.84 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 126.064 1.746 . . . . 0.0 113.357 170.204 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 21.2 ttmm -69.01 -25.33 64.44 Favored 'General case' 0 N--CA 1.468 0.46 0 O-C-N 120.839 -1.163 . . . . 0.0 111.327 -177.333 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -59.04 -31.7 69.08 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 123.529 0.731 . . . . 0.0 112.608 174.065 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 58.6 m-85 -69.78 -50.21 45.42 Favored 'General case' 0 C--O 1.221 -0.438 0 C-N-CA 124.527 1.131 . . . . 0.0 110.538 170.199 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 84.5 mt -64.15 -25.24 37.61 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.839 0 C-N-CA 124.201 1.0 . . . . 0.0 111.73 -175.589 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 69.0 mmtt -81.54 -25.36 35.94 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 125.461 1.504 . . . . 0.0 114.408 177.741 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 8.6 p30 . . . . . 0 N--CA 1.47 0.55 0 CA-C-N 119.994 1.27 . . . . 0.0 111.958 170.136 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 . . . . . 0 N--CA 1.477 0.893 0 CA-C-O 121.611 0.72 . . . . 0.0 111.852 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -145.91 115.96 7.39 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.463 1.105 . . . . 0.0 110.888 179.449 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 59.9 t -141.12 132.02 27.47 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 C-N-CA 125.199 1.4 . . . . 0.0 110.55 179.027 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 55.1 m -96.77 -50.39 4.69 Favored 'General case' 0 N--CA 1.48 1.06 0 N-CA-C 113.463 0.912 . . . . 0.0 113.463 179.732 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 35.8 t -159.73 -50.38 0.05 Allowed 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 124.708 1.203 . . . . 0.0 112.332 179.982 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 6.0 tpt -121.09 15.74 11.55 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 125.165 1.386 . . . . 0.0 113.068 -174.3 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -83.31 48.75 1.44 Allowed 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 124.867 1.267 . . . . 0.0 112.4 -174.254 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -142.41 155.02 45.08 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.737 1.615 . . . . 0.0 112.268 -175.813 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 4.7 mmpt? . . . . . 0 N--CA 1.474 0.77 0 C-N-CA 124.542 1.137 . . . . 0.0 111.934 178.911 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.7 mpt? . . . . . 0 N--CA 1.469 0.484 0 N-CA-C 110.068 -0.345 . . . . 0.0 110.068 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 44.1 m-20 43.9 63.27 8.42 Favored Pre-proline 0 CA--C 1.555 1.162 0 C-N-CA 126.5 1.92 . . . . 0.0 114.778 176.798 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_endo -72.6 -1.78 10.82 Favored 'Trans proline' 0 C--N 1.351 0.664 0 C-N-CA 123.762 2.975 . . . . 0.0 115.266 -175.714 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 88.7 mt -106.82 38.94 1.96 Allowed 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.902 1.681 . . . . 0.0 112.671 -178.983 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -110.53 1.48 18.19 Favored 'General case' 0 N--CA 1.478 0.959 0 N-CA-C 114.574 1.324 . . . . 0.0 114.574 178.589 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.23 -56.74 1.89 Allowed 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 124.632 1.173 . . . . 0.0 113.269 -165.851 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.0 pp -129.13 13.86 2.66 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.862 0 C-N-CA 126.163 1.785 . . . . 0.0 112.9 -173.523 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 10.7 tt -41.77 126.44 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.02 0 C-N-CA 125.423 1.489 . . . . 0.0 113.402 179.322 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -145.0 16.84 1.57 Allowed 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.816 1.247 . . . . 0.0 112.942 179.981 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -82.95 11.21 6.42 Favored 'General case' 0 CA--C 1.545 0.771 0 N-CA-C 114.534 1.309 . . . . 0.0 114.534 -171.737 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 14.0 tt -141.46 24.38 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 126.473 1.909 . . . . 0.0 113.145 -176.503 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 88.9 tttt . . . . . 0 N--CA 1.473 0.686 0 C-N-CA 124.285 1.034 . . . . 0.0 113.567 179.043 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.5 mt . . . . . 0 CA--C 1.544 0.741 0 N-CA-C 110.497 -0.186 . . . . 0.0 110.497 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 19.0 t -72.1 168.33 18.37 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.088 0.555 . . . . 0.0 110.406 167.298 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -58.65 -45.62 88.92 Favored 'General case' 0 N--CA 1.473 0.695 0 O-C-N 120.25 -1.531 . . . . 0.0 112.607 -174.577 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 9.9 tt0 -71.78 -41.87 67.82 Favored 'General case' 0 N--CA 1.47 0.558 0 O-C-N 121.195 -0.941 . . . . 0.0 111.367 177.344 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 30.6 mm-40 -57.04 -45.32 83.27 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 123.959 0.903 . . . . 0.0 110.72 175.873 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt -60.75 -41.56 95.65 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 124.726 1.21 . . . . 0.0 111.3 178.277 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 51.5 mt -67.54 -41.85 86.26 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 CA-C-O 117.937 -1.03 . . . . 0.0 111.447 177.177 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 36.5 mt -63.8 -44.42 98.21 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 CA-C-N 120.832 1.651 . . . . 0.0 110.072 177.969 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -59.42 -49.21 78.69 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.711 1.204 . . . . 0.0 111.024 177.745 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -64.36 -52.18 59.64 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 124.982 1.313 . . . . 0.0 112.456 177.674 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -60.75 -27.44 67.95 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-N 119.362 0.983 . . . . 0.0 113.027 -179.572 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -69.05 -58.34 4.23 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 123.433 0.693 . . . . 0.0 110.784 174.962 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 90.8 mt -63.71 -32.68 57.85 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.471 0 C-N-CA 127.016 2.126 . . . . 0.0 111.641 179.572 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -71.48 -25.54 62.31 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.111 0.965 . . . . 0.0 112.713 175.93 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -90.64 -37.75 13.56 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.188 0.995 . . . . 0.0 112.622 176.233 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.5 m -109.98 -3.41 10.5 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.215 0 N-CA-C 114.371 1.249 . . . . 0.0 114.371 -175.039 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 88.03 10.14 69.6 Favored Glycine 0 N--CA 1.472 1.081 0 C-N-CA 126.096 1.808 . . . . 0.0 116.133 160.974 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 64.36 4.06 2.05 Favored 'General case' 0 CA--C 1.554 1.116 0 C-N-CA 127.756 2.422 . . . . 0.0 114.677 -164.53 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -85.98 -26.12 25.64 Favored 'General case' 0 N--CA 1.48 1.028 0 O-C-N 120.626 -1.296 . . . . 0.0 113.304 179.631 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 45.6 m-80 -122.63 2.95 9.58 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 113.976 1.102 . . . . 0.0 113.976 -164.85 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 20.5 pt -75.05 155.65 6.26 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.551 0 C-N-CA 123.024 0.53 . . . . 0.0 111.352 174.685 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -139.03 142.18 38.26 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 124.765 1.226 . . . . 0.0 109.304 177.486 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -61.11 -26.51 67.72 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 119.088 0.858 . . . . 0.0 112.439 -179.166 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.9 mp -64.76 -50.88 73.33 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.472 0 C-N-CA 125.555 1.542 . . . . 0.0 109.831 173.778 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 81.1 m -76.3 -41.02 50.0 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 123.849 0.86 . . . . 0.0 110.764 -176.566 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 16.3 tp -61.85 -38.46 88.29 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 125.619 1.568 . . . . 0.0 111.766 174.189 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.466 ' HA ' HG13 ' A' ' 66' ' ' ILE . 39.8 t -56.95 -28.72 62.47 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 124.921 1.288 . . . . 0.0 112.794 170.298 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -100.56 -29.07 12.55 Favored 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 124.789 1.236 . . . . 0.0 114.25 -176.196 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 9.1 mmtm -63.28 -33.61 75.89 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 125.197 1.399 . . . . 0.0 111.715 175.102 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.4 mp -114.43 4.12 15.2 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 125.472 1.509 . . . . 0.0 114.039 -176.584 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 49.2 m-80 53.51 56.66 7.02 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 126.01 1.724 . . . . 0.0 113.366 -179.232 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.466 HG13 ' HA ' ' A' ' 61' ' ' SER . 1.2 pt -125.2 -166.67 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.764 0 C-N-CA 126.885 2.074 . . . . 0.0 110.974 -171.829 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 62.2 p -94.15 155.66 16.96 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 124.514 1.126 . . . . 0.0 111.251 169.915 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 60.6 t -63.93 -24.77 36.58 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 O-C-N 121.628 -0.67 . . . . 0.0 111.086 171.865 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 15.6 mp0 -79.72 -30.33 40.93 Favored 'General case' 0 C--O 1.233 0.209 0 C-N-CA 125.148 1.379 . . . . 0.0 111.124 -174.695 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.16 -32.81 16.48 Favored 'General case' 0 C--N 1.344 0.368 0 CA-C-N 118.156 0.435 . . . . 0.0 111.738 173.978 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -62.14 -46.77 87.5 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 124.239 1.015 . . . . 0.0 111.9 173.149 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 19.9 ptmt -69.0 -24.77 64.26 Favored 'General case' 0 N--CA 1.468 0.449 0 O-C-N 121.296 -0.877 . . . . 0.0 112.121 -176.766 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -60.93 -39.76 90.67 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 120.342 -0.543 . . . . 0.0 110.445 179.247 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 26.4 m-85 -61.48 -38.88 88.88 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 124.609 1.164 . . . . 0.0 112.301 179.752 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 7.3 mt -73.4 -18.11 17.83 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.847 0 C-N-CA 125.852 1.661 . . . . 0.0 111.941 -178.951 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 61.8 tttt -103.52 -33.93 8.86 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 125.678 1.591 . . . . 0.0 110.776 -177.599 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 81.6 m-20 . . . . . 0 CA--C 1.531 0.228 0 C-N-CA 126.72 2.008 . . . . 0.0 109.838 175.799 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 . . . . . 0 CA--C 1.545 0.787 0 CA-C-O 120.964 0.411 . . . . 0.0 111.872 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -145.87 139.86 26.61 Favored 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 125.323 1.449 . . . . 0.0 111.355 175.068 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 95.9 t -138.15 135.13 44.85 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 C-N-CA 126.133 1.773 . . . . 0.0 110.306 179.453 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 19.2 t -154.73 -42.96 0.09 Allowed 'General case' 0 N--CA 1.47 0.529 0 N-CA-C 113.841 1.052 . . . . 0.0 113.841 177.513 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 23.1 p -151.3 117.29 5.54 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-O 122.181 0.991 . . . . 0.0 113.418 -176.187 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 57.9 mtt 54.74 40.97 32.22 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 126.061 1.745 . . . . 0.0 112.983 173.713 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -84.0 3.42 34.45 Favored 'General case' 0 CA--C 1.547 0.828 0 N-CA-C 115.298 1.592 . . . . 0.0 115.298 -163.162 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -133.47 155.37 49.66 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 125.587 1.555 . . . . 0.0 113.167 -174.562 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 33.5 mmtp . . . . . 0 N--CA 1.483 1.178 0 C-N-CA 126.451 1.9 . . . . 0.0 113.515 -176.898 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 58.5 ttm . . . . . 0 CA--C 1.537 0.481 0 CA-C-O 120.667 0.27 . . . . 0.0 110.66 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 25.4 m-20 -127.16 97.62 31.57 Favored Pre-proline 0 CA--C 1.547 0.839 0 C-N-CA 124.922 1.289 . . . . 0.0 111.008 176.217 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 64.8 Cg_endo -83.03 6.87 5.54 Favored 'Trans proline' 0 CA--C 1.539 0.756 0 C-N-CA 123.79 2.993 . . . . 0.0 114.219 179.325 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 92.2 mt -115.55 29.72 7.82 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 125.368 1.467 . . . . 0.0 113.716 -172.734 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -98.02 -1.1 43.36 Favored 'General case' 0 N--CA 1.479 1.024 0 N-CA-C 114.087 1.144 . . . . 0.0 114.087 170.897 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 13.7 ptmt -103.86 -35.38 8.19 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 125.78 1.632 . . . . 0.0 114.78 -171.004 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.3 pp -144.44 -42.12 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.008 0 C-N-CA 125.845 1.658 . . . . 0.0 113.643 -174.324 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . 0.31 10.6 tt 38.27 35.29 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.437 0 N-CA-C 116.283 1.957 . . . . 0.0 116.283 -177.52 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 3.2 t30 55.91 29.07 13.52 Favored 'General case' 0 CA--C 1.552 1.023 0 C-N-CA 125.688 1.595 . . . . 0.0 114.279 -177.744 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 3.2 p-10 -81.2 9.61 6.65 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 116.781 2.141 . . . . 0.0 116.781 -166.11 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 7.1 tp -141.76 18.86 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.835 0 C-N-CA 125.779 1.632 . . . . 0.0 113.733 -175.704 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 13.9 tmtt? . . . . . 0 N--CA 1.475 0.781 0 N-CA-C 115.15 1.537 . . . . 0.0 115.15 -175.753 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 34.5 mt . . . . . 0 CA--C 1.541 0.618 0 CA-C-O 120.73 0.3 . . . . 0.0 111.147 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 29.7 t -69.68 163.28 25.97 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 123.138 0.575 . . . . 0.0 110.735 168.459 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 7.1 tm-20 -53.86 -42.78 68.92 Favored 'General case' 0 N--CA 1.474 0.741 0 O-C-N 120.874 -1.141 . . . . 0.0 112.82 -179.268 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 7.9 pt20 -78.23 -34.62 49.11 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 112.359 0.503 . . . . 0.0 112.359 175.958 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 91.0 mt-30 -68.12 -37.17 80.83 Favored 'General case' 0 CA--C 1.535 0.37 0 O-C-N 121.501 -0.75 . . . . 0.0 111.578 179.517 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 40.1 ttmt -59.3 -39.52 83.28 Favored 'General case' 0 N--CA 1.47 0.568 0 O-C-N 121.272 -0.893 . . . . 0.0 111.209 172.961 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 45.2 mt -72.77 -40.64 61.33 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 CA-C-O 118.262 -0.875 . . . . 0.0 111.296 176.841 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 39.2 mt -64.4 -42.06 94.18 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 CA-C-N 120.644 1.565 . . . . 0.0 110.526 177.8 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -56.38 -52.74 63.5 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 124.336 1.054 . . . . 0.0 109.952 173.903 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -64.64 -50.68 66.13 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 123.687 0.795 . . . . 0.0 113.003 -178.816 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 18.7 mm-40 -62.35 -22.07 65.81 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 113.525 0.935 . . . . 0.0 113.525 -178.423 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.415 ' CE1' HG22 ' A' ' 55' ' ' ILE . 1.7 t80 -71.55 -60.68 2.1 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 119.038 0.836 . . . . 0.0 110.742 173.376 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 16.2 mt -63.42 -32.45 56.63 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.496 0 C-N-CA 125.939 1.695 . . . . 0.0 111.688 179.847 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -70.26 -21.56 62.96 Favored 'General case' 0 CA--C 1.545 0.754 0 O-C-N 121.255 -0.903 . . . . 0.0 113.066 175.655 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -94.19 -34.77 12.78 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.358 1.063 . . . . 0.0 112.654 177.751 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 11.7 m -116.7 -18.77 6.79 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.066 0 N-CA-C 114.121 1.156 . . . . 0.0 114.121 -174.411 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 80.62 141.05 2.74 Favored Glycine 0 CA--C 1.53 1.001 0 C-N-CA 124.58 1.086 . . . . 0.0 111.649 -171.501 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.0 tt -64.05 -19.02 64.92 Favored 'General case' 0 N--CA 1.473 0.725 0 O-C-N 121.154 -1.203 . . . . 0.0 114.015 -169.029 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 36.8 mt-30 -66.18 -17.1 64.52 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 126.1 1.76 . . . . 0.0 113.324 174.9 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 69.3 m-80 -112.86 -5.93 13.83 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 114.703 1.372 . . . . 0.0 114.703 -174.145 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' ILE . . . . . 0.415 HG22 ' CE1' ' A' ' 46' ' ' TYR . 3.7 pt -79.72 162.8 3.72 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 C-N-CA 123.55 0.74 . . . . 0.0 112.48 173.117 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -130.83 147.06 52.44 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 124.931 1.292 . . . . 0.0 109.974 171.895 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -63.76 -25.04 68.01 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 121.429 -0.794 . . . . 0.0 112.029 174.387 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -66.42 -46.98 85.36 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.481 0 C-N-CA 125.455 1.502 . . . . 0.0 109.667 173.423 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 89.7 m -74.22 -43.53 56.75 Favored 'General case' 0 C--O 1.224 -0.27 0 C-N-CA 123.344 0.658 . . . . 0.0 110.151 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 18.7 tp -61.96 -36.04 80.24 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 124.491 1.117 . . . . 0.0 111.864 176.046 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.49 ' HA ' HG13 ' A' ' 66' ' ' ILE . 44.9 t -53.01 -33.25 50.84 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.621 1.168 . . . . 0.0 113.146 168.292 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -100.47 -22.65 14.95 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 125.087 1.355 . . . . 0.0 114.518 -175.584 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 63.9 mmtt -65.19 -38.25 89.91 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 124.709 1.204 . . . . 0.0 111.153 173.967 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.4 mp -111.62 -0.16 16.19 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 125.073 1.349 . . . . 0.0 114.335 -173.028 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 16.0 m-80 56.89 45.41 21.47 Favored 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 125.743 1.617 . . . . 0.0 112.615 -172.875 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.49 HG13 ' HA ' ' A' ' 61' ' ' SER . 10.5 pt -104.46 -166.83 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 C-N-CA 125.821 1.648 . . . . 0.0 111.227 -179.47 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 44.5 p -94.74 161.19 14.28 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 123.998 0.919 . . . . 0.0 110.889 166.767 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 82.5 t -61.85 -28.28 43.95 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 O-C-N 121.341 -0.849 . . . . 0.0 111.054 170.995 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -77.31 -40.21 45.11 Favored 'General case' 0 C--O 1.233 0.214 0 O-C-N 120.68 -1.262 . . . . 0.0 110.453 -175.913 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . 0.366 0.0 OUTLIER -91.59 8.37 37.0 Favored 'General case' 0 C--N 1.348 0.508 0 N-CA-C 113.722 1.008 . . . . 0.0 113.722 175.917 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -95.52 -44.37 7.55 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.467 1.507 . . . . 0.0 111.635 159.799 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 23.9 ttmm -74.15 -29.62 61.88 Favored 'General case' 0 CA--C 1.517 -0.29 0 C-N-CA 124.896 1.278 . . . . 0.0 111.465 -174.475 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 51.9 p-10 -55.53 -42.67 74.88 Favored 'General case' 0 CA--C 1.544 0.735 0 CA-C-O 118.631 -0.7 . . . . 0.0 111.905 176.649 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 20.9 m-85 -59.08 -44.01 91.86 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 125.718 1.607 . . . . 0.0 112.376 175.811 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 69.2 mt -68.44 -25.11 30.42 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.795 0 C-N-CA 124.984 1.314 . . . . 0.0 110.041 179.647 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 73.4 mmtt -93.56 -25.32 17.61 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 115.888 1.81 . . . . 0.0 115.888 -179.846 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 8.4 p30 . . . . . 0 N--CA 1.472 0.666 0 CA-C-N 120.682 1.583 . . . . 0.0 113.103 175.949 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 26.1 tt0 . . . . . 0 CA--C 1.546 0.821 0 N-CA-C 113.027 0.751 . . . . 0.0 113.027 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -106.54 98.06 7.78 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 125.071 1.349 . . . . 0.0 111.751 -174.275 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 8.7 m -135.0 31.81 0.79 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.649 0 C-N-CA 125.939 1.696 . . . . 0.0 113.365 -170.995 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 72.2 m -131.4 -62.19 0.89 Allowed 'General case' 0 N--CA 1.475 0.824 0 N-CA-C 113.524 0.935 . . . . 0.0 113.524 -163.07 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 55.7 p -78.87 -23.74 44.7 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 124.043 0.937 . . . . 0.0 112.963 175.27 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 77.1 mtm -134.69 140.49 46.02 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 126.817 2.047 . . . . 0.0 109.162 169.28 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 6.1 tt0 -145.46 24.31 1.41 Allowed 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 123.865 0.866 . . . . 0.0 112.642 -179.387 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -65.22 127.29 31.11 Favored 'General case' 0 CA--C 1.542 0.65 0 O-C-N 120.701 -1.25 . . . . 0.0 112.55 -173.941 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 47.5 mtmt . . . . . 0 N--CA 1.475 0.809 0 C-N-CA 126.491 1.916 . . . . 0.0 110.778 -177.701 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.4 ttp . . . . . 0 CA--C 1.549 0.909 0 N-CA-C 113.646 0.98 . . . . 0.0 113.646 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 20.6 m-20 -133.45 79.03 61.36 Favored Pre-proline 0 CA--C 1.549 0.916 0 C-N-CA 124.744 1.217 . . . . 0.0 112.227 -169.472 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo -80.95 -3.08 12.14 Favored 'Trans proline' 0 C--N 1.351 0.682 0 C-N-CA 123.88 3.053 . . . . 0.0 115.081 -177.74 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 97.7 mt -112.84 44.46 1.49 Allowed 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 125.938 1.695 . . . . 0.0 112.256 -175.312 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -116.28 1.75 13.14 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 125.08 1.352 . . . . 0.0 114.506 177.831 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.74 -56.0 2.23 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 124.627 1.171 . . . . 0.0 112.899 -167.458 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.0 pp -130.93 14.09 1.99 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 126.236 1.815 . . . . 0.0 112.82 -174.657 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 8.6 tt -43.82 123.46 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 C-N-CA 124.921 1.288 . . . . 0.0 112.537 178.693 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -146.69 10.15 1.05 Allowed 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 124.399 1.08 . . . . 0.0 113.401 179.82 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -81.41 6.39 14.66 Favored 'General case' 0 CA--C 1.546 0.794 0 N-CA-C 114.939 1.459 . . . . 0.0 114.939 -167.626 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 7.0 tp -146.1 23.05 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 C-N-CA 125.916 1.686 . . . . 0.0 113.609 -173.825 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 40.7 ttmt . . . . . 0 N--CA 1.473 0.723 0 N-CA-C 114.081 1.141 . . . . 0.0 114.081 178.802 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.8 mt . . . . . 0 CA--C 1.544 0.726 0 N-CA-C 110.055 -0.35 . . . . 0.0 110.055 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 30.1 t -68.81 163.55 23.93 Favored 'General case' 0 N--CA 1.477 0.911 0 O-C-N 121.81 -0.557 . . . . 0.0 110.636 166.882 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -57.93 -42.0 83.91 Favored 'General case' 0 N--CA 1.477 0.884 0 O-C-N 120.335 -1.478 . . . . 0.0 112.875 -176.595 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 6.9 pt20 -74.96 -35.79 62.09 Favored 'General case' 0 N--CA 1.47 0.544 0 O-C-N 121.71 -0.619 . . . . 0.0 112.323 173.9 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 93.4 mt-30 -66.07 -38.22 87.77 Favored 'General case' 0 CA--C 1.532 0.276 0 O-C-N 121.563 -0.711 . . . . 0.0 111.261 178.823 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 40.7 ttmt -58.83 -41.13 86.15 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 124.228 1.011 . . . . 0.0 111.066 174.941 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 39.4 mt -71.65 -42.44 71.32 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 CA-C-O 118.441 -0.79 . . . . 0.0 110.993 178.106 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 40.1 mt -63.65 -43.04 97.99 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.988 0 CA-C-N 120.282 1.401 . . . . 0.0 110.19 177.851 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -57.4 -51.39 69.6 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 125.043 1.337 . . . . 0.0 110.129 176.097 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -65.14 -46.66 80.03 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.367 1.067 . . . . 0.0 113.508 179.685 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 17.7 mm-40 -67.35 -25.22 65.88 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 123.931 0.892 . . . . 0.0 112.96 179.8 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.435 ' CE1' HG22 ' A' ' 55' ' ' ILE . 1.9 t80 -72.35 -51.51 20.28 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 118.811 0.732 . . . . 0.0 110.589 175.642 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 42.6 mt -61.51 -32.51 53.67 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.596 0 C-N-CA 124.789 1.236 . . . . 0.0 111.229 173.591 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -66.3 -24.08 66.49 Favored 'General case' 0 CA--C 1.546 0.802 0 O-C-N 121.091 -1.005 . . . . 0.0 113.288 173.953 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -92.43 -31.48 15.28 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.543 1.137 . . . . 0.0 112.828 179.4 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 6.4 m -127.57 -22.39 1.73 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.94 0 N-CA-C 114.209 1.189 . . . . 0.0 114.209 -172.137 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 88.67 148.16 16.39 Favored Glycine 0 CA--C 1.533 1.206 0 C-N-CA 125.422 1.486 . . . . 0.0 113.458 -172.455 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -57.23 -25.63 59.44 Favored 'General case' 0 N--CA 1.481 1.08 0 CA-C-O 123.569 1.652 . . . . 0.0 112.544 -176.833 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 7.2 pt20 -81.16 -13.32 58.75 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 126.738 2.015 . . . . 0.0 114.622 -179.7 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 76.0 m-20 -118.07 -11.93 10.12 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 114.759 1.392 . . . . 0.0 114.759 -177.894 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' ILE . . . . . 0.435 HG22 ' CE1' ' A' ' 46' ' ' TYR . 46.0 pt -64.21 152.61 8.21 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 CA-C-O 120.899 0.38 . . . . 0.0 110.678 163.418 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -130.15 143.53 50.84 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 124.452 1.101 . . . . 0.0 109.991 178.363 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -62.17 -24.77 67.38 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 118.931 0.787 . . . . 0.0 112.49 -179.65 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.9 mp -70.29 -42.11 78.73 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 C-N-CA 125.868 1.667 . . . . 0.0 110.747 174.629 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 88.8 m -79.09 -42.87 25.31 Favored 'General case' 0 C--N 1.33 -0.276 0 O-C-N 121.675 -0.64 . . . . 0.0 109.62 -179.411 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 17.3 tp -64.86 -35.97 82.83 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 125.701 1.6 . . . . 0.0 112.329 177.022 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.466 ' HA ' HG13 ' A' ' 66' ' ' ILE . 60.5 p -58.29 -26.47 63.05 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 118.995 0.816 . . . . 0.0 112.397 170.982 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -99.49 -30.1 12.35 Favored 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 124.794 1.238 . . . . 0.0 114.22 -178.913 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 11.1 mmtm -63.19 -34.44 77.63 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 125.077 1.351 . . . . 0.0 112.196 177.586 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.1 mp -118.06 8.78 12.53 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 124.981 1.312 . . . . 0.0 113.998 -177.585 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 14.2 t30 55.38 61.82 2.72 Favored 'General case' 0 CA--C 1.552 1.044 0 C-N-CA 125.091 1.357 . . . . 0.0 111.854 177.165 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.466 HG13 ' HA ' ' A' ' 61' ' ' SER . 1.6 pt -136.5 175.87 9.31 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 C-N-CA 126.428 1.891 . . . . 0.0 111.476 -171.148 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 32.4 p -74.99 160.27 30.76 Favored 'General case' 0 N--CA 1.472 0.639 0 O-C-N 120.964 -1.085 . . . . 0.0 111.073 171.987 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 90.6 t -66.61 -26.39 37.27 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.02 0 O-C-N 121.364 -0.835 . . . . 0.0 110.987 169.938 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -77.53 -30.79 52.98 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 124.822 1.249 . . . . 0.0 111.204 -176.916 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . 0.352 0.0 OUTLIER -102.49 18.01 22.23 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 125.254 1.422 . . . . 0.0 113.395 171.254 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -104.05 -43.82 5.17 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.134 1.374 . . . . 0.0 111.616 158.029 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 9.2 ptmm? -73.61 -24.66 60.08 Favored 'General case' 0 N--CA 1.472 0.629 0 O-C-N 120.877 -1.14 . . . . 0.0 112.478 -176.202 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 28.3 p-10 -54.15 -39.63 66.69 Favored 'General case' 0 CA--C 1.545 0.755 0 N-CA-C 113.246 0.832 . . . . 0.0 113.246 173.444 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 28.2 m-85 -69.68 -47.23 63.97 Favored 'General case' 0 C--O 1.226 -0.164 0 C-N-CA 126.902 2.081 . . . . 0.0 110.167 179.314 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 67.7 mt -65.25 -42.76 94.74 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.497 0 C-N-CA 123.974 0.91 . . . . 0.0 109.821 -179.355 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 2.7 tppp? -70.03 -31.54 69.24 Favored 'General case' 0 N--CA 1.467 0.419 0 O-C-N 120.809 -1.182 . . . . 0.0 112.533 -176.17 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 3.6 p30 . . . . . 0 CA--C 1.535 0.367 0 CA-C-N 119.202 0.91 . . . . 0.0 112.032 175.443 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 . . . . . 0 N--CA 1.473 0.711 0 CA-C-O 121.092 0.472 . . . . 0.0 111.393 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -135.52 122.87 21.82 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 124.94 1.296 . . . . 0.0 110.848 -179.004 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 67.9 t -133.94 127.82 52.45 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 C-N-CA 125.513 1.525 . . . . 0.0 109.933 176.835 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 44.2 t -161.29 -56.61 0.05 OUTLIER 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 123.978 0.911 . . . . 0.0 112.635 174.447 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 13.2 t -80.09 -29.6 39.08 Favored 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 113.553 0.945 . . . . 0.0 113.553 -174.517 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 13.3 ttt -135.34 115.08 12.84 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 125.283 1.433 . . . . 0.0 109.991 -178.875 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -117.76 -10.07 10.58 Favored 'General case' 0 N--CA 1.479 0.988 0 N-CA-C 113.89 1.071 . . . . 0.0 113.89 -169.291 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -87.42 124.65 33.64 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 124.866 1.266 . . . . 0.0 112.005 -178.043 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 59.4 mtmt . . . . . 0 N--CA 1.477 0.879 0 C-N-CA 126.098 1.759 . . . . 0.0 110.489 174.957 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.1 mtt . . . . . 0 N--CA 1.471 0.576 0 CA-C-O 120.519 0.2 . . . . 0.0 110.765 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 -135.88 148.44 65.1 Favored Pre-proline 0 CA--C 1.548 0.872 0 C-N-CA 125.11 1.364 . . . . 0.0 112.09 176.67 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -81.43 -7.85 12.72 Favored 'Trans proline' 0 CA--C 1.538 0.678 0 C-N-CA 123.643 2.895 . . . . 0.0 115.097 -177.0 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -130.94 31.4 4.48 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 125.787 1.635 . . . . 0.0 114.206 -174.194 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -101.29 -4.11 27.68 Favored 'General case' 0 N--CA 1.478 0.971 0 N-CA-C 114.67 1.359 . . . . 0.0 114.67 179.589 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -129.79 -57.63 1.11 Allowed 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 124.647 1.179 . . . . 0.0 113.424 -160.62 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.8 pp -107.05 9.5 9.39 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.761 0 C-N-CA 125.925 1.69 . . . . 0.0 112.869 -177.157 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 18.0 tt -48.61 114.4 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.841 0 C-N-CA 125.045 1.338 . . . . 0.0 113.791 -175.219 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 7.7 t30 -161.14 130.15 4.64 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 126.942 2.097 . . . . 0.0 108.586 171.652 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 29.2 t0 -150.42 47.87 0.89 Allowed 'General case' 0 N--CA 1.476 0.835 0 CA-C-O 122.556 1.17 . . . . 0.0 111.106 178.409 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 58.5 mt 48.69 96.7 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 C-N-CA 128.83 2.852 . . . . 0.0 112.539 -168.362 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.441 ' HA ' ' HE2' ' A' ' 12' ' ' LYS . 11.3 mmpt? . . . . . 0 N--CA 1.472 0.663 0 C-N-CA 125.136 1.374 . . . . 0.0 113.321 172.463 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 63.7 mt . . . . . 0 N--CA 1.472 0.637 0 N-CA-C 112.988 0.736 . . . . 0.0 112.988 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 67.4 m -76.33 165.0 25.48 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.73 0.812 . . . . 0.0 110.299 171.144 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -55.22 -45.91 75.95 Favored 'General case' 0 N--CA 1.48 1.027 0 O-C-N 120.746 -1.222 . . . . 0.0 113.185 -174.348 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 10.5 tt0 -67.69 -43.43 80.13 Favored 'General case' 0 N--CA 1.469 0.522 0 O-C-N 121.496 -0.752 . . . . 0.0 111.063 176.758 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 88.7 mt-30 -62.95 -41.48 99.52 Favored 'General case' 0 CA--C 1.536 0.412 0 O-C-N 121.916 -0.49 . . . . 0.0 111.819 178.935 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 22.6 ttmm -59.74 -40.98 89.89 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 124.27 1.028 . . . . 0.0 110.982 174.742 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 50.6 mt -67.38 -41.53 86.4 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 CA-C-O 118.077 -0.963 . . . . 0.0 111.474 175.583 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 45.6 mt -64.5 -44.91 96.95 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.904 0 CA-C-N 120.773 1.624 . . . . 0.0 110.29 178.074 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -58.29 -48.38 80.66 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.774 1.23 . . . . 0.0 110.587 177.434 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -63.56 -53.11 56.92 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.625 1.17 . . . . 0.0 112.599 176.529 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.3 mm-40 -60.01 -29.99 68.85 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-N 118.998 0.817 . . . . 0.0 112.822 -179.696 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.417 ' CE2' HG22 ' A' ' 55' ' ' ILE . 1.3 t80 -68.04 -56.95 7.02 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 118.806 0.73 . . . . 0.0 110.93 176.311 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 80.1 mt -64.98 -33.65 65.14 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.333 0 C-N-CA 126.526 1.931 . . . . 0.0 111.195 -179.323 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -72.25 -27.96 62.84 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.892 0.877 . . . . 0.0 112.568 176.309 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -85.53 -39.67 17.16 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 123.861 0.865 . . . . 0.0 112.503 176.337 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.9 m -105.21 -6.95 9.83 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.047 0 N-CA-C 113.654 0.983 . . . . 0.0 113.654 -175.497 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 81.48 33.23 28.72 Favored Glycine 0 N--CA 1.471 0.985 0 C-N-CA 124.263 0.935 . . . . 0.0 114.176 164.207 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 20.0 tp 60.86 -26.77 0.04 OUTLIER 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 129.945 3.298 . . . . 0.0 117.708 -174.148 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 29.5 mt-30 -77.27 -13.0 60.02 Favored 'General case' 0 C--N 1.32 -0.684 0 C-N-CA 126.922 2.089 . . . . 0.0 113.752 -169.277 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 60.5 m-80 -123.31 1.16 9.03 Favored 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 114.336 1.236 . . . . 0.0 114.336 -169.736 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' ILE . . . . . 0.417 HG22 ' CE2' ' A' ' 46' ' ' TYR . 18.3 pt -75.91 155.46 5.95 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 CA-C-O 121.072 0.463 . . . . 0.0 111.705 175.006 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -137.85 143.94 41.19 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 124.658 1.183 . . . . 0.0 110.018 178.794 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -61.33 -26.62 67.93 Favored 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 123.634 0.773 . . . . 0.0 112.316 -179.758 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -67.47 -51.21 54.37 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.327 0 C-N-CA 125.343 1.457 . . . . 0.0 109.631 174.538 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 83.6 m -73.81 -43.82 57.66 Favored 'General case' 0 C--N 1.33 -0.239 0 O-C-N 121.749 -0.594 . . . . 0.0 109.918 -176.719 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 17.2 tp -60.61 -35.09 75.29 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 125.53 1.532 . . . . 0.0 112.343 174.384 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.485 ' HA ' HG13 ' A' ' 66' ' ' ILE . 12.0 t -54.99 -30.43 59.3 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 124.975 1.31 . . . . 0.0 112.581 169.485 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 1.5 mptp? -105.19 -22.78 13.01 Favored 'General case' 0 N--CA 1.468 0.474 0 N-CA-C 114.491 1.293 . . . . 0.0 114.491 -176.464 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 68.4 mmtt -62.9 -34.57 77.69 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 119.797 1.18 . . . . 0.0 111.636 174.074 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.2 mp -120.92 13.65 11.44 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.923 1.289 . . . . 0.0 114.05 -176.401 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . 0.273 0.9 OUTLIER 48.2 53.68 11.4 Favored 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 126.614 1.965 . . . . 0.0 114.218 -177.14 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.485 HG13 ' HA ' ' A' ' 61' ' ' SER . 2.7 pt -117.42 -176.05 0.92 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 C-N-CA 126.781 2.032 . . . . 0.0 111.483 -174.626 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 36.8 p -83.94 156.76 22.19 Favored 'General case' 0 N--CA 1.474 0.734 0 O-C-N 121.214 -0.929 . . . . 0.0 111.084 170.791 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 66.7 t -62.27 -28.94 45.54 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 O-C-N 121.672 -0.643 . . . . 0.0 111.132 170.914 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -74.91 -42.71 57.24 Favored 'General case' 0 C--O 1.234 0.263 0 O-C-N 120.988 -1.07 . . . . 0.0 109.879 -176.597 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . 0.262 0.0 OUTLIER -77.69 -30.17 51.79 Favored 'General case' 0 C--N 1.344 0.348 0 CA-C-N 118.137 0.426 . . . . 0.0 111.88 -178.993 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -65.04 -47.32 77.81 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 124.678 1.191 . . . . 0.0 112.324 169.322 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 38.1 ttmt -68.1 -28.91 67.75 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 124.32 1.048 . . . . 0.0 111.492 -178.258 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -55.17 -36.54 65.96 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 123.494 0.718 . . . . 0.0 112.361 175.729 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 31.5 m-85 -69.54 -42.7 74.28 Favored 'General case' 0 C--O 1.223 -0.324 0 C-N-CA 125.569 1.548 . . . . 0.0 111.02 177.136 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 75.2 mt -68.45 -37.27 77.56 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.468 0 C-N-CA 124.173 0.989 . . . . 0.0 110.264 -178.626 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 88.5 mttt -65.19 -34.91 79.49 Favored 'General case' 0 N--CA 1.471 0.594 0 O-C-N 120.853 -1.154 . . . . 0.0 113.448 178.538 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 9.6 p30 . . . . . 0 N--CA 1.464 0.272 0 CA-C-N 119.315 0.961 . . . . 0.0 111.105 174.202 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 . . . . . 0 N--CA 1.473 0.708 0 CA-C-O 120.982 0.42 . . . . 0.0 111.72 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -121.43 74.25 1.1 Allowed 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 125.166 1.386 . . . . 0.0 110.692 -175.394 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 18.6 m -135.12 21.92 1.05 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.615 0 C-N-CA 125.588 1.555 . . . . 0.0 114.229 -170.76 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 22.9 t -146.45 -56.59 0.28 Allowed 'General case' 0 N--CA 1.476 0.831 0 N-CA-C 113.517 0.932 . . . . 0.0 113.517 -176.625 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 45.6 m -88.15 -40.27 13.87 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 123.261 0.624 . . . . 0.0 112.441 -175.509 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 1.8 mpt? -125.05 141.66 51.98 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 126.473 1.909 . . . . 0.0 108.827 169.75 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -148.04 94.49 2.34 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.752 1.221 . . . . 0.0 109.259 178.31 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -138.2 156.18 47.95 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.195 1.398 . . . . 0.0 112.304 -178.863 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 2.0 mmmp? . . . . . 0 N--CA 1.478 0.93 0 C-N-CA 125.996 1.718 . . . . 0.0 110.831 179.894 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 36.9 ttm . . . . . 0 CA--C 1.547 0.863 0 N-CA-C 112.926 0.713 . . . . 0.0 112.926 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 -84.76 147.81 49.76 Favored Pre-proline 0 CA--C 1.547 0.847 0 C-N-CA 124.628 1.171 . . . . 0.0 112.481 -179.141 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_endo -71.03 -19.18 30.44 Favored 'Trans proline' 0 C--N 1.35 0.655 0 C-N-CA 122.935 2.424 . . . . 0.0 114.963 -173.634 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.478 HD23 ' H ' ' A' ' 4' ' ' LEU . 2.6 pt? -112.63 25.68 11.24 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 126.828 2.051 . . . . 0.0 114.402 -172.353 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -103.01 0.52 32.22 Favored 'General case' 0 N--CA 1.477 0.876 0 N-CA-C 114.815 1.413 . . . . 0.0 114.815 -178.167 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -122.46 -55.36 1.84 Allowed 'General case' 0 N--CA 1.484 1.234 0 N-CA-C 113.894 1.072 . . . . 0.0 113.894 -165.168 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.0 pp -129.84 15.15 2.39 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 C-N-CA 125.652 1.581 . . . . 0.0 112.81 -171.784 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 14.2 tt -39.79 133.33 0.49 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.847 0 C-N-CA 126.407 1.883 . . . . 0.0 114.407 178.724 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 25.8 t30 -148.54 148.85 30.66 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 126.242 1.817 . . . . 0.0 110.732 170.63 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 20.2 m-20 -132.63 71.47 1.47 Allowed 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 125.389 1.475 . . . . 0.0 111.004 170.41 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . 0.34 6.7 tp 52.21 26.26 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.069 0 C-N-CA 128.262 2.625 . . . . 0.0 115.571 175.098 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.476 0.867 0 N-CA-C 114.818 1.414 . . . . 0.0 114.818 177.612 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 11.2 mt . . . . . 0 CA--C 1.54 0.593 0 N-CA-C 110.398 -0.223 . . . . 0.0 110.398 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 68.3 m -69.06 167.19 16.52 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.006 0.522 . . . . 0.0 110.47 171.158 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -56.26 -45.48 80.07 Favored 'General case' 0 N--CA 1.478 0.927 0 O-C-N 120.463 -1.398 . . . . 0.0 112.651 -176.327 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 10.3 tt0 -70.16 -44.25 69.18 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 123.527 0.731 . . . . 0.0 111.347 176.338 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 82.9 mt-30 -59.71 -41.66 91.3 Favored 'General case' 0 N--CA 1.468 0.453 0 O-C-N 121.805 -0.559 . . . . 0.0 111.693 178.16 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 3.4 ttmp? -62.34 -40.05 95.11 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 124.206 1.002 . . . . 0.0 111.215 177.542 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 52.4 mt -70.53 -39.46 76.18 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.558 0 CA-C-O 117.958 -1.02 . . . . 0.0 111.585 175.655 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 50.7 mt -62.87 -45.64 98.36 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.99 0 CA-C-N 120.942 1.701 . . . . 0.0 109.733 176.676 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -58.58 -49.44 77.45 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.829 1.251 . . . . 0.0 110.924 178.56 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -63.94 -52.21 60.8 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 124.784 1.234 . . . . 0.0 112.766 177.086 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -60.22 -30.36 69.34 Favored 'General case' 0 N--CA 1.472 0.625 0 CA-C-N 118.99 0.814 . . . . 0.0 112.724 179.867 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -67.02 -56.84 8.38 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 118.631 0.65 . . . . 0.0 110.605 176.659 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 87.1 mt -62.81 -34.14 64.14 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 C-N-CA 126.383 1.873 . . . . 0.0 111.287 178.126 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -70.91 -28.08 64.26 Favored 'General case' 0 CA--C 1.542 0.663 0 O-C-N 121.267 -0.896 . . . . 0.0 112.654 177.169 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -85.67 -40.26 16.37 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.127 0.971 . . . . 0.0 112.208 175.689 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.5 m -108.75 -5.04 10.73 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.159 0 N-CA-C 114.32 1.23 . . . . 0.0 114.32 -172.275 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 84.96 25.25 41.66 Favored Glycine 0 CA--C 1.529 0.96 0 C-N-CA 125.111 1.339 . . . . 0.0 115.263 161.318 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 58.01 6.64 0.51 Allowed 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 127.267 2.227 . . . . 0.0 115.155 -172.923 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 29.2 mt-30 -105.71 -18.01 14.21 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 125.856 1.663 . . . . 0.0 113.098 -172.139 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 47.0 m-80 -124.06 3.79 8.64 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 124.257 1.023 . . . . 0.0 113.542 -172.631 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 24.6 pt -74.36 154.31 6.68 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 CA-C-O 121.085 0.469 . . . . 0.0 111.116 172.666 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -138.85 142.65 38.63 Favored 'General case' 0 N--CA 1.466 0.375 0 C-N-CA 124.824 1.25 . . . . 0.0 109.525 178.68 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -61.01 -27.87 68.63 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 118.838 0.745 . . . . 0.0 112.274 -179.772 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -63.84 -49.29 82.58 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.466 0 C-N-CA 125.576 1.55 . . . . 0.0 109.922 174.626 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 83.9 m -78.98 -43.0 25.35 Favored 'General case' 0 C--O 1.223 -0.32 0 C-N-CA 123.806 0.842 . . . . 0.0 110.302 -175.904 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 14.0 tp -60.01 -36.75 77.89 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 125.078 1.351 . . . . 0.0 111.745 174.098 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.443 ' HA ' HG13 ' A' ' 66' ' ' ILE . 30.4 t -56.44 -31.41 63.93 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 124.839 1.255 . . . . 0.0 112.632 170.601 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -101.24 -26.36 13.67 Favored 'General case' 0 N--CA 1.467 0.39 0 N-CA-C 114.643 1.349 . . . . 0.0 114.643 -175.81 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 58.7 mmtt -64.41 -33.01 74.87 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 125.135 1.374 . . . . 0.0 111.577 175.387 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.7 mp -117.84 3.92 12.22 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.213 1.405 . . . . 0.0 114.353 -175.086 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 24.7 m-80 57.0 57.52 4.57 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 126.388 1.875 . . . . 0.0 113.415 -178.659 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.443 HG13 ' HA ' ' A' ' 61' ' ' SER . 1.2 pt -124.74 -163.99 0.38 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.849 0 C-N-CA 127.243 2.217 . . . . 0.0 110.554 -174.641 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 2.4 p -100.8 162.24 13.04 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 124.296 1.039 . . . . 0.0 111.126 170.284 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 69.2 t -61.65 -28.9 45.05 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 C-N-CA 123.545 0.738 . . . . 0.0 111.391 173.242 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -80.87 -38.17 28.59 Favored 'General case' 0 N--CA 1.471 0.613 0 O-C-N 120.893 -1.129 . . . . 0.0 110.394 -178.971 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 9.5 tmtt? -64.67 -45.5 86.45 Favored 'General case' 0 C--O 1.224 -0.237 0 C-N-CA 125.632 1.573 . . . . 0.0 110.518 176.961 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -60.34 -48.62 80.97 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 126.275 1.83 . . . . 0.0 113.444 170.71 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 36.5 ttmt -71.62 -23.03 61.64 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 124.227 1.011 . . . . 0.0 111.758 -174.417 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -52.02 -47.73 64.86 Favored 'General case' 0 CA--C 1.545 0.76 0 CA-C-N 118.137 0.426 . . . . 0.0 110.527 171.421 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 33.9 m-85 -64.6 -43.28 94.29 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 123.845 0.858 . . . . 0.0 111.982 179.776 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 55.8 mt -63.91 -25.38 38.04 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.629 0 C-N-CA 123.978 0.911 . . . . 0.0 111.099 179.15 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -91.06 -31.85 16.11 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 125.176 1.39 . . . . 0.0 114.686 179.724 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 23.5 p30 . . . . . 0 CA--C 1.54 0.57 0 CA-C-N 120.247 1.385 . . . . 0.0 114.224 -179.258 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 . . . . . 0 N--CA 1.473 0.676 0 CA-C-O 120.825 0.345 . . . . 0.0 111.276 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -144.64 96.8 2.93 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 124.833 1.253 . . . . 0.0 110.345 -175.535 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 71.7 t -136.59 137.99 46.99 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 C-N-CA 125.577 1.551 . . . . 0.0 110.683 -177.33 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 67.5 p -161.92 -66.26 0.05 Allowed 'General case' 0 N--CA 1.476 0.837 0 N-CA-C 113.609 0.966 . . . . 0.0 113.609 172.632 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 77.9 p -82.43 -23.54 34.77 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 124.977 1.311 . . . . 0.0 114.291 -173.157 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 93.1 mtp -133.5 130.93 39.21 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 126.023 1.729 . . . . 0.0 109.495 174.551 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -138.69 65.63 1.45 Allowed 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 125.074 1.35 . . . . 0.0 109.93 -174.683 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 53.4 -155.62 0.2 Allowed 'General case' 0 CA--C 1.555 1.147 0 C-N-CA 125.855 1.662 . . . . 0.0 113.886 -174.94 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 71.2 mmtt . . . . . 0 N--CA 1.478 0.973 0 C-N-CA 126.287 1.835 . . . . 0.0 111.947 177.851 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 21.0 ttt . . . . . 0 CA--C 1.55 0.972 0 CA-C-O 121.157 0.503 . . . . 0.0 112.298 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -120.82 98.39 47.81 Favored Pre-proline 0 CA--C 1.546 0.809 0 O-C-N 120.639 -1.288 . . . . 0.0 111.981 -168.796 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 95.5 Cg_endo -83.66 -8.59 10.31 Favored 'Trans proline' 0 C--N 1.351 0.665 0 C-N-CA 123.205 2.603 . . . . 0.0 114.699 178.145 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 94.3 mt -102.69 44.22 1.03 Allowed 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.626 1.57 . . . . 0.0 113.683 -170.582 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -106.91 -1.77 21.98 Favored 'General case' 0 N--CA 1.479 1.004 0 N-CA-C 114.907 1.447 . . . . 0.0 114.907 172.073 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -128.49 -56.46 1.23 Allowed 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 124.174 0.99 . . . . 0.0 113.363 -166.833 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.7 pp -109.54 9.07 8.96 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 C-N-CA 126.029 1.732 . . . . 0.0 112.888 -175.912 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 13.3 tt -49.85 120.31 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 124.223 1.009 . . . . 0.0 112.559 -179.252 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 53.85 21.48 2.79 Favored 'General case' 0 CA--C 1.55 0.965 0 C-N-CA 126.536 1.935 . . . . 0.0 115.244 179.937 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -86.32 13.83 7.5 Favored 'General case' 0 CA--C 1.547 0.832 0 N-CA-C 114.794 1.405 . . . . 0.0 114.794 -168.636 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 12.7 tt -143.69 21.35 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.879 0 C-N-CA 125.325 1.45 . . . . 0.0 114.201 -174.076 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 54.3 mtpt . . . . . 0 N--CA 1.479 0.979 0 N-CA-C 115.572 1.693 . . . . 0.0 115.572 178.895 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 8.1 mt . . . . . 0 CA--C 1.543 0.677 0 N-CA-C 110.224 -0.287 . . . . 0.0 110.224 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 22.8 t -70.93 164.46 25.39 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 122.93 0.492 . . . . 0.0 110.747 169.83 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -57.24 -44.17 83.58 Favored 'General case' 0 N--CA 1.476 0.836 0 O-C-N 120.531 -1.355 . . . . 0.0 112.965 -175.3 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 8.1 pt20 -75.9 -33.88 59.93 Favored 'General case' 0 N--CA 1.471 0.6 0 O-C-N 121.693 -0.63 . . . . 0.0 112.155 174.769 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 93.2 mt-30 -67.52 -39.5 85.11 Favored 'General case' 0 CA--C 1.532 0.264 0 O-C-N 121.662 -0.649 . . . . 0.0 111.52 -179.691 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 23.7 ttmm -59.36 -41.0 88.24 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 124.213 1.005 . . . . 0.0 110.81 174.682 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 46.2 mt -69.65 -42.2 80.38 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.656 0 CA-C-O 118.136 -0.935 . . . . 0.0 111.283 177.026 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 42.4 mt -63.86 -44.5 98.11 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.069 0 CA-C-N 120.702 1.592 . . . . 0.0 110.361 178.357 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -59.69 -47.52 85.33 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 125.033 1.333 . . . . 0.0 110.865 176.74 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -63.92 -51.83 62.67 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 124.634 1.173 . . . . 0.0 112.67 176.703 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -58.95 -31.62 68.87 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-N 119.261 0.937 . . . . 0.0 112.689 179.124 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -66.07 -57.41 7.78 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 118.621 0.646 . . . . 0.0 110.587 176.869 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 71.0 mt -62.7 -35.13 69.17 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.352 0 C-N-CA 127.199 2.2 . . . . 0.0 111.896 178.631 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -71.97 -29.03 63.83 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.023 0.929 . . . . 0.0 112.408 178.138 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -86.27 -38.76 17.22 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 123.988 0.915 . . . . 0.0 112.312 176.236 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.3 m -106.55 -5.91 10.19 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.191 0 N-CA-C 114.285 1.217 . . . . 0.0 114.285 -174.372 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 86.32 25.85 35.27 Favored Glycine 0 N--CA 1.472 1.085 0 C-N-CA 124.967 1.27 . . . . 0.0 115.306 161.594 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 54.3 14.24 0.74 Allowed 'General case' 0 CA--C 1.554 1.116 0 C-N-CA 127.381 2.272 . . . . 0.0 115.129 -173.538 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 5.2 pt20 -124.6 -3.17 7.84 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 124.854 1.262 . . . . 0.0 113.662 -171.589 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 50.4 m-80 -124.55 3.52 8.31 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 124.935 1.294 . . . . 0.0 113.411 174.419 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 33.0 pt -74.51 152.95 6.76 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.648 0 O-C-N 121.68 -0.638 . . . . 0.0 112.192 177.007 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -135.49 146.13 47.83 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 125.237 1.415 . . . . 0.0 109.864 174.522 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -65.0 -24.99 67.67 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.884 0.874 . . . . 0.0 112.125 177.397 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -68.02 -38.5 79.99 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.488 0 C-N-CA 125.905 1.682 . . . . 0.0 110.419 173.464 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 90.7 m -83.06 -43.67 16.04 Favored 'General case' 0 C--N 1.33 -0.25 0 O-C-N 121.661 -0.649 . . . . 0.0 109.668 -178.643 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 8.0 mt -60.44 -36.86 79.18 Favored 'General case' 0 N--CA 1.468 0.439 0 O-C-N 121.442 -0.786 . . . . 0.0 112.571 171.297 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.452 ' HA ' HG13 ' A' ' 66' ' ' ILE . 62.1 p -59.98 -24.69 64.64 Favored 'General case' 0 N--CA 1.477 0.921 0 CA-C-N 119.509 1.049 . . . . 0.0 112.669 175.938 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -103.13 -28.23 12.07 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 125.277 1.431 . . . . 0.0 114.246 -177.625 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 19.7 mmmt -64.31 -31.0 72.03 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.841 1.257 . . . . 0.0 112.775 176.889 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.3 mp -126.71 9.5 7.03 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 114.158 1.17 . . . . 0.0 114.158 -175.378 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 16.4 m-80 56.04 59.8 3.55 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 125.932 1.693 . . . . 0.0 113.222 -178.541 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.452 HG13 ' HA ' ' A' ' 61' ' ' SER . 1.1 pt -128.41 173.83 12.81 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 C-N-CA 126.747 2.019 . . . . 0.0 111.679 -173.986 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.2 p -77.17 158.16 30.53 Favored 'General case' 0 N--CA 1.477 0.905 0 O-C-N 120.998 -1.064 . . . . 0.0 111.054 173.931 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 87.6 t -63.69 -28.88 45.89 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.909 0 O-C-N 121.632 -0.667 . . . . 0.0 111.25 172.752 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -77.63 -37.83 49.27 Favored 'General case' 0 N--CA 1.47 0.551 0 O-C-N 120.711 -1.243 . . . . 0.0 110.19 -179.757 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 5.0 tmtm? -65.01 -48.52 73.62 Favored 'General case' 0 C--O 1.225 -0.227 0 C-N-CA 125.489 1.515 . . . . 0.0 110.402 176.423 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -59.61 -42.9 93.67 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 126.107 1.763 . . . . 0.0 113.213 172.808 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 36.3 ttmt -74.16 -29.37 61.75 Favored 'General case' 0 CA--C 1.516 -0.342 0 C-N-CA 124.477 1.111 . . . . 0.0 111.838 -175.958 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -50.5 -45.98 56.86 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 118.415 0.552 . . . . 0.0 110.405 176.837 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 35.6 m-85 -64.58 -39.17 93.25 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.75 0.82 . . . . 0.0 111.559 -176.453 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 20.2 mt -71.91 -28.07 29.23 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.623 0 C-N-CA 124.594 1.157 . . . . 0.0 110.955 -179.952 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 25.4 mmmt -76.98 -39.93 48.69 Favored 'General case' 0 N--CA 1.466 0.33 0 O-C-N 120.878 -1.138 . . . . 0.0 112.251 178.032 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 24.2 p30 . . . . . 0 N--CA 1.468 0.431 0 CA-C-N 119.123 0.874 . . . . 0.0 112.63 -174.771 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.476 0.858 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -132.17 43.07 3.06 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 125.092 1.357 . . . . 0.0 112.291 -179.911 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 7.2 p -152.37 142.83 15.38 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.442 0 C-N-CA 124.916 1.286 . . . . 0.0 111.321 -173.369 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 43.9 m 53.17 28.26 6.84 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 125.859 1.664 . . . . 0.0 115.361 177.618 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 35.4 t -153.57 -49.42 0.09 Allowed 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 124.916 1.286 . . . . 0.0 112.145 -179.029 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 78.1 mtm -131.16 69.08 1.48 Allowed 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 125.401 1.48 . . . . 0.0 110.556 178.648 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -77.1 74.7 3.67 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 124.836 1.255 . . . . 0.0 110.318 176.376 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 56.27 -170.98 0.08 Allowed 'General case' 0 CA--C 1.554 1.133 0 C-N-CA 126.479 1.912 . . . . 0.0 113.899 -167.887 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 98.4 mttt . . . . . 0 N--CA 1.478 0.97 0 C-N-CA 126.028 1.731 . . . . 0.0 111.712 178.757 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 98.8 mmm . . . . . 0 N--CA 1.47 0.531 0 CA-C-O 120.795 0.331 . . . . 0.0 111.437 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 22.2 m-20 -122.42 102.18 39.79 Favored Pre-proline 0 CA--C 1.547 0.834 0 C-N-CA 125.225 1.41 . . . . 0.0 111.008 177.902 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 65.1 Cg_endo -86.29 2.82 7.18 Favored 'Trans proline' 0 C--N 1.35 0.607 0 C-N-CA 123.66 2.906 . . . . 0.0 114.559 -179.336 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 84.6 mt -111.32 41.69 1.81 Allowed 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 125.449 1.5 . . . . 0.0 113.176 -171.575 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -110.02 1.02 18.72 Favored 'General case' 0 N--CA 1.48 1.031 0 N-CA-C 114.985 1.476 . . . . 0.0 114.985 176.572 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -117.13 -55.51 2.33 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 124.142 0.977 . . . . 0.0 113.418 -168.443 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.9 pp -129.22 12.23 2.61 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 C-N-CA 126.238 1.815 . . . . 0.0 112.996 -171.975 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 11.7 tt -41.98 126.81 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.908 0 C-N-CA 125.569 1.547 . . . . 0.0 113.794 -176.854 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 49.5 t30 -153.93 138.93 17.26 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.497 1.519 . . . . 0.0 110.516 165.515 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 33.5 t0 -152.59 62.07 0.81 Allowed 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.765 1.226 . . . . 0.0 110.204 171.509 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 86.8 mt 54.95 106.57 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.543 0 C-N-CA 128.363 2.665 . . . . 0.0 112.153 -162.013 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 11.6 mmpt? . . . . . 0 N--CA 1.48 1.075 0 C-N-CA 125.57 1.548 . . . . 0.0 113.438 175.611 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.1 mt . . . . . 0 CA--C 1.543 0.708 0 CA-C-O 120.328 0.109 . . . . 0.0 111.081 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 23.2 t -73.45 166.34 23.4 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.452 0.701 . . . . 0.0 110.768 169.015 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -56.98 -44.29 82.52 Favored 'General case' 0 N--CA 1.476 0.83 0 O-C-N 120.343 -1.473 . . . . 0.0 113.106 -174.732 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 6.7 pt20 -76.3 -35.88 58.63 Favored 'General case' 0 N--CA 1.47 0.542 0 O-C-N 121.642 -0.661 . . . . 0.0 112.233 175.028 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 92.7 mt-30 -65.35 -38.98 91.75 Favored 'General case' 0 N--CA 1.464 0.271 0 O-C-N 121.595 -0.69 . . . . 0.0 111.21 179.254 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 40.9 ttmt -58.87 -41.44 87.06 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 124.522 1.129 . . . . 0.0 110.814 175.569 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 42.5 mt -71.24 -41.21 74.85 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.638 0 CA-C-O 118.358 -0.829 . . . . 0.0 111.219 177.911 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 37.9 mt -65.15 -41.44 91.77 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.964 0 CA-C-N 120.166 1.348 . . . . 0.0 110.363 177.416 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -60.72 -48.45 81.72 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.541 1.137 . . . . 0.0 110.737 176.763 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -66.04 -50.21 64.96 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 124.472 1.109 . . . . 0.0 112.141 178.608 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -65.56 -22.65 66.72 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 119.222 0.919 . . . . 0.0 113.104 -176.185 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.437 ' CE2' HG22 ' A' ' 55' ' ' ILE . 1.2 t80 -71.58 -58.96 3.02 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.228 1.011 . . . . 0.0 110.834 173.075 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 86.8 mt -63.84 -33.06 59.61 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.451 0 C-N-CA 126.794 2.038 . . . . 0.0 111.598 -179.861 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -71.04 -24.75 62.41 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.076 0.951 . . . . 0.0 112.704 176.234 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -90.78 -38.81 12.76 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.199 0.999 . . . . 0.0 112.517 175.767 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.3 m -110.24 -3.41 10.54 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.111 0 N-CA-C 114.167 1.173 . . . . 0.0 114.167 -173.577 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 85.21 23.11 49.75 Favored Glycine 0 N--CA 1.473 1.112 0 C-N-CA 125.219 1.39 . . . . 0.0 115.457 159.326 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 56.87 6.9 0.35 Allowed 'General case' 0 CA--C 1.554 1.128 0 C-N-CA 127.577 2.351 . . . . 0.0 115.181 -170.335 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 29.2 mt-30 -104.71 -17.69 14.55 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 125.545 1.538 . . . . 0.0 112.977 -173.005 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 44.5 m-80 -123.98 4.17 8.68 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.396 1.078 . . . . 0.0 113.634 -173.543 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' ILE . . . . . 0.437 HG22 ' CE2' ' A' ' 46' ' ' TYR . 23.1 pt -75.28 155.26 6.22 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 C-N-CA 122.976 0.51 . . . . 0.0 111.291 173.377 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -137.62 142.85 41.23 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 124.487 1.115 . . . . 0.0 110.257 179.106 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -60.7 -27.45 67.89 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.741 0.816 . . . . 0.0 112.227 -179.867 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -65.93 -49.76 74.64 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.484 0 C-N-CA 125.606 1.562 . . . . 0.0 110.125 175.044 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 61.9 m -77.79 -43.41 30.73 Favored 'General case' 0 C--O 1.222 -0.387 0 C-N-CA 123.612 0.765 . . . . 0.0 109.962 -175.642 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 19.8 tp -61.39 -35.11 76.6 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 125.481 1.513 . . . . 0.0 112.171 174.322 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.459 ' HA ' HG13 ' A' ' 66' ' ' ILE . 30.3 t -54.96 -31.65 60.82 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 124.719 1.208 . . . . 0.0 112.513 168.501 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -100.57 -26.9 13.67 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 125.033 1.333 . . . . 0.0 114.162 -174.892 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 64.6 mmtt -61.44 -37.7 84.51 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 125.018 1.327 . . . . 0.0 111.773 174.974 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.2 mp -116.95 6.73 13.06 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 114.146 1.165 . . . . 0.0 114.146 -174.373 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 20.4 m-80 56.56 57.46 4.82 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 126.485 1.914 . . . . 0.0 113.23 -179.046 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.459 HG13 ' HA ' ' A' ' 61' ' ' SER . 1.6 pt -124.76 -170.93 0.67 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.693 0 C-N-CA 126.584 1.954 . . . . 0.0 110.917 -172.753 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.5 p -89.76 159.98 16.77 Favored 'General case' 0 N--CA 1.476 0.862 0 O-C-N 121.311 -0.868 . . . . 0.0 110.921 170.258 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 88.8 t -62.14 -30.18 48.2 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.893 0 C-N-CA 123.187 0.595 . . . . 0.0 111.307 172.641 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -79.73 -36.7 36.99 Favored 'General case' 0 N--CA 1.469 0.492 0 O-C-N 121.001 -1.062 . . . . 0.0 110.514 -179.055 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 4.6 tmtm? -68.08 -44.45 76.26 Favored 'General case' 0 C--O 1.222 -0.362 0 C-N-CA 124.421 1.088 . . . . 0.0 110.715 177.242 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -59.33 -46.87 87.42 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 125.046 1.338 . . . . 0.0 112.752 170.107 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 18.9 ttmm -67.67 -26.69 66.32 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 124.417 1.087 . . . . 0.0 111.523 -176.79 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -51.26 -42.14 60.86 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-N 118.171 0.441 . . . . 0.0 111.216 174.2 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 24.2 m-85 -70.39 -39.71 74.37 Favored 'General case' 0 C--O 1.225 -0.211 0 C-N-CA 124.479 1.111 . . . . 0.0 111.588 -177.474 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 52.6 mt -67.15 -24.79 32.58 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 C-N-CA 125.608 1.563 . . . . 0.0 111.185 179.292 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.428 ' HA ' ' HE2' ' A' ' 76' ' ' LYS . 10.6 mmpt? -95.23 -25.44 16.37 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 125.322 1.449 . . . . 0.0 113.177 178.46 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 42.6 m-20 . . . . . 0 N--CA 1.465 0.298 0 C-N-CA 125.305 1.442 . . . . 0.0 110.679 174.242 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 17.3 mm-40 . . . . . 0 N--CA 1.474 0.76 0 N-CA-C 114.083 1.142 . . . . 0.0 114.083 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -143.41 79.9 1.65 Allowed 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 124.579 1.152 . . . . 0.0 111.2 178.614 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 11.6 p -151.1 154.77 7.95 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.715 0 C-N-CA 125.71 1.604 . . . . 0.0 110.578 177.099 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 25.5 m 63.76 -39.42 0.2 Allowed 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 128.301 2.64 . . . . 0.0 116.909 -179.333 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 49.8 m -86.01 -19.56 30.16 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.738 1.215 . . . . 0.0 114.122 -177.547 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 13.5 ttt -144.57 28.99 1.28 Allowed 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.986 1.315 . . . . 0.0 112.458 -177.731 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -83.54 59.68 5.25 Favored 'General case' 0 CA--C 1.55 0.943 0 C-N-CA 124.881 1.273 . . . . 0.0 111.624 -174.75 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -152.02 165.1 35.71 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 125.841 1.656 . . . . 0.0 112.442 -177.628 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 36.4 mtmm . . . . . 0 N--CA 1.478 0.94 0 C-N-CA 125.848 1.659 . . . . 0.0 111.539 171.569 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 60.6 mtt . . . . . 0 N--CA 1.477 0.884 0 CA-C-O 121.418 0.628 . . . . 0.0 111.231 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -130.09 110.03 16.78 Favored Pre-proline 0 CA--C 1.55 0.949 0 C-N-CA 124.75 1.22 . . . . 0.0 111.79 -173.726 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 69.3 Cg_endo -85.28 -8.52 8.69 Favored 'Trans proline' 0 C--N 1.352 0.741 0 C-N-CA 123.51 2.807 . . . . 0.0 115.179 -176.609 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 96.6 mt -111.92 48.65 0.95 Allowed 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 126.261 1.825 . . . . 0.0 111.183 -177.757 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -118.29 1.52 11.86 Favored 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 114.26 1.208 . . . . 0.0 114.26 -179.836 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -119.12 -55.84 2.13 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 124.673 1.189 . . . . 0.0 112.879 -168.402 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.1 pp -128.98 14.32 2.72 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 C-N-CA 126.414 1.886 . . . . 0.0 112.762 -173.741 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 7.7 tt -46.54 105.31 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.1 0 C-N-CA 125.346 1.458 . . . . 0.0 112.4 179.79 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -154.71 -3.29 0.16 Allowed 'General case' 0 N--CA 1.478 0.929 0 N-CA-C 114.519 1.303 . . . . 0.0 114.519 -177.406 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -84.62 12.12 7.65 Favored 'General case' 0 CA--C 1.546 0.796 0 N-CA-C 115.157 1.54 . . . . 0.0 115.157 -162.383 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 7.1 tp -147.01 29.29 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 C-N-CA 125.73 1.612 . . . . 0.0 113.32 -173.707 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 2.3 tppp? . . . . . 0 N--CA 1.476 0.834 0 N-CA-C 114.824 1.416 . . . . 0.0 114.824 -179.085 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 49.7 mt . . . . . 0 CA--C 1.54 0.595 0 CA-C-O 120.537 0.208 . . . . 0.0 111.045 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 70.7 m -72.98 164.8 26.14 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 122.891 0.476 . . . . 0.0 110.255 169.794 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -55.21 -44.2 75.18 Favored 'General case' 0 N--CA 1.478 0.932 0 O-C-N 120.76 -1.213 . . . . 0.0 112.797 -176.261 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 12.8 tt0 -69.7 -42.92 73.41 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 123.552 0.741 . . . . 0.0 111.19 176.187 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 83.9 mt-30 -63.71 -39.0 93.2 Favored 'General case' 0 CA--C 1.536 0.42 0 O-C-N 121.659 -0.65 . . . . 0.0 112.12 179.183 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -61.21 -40.11 92.77 Favored 'General case' 0 N--CA 1.468 0.475 0 O-C-N 121.06 -1.025 . . . . 0.0 110.903 173.719 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 51.6 mt -69.62 -39.51 78.36 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 CA-C-O 117.789 -1.101 . . . . 0.0 111.704 175.817 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 47.3 mt -64.03 -43.28 97.53 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.947 0 CA-C-N 121.01 1.732 . . . . 0.0 110.285 176.814 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -59.5 -47.49 85.3 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.056 0.943 . . . . 0.0 110.885 176.795 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -69.44 -49.17 57.51 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 124.335 1.054 . . . . 0.0 112.86 -179.714 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -64.29 -23.14 67.19 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-N 118.91 0.777 . . . . 0.0 112.96 -176.646 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.445 ' CE2' HG22 ' A' ' 55' ' ' ILE . 1.4 t80 -69.4 -59.55 2.92 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 124.206 1.002 . . . . 0.0 110.72 174.309 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 50.5 mt -60.74 -34.28 58.37 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.436 0 C-N-CA 125.309 1.444 . . . . 0.0 111.492 176.95 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -67.07 -21.04 65.91 Favored 'General case' 0 CA--C 1.546 0.807 0 O-C-N 121.269 -0.895 . . . . 0.0 113.271 176.379 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -98.03 -31.27 12.23 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 124.748 1.219 . . . . 0.0 113.309 178.308 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 5.9 m -122.36 -19.21 4.36 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 N-CA-C 114.139 1.163 . . . . 0.0 114.139 -173.857 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 83.43 147.1 7.21 Favored Glycine 0 CA--C 1.532 1.096 0 C-N-CA 124.964 1.269 . . . . 0.0 112.864 -172.128 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 12.3 tp -61.63 -13.25 20.66 Favored 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 125.244 1.418 . . . . 0.0 113.81 -175.05 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 7.6 pt20 -87.8 -16.26 34.62 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 127.143 2.177 . . . . 0.0 114.134 179.437 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 76.1 m-80 -111.15 -11.66 14.22 Favored 'General case' 0 N--CA 1.476 0.858 0 N-CA-C 114.513 1.301 . . . . 0.0 114.513 -178.138 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' ILE . . . . . 0.445 HG22 ' CE2' ' A' ' 46' ' ' TYR . 43.8 pt -67.92 156.87 6.64 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.614 0 C-N-CA 123.83 0.852 . . . . 0.0 111.722 168.856 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.2 p -131.21 142.24 50.15 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 125.704 1.602 . . . . 0.0 109.645 174.215 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -63.17 -25.81 68.52 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 123.769 0.828 . . . . 0.0 112.27 177.573 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.9 mp -63.29 -49.61 82.31 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 C-N-CA 125.124 1.37 . . . . 0.0 109.601 173.055 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 97.2 m -75.26 -41.7 56.77 Favored 'General case' 0 C--O 1.224 -0.289 0 C-N-CA 123.929 0.892 . . . . 0.0 110.749 -177.846 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.9 tt -67.03 -32.63 73.97 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 124.627 1.171 . . . . 0.0 111.954 177.825 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.453 ' HA ' HG13 ' A' ' 66' ' ' ILE . 44.5 t -53.98 -33.33 56.73 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 124.791 1.236 . . . . 0.0 113.034 165.455 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -97.87 -22.79 16.16 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 125.071 1.348 . . . . 0.0 113.667 -175.166 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 7.9 mmtm -69.04 -37.95 78.86 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 124.792 1.237 . . . . 0.0 111.386 175.924 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.4 mp -107.52 -0.98 21.76 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 125.14 1.376 . . . . 0.0 114.057 -175.577 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 16.7 m-80 57.89 48.13 14.03 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 126.133 1.773 . . . . 0.0 112.603 -175.041 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.453 HG13 ' HA ' ' A' ' 61' ' ' SER . 15.3 pt -111.98 -159.19 0.14 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.632 0 C-N-CA 125.964 1.706 . . . . 0.0 110.992 -177.078 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 44.6 p -100.79 161.04 13.87 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 124.649 1.179 . . . . 0.0 111.323 168.084 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 59.6 t -61.59 -24.31 33.47 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 O-C-N 121.58 -0.7 . . . . 0.0 111.059 169.34 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -78.18 -37.02 46.73 Favored 'General case' 0 C--O 1.232 0.166 0 O-C-N 120.901 -1.124 . . . . 0.0 110.246 -178.15 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 33.5 mttm -64.71 -52.86 54.91 Favored 'General case' 0 C--N 1.347 0.498 0 CA-C-N 118.888 0.767 . . . . 0.0 110.568 167.395 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -58.99 -37.55 77.11 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.012 0.925 . . . . 0.0 112.773 -172.13 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 23.7 ttmm -77.57 -31.02 52.88 Favored 'General case' 0 CA--C 1.522 -0.123 0 C-N-CA 125.444 1.498 . . . . 0.0 111.889 177.777 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -57.09 -42.38 80.6 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 119.037 0.835 . . . . 0.0 111.531 179.596 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 39.3 m-85 -61.93 -51.5 67.88 Favored 'General case' 0 C--O 1.222 -0.389 0 C-N-CA 124.451 1.101 . . . . 0.0 109.641 178.481 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 71.3 mt -62.27 -25.07 36.69 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.875 0 C-N-CA 124.475 1.11 . . . . 0.0 111.517 -179.363 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 13.1 tppt? -87.48 -27.29 22.75 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 126.498 1.919 . . . . 0.0 113.28 -179.385 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 31.6 p30 . . . . . 0 CA--C 1.546 0.825 0 CA-C-N 119.897 1.226 . . . . 0.0 113.401 177.88 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 . . . . . 0 CA--C 1.541 0.623 0 CA-C-O 120.889 0.376 . . . . 0.0 110.302 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -133.62 65.22 1.59 Allowed 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 125.096 1.358 . . . . 0.0 111.307 -173.933 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 94.6 t -132.28 143.68 39.24 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.687 0 C-N-CA 125.061 1.344 . . . . 0.0 111.227 -179.569 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 82.8 p -147.4 -53.64 0.21 Allowed 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 173.138 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 22.6 t -149.99 113.32 4.93 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 124.634 1.173 . . . . 0.0 111.322 177.33 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 54.2 mtt 55.0 24.39 5.91 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 126.041 1.737 . . . . 0.0 115.145 -178.089 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 -82.62 67.48 8.69 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 125.33 1.452 . . . . 0.0 111.329 179.291 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -140.12 159.58 41.87 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 125.391 1.476 . . . . 0.0 112.6 -178.217 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 98.4 mttt . . . . . 0 N--CA 1.478 0.945 0 C-N-CA 125.92 1.688 . . . . 0.0 111.993 177.901 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.546 0.792 0 CA-C-O 122.37 1.081 . . . . 0.0 111.802 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 59.6 m-20 47.15 70.71 1.92 Allowed Pre-proline 0 CA--C 1.551 1.007 0 C-N-CA 127.006 2.122 . . . . 0.0 114.59 171.828 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 88.8 Cg_endo -69.35 0.39 5.4 Favored 'Trans proline' 0 CA--C 1.542 0.893 0 C-N-CA 124.21 3.274 . . . . 0.0 115.455 -173.634 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -134.93 33.14 3.17 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 126.408 1.883 . . . . 0.0 113.626 -178.65 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -99.58 -2.08 36.59 Favored 'General case' 0 N--CA 1.477 0.898 0 N-CA-C 114.407 1.262 . . . . 0.0 114.407 172.855 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -131.5 -60.78 0.93 Allowed 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 124.782 1.233 . . . . 0.0 113.458 -160.361 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.8 pp -106.45 9.66 9.35 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 C-N-CA 125.609 1.564 . . . . 0.0 112.937 -178.55 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 19.2 tt -46.11 129.06 2.45 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 124.632 1.173 . . . . 0.0 112.854 175.967 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -151.48 49.67 0.82 Allowed 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 125.683 1.593 . . . . 0.0 109.935 -179.646 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -115.71 15.56 16.46 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 124.347 1.059 . . . . 0.0 112.84 -170.378 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 15.9 tt -159.23 40.25 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 C-N-CA 126.692 1.997 . . . . 0.0 112.272 -175.815 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 87.0 tttt . . . . . 0 N--CA 1.476 0.85 0 N-CA-C 115.914 1.82 . . . . 0.0 115.914 -170.574 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 62.8 mt . . . . . 0 N--CA 1.471 0.616 0 CA-C-O 120.932 0.396 . . . . 0.0 112.015 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 66.0 m -71.33 164.3 26.01 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 123.295 0.638 . . . . 0.0 110.491 170.889 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -56.6 -44.72 81.4 Favored 'General case' 0 N--CA 1.477 0.901 0 O-C-N 120.633 -1.292 . . . . 0.0 112.974 -174.669 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 10.7 tt0 -68.82 -43.1 76.24 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 123.763 0.825 . . . . 0.0 110.989 175.752 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 85.0 mt-30 -61.13 -42.44 98.54 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 122.914 0.486 . . . . 0.0 111.968 178.349 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 40.1 ttmt -59.94 -39.07 84.26 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 124.073 0.949 . . . . 0.0 111.232 176.139 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 45.2 mt -68.26 -41.83 84.1 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 CA-C-O 118.121 -0.942 . . . . 0.0 111.386 174.386 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 48.3 mt -64.3 -44.66 97.32 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.982 0 CA-C-N 120.777 1.626 . . . . 0.0 110.48 178.555 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -56.02 -49.41 73.75 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 124.799 1.24 . . . . 0.0 110.195 176.54 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -65.52 -52.34 53.37 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.177 0.991 . . . . 0.0 113.024 178.185 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 19.6 mm-40 -62.24 -26.95 68.66 Favored 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 112.925 0.713 . . . . 0.0 112.925 -179.137 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -70.38 -55.28 9.48 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 123.576 0.751 . . . . 0.0 111.126 175.875 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 44.6 mt -60.57 -35.11 61.24 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.553 0 C-N-CA 124.958 1.303 . . . . 0.0 111.48 175.571 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -68.51 -21.46 64.58 Favored 'General case' 0 CA--C 1.545 0.765 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 176.761 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -95.92 -30.2 13.76 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.666 1.187 . . . . 0.0 113.029 178.963 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 6.0 m -122.27 -25.21 2.3 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.003 0 CA-C-N 119.651 1.114 . . . . 0.0 113.946 -173.966 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 94.07 142.38 12.19 Favored Glycine 0 CA--C 1.533 1.21 0 C-N-CA 125.303 1.43 . . . . 0.0 113.213 -172.694 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 55.0 tp -60.03 -16.85 34.43 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 127.046 2.139 . . . . 0.0 115.503 -171.879 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 7.9 pm0 -99.05 -10.15 22.97 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 127.732 2.413 . . . . 0.0 113.825 179.74 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 80.9 m-20 -107.18 -14.29 14.94 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.86 1.264 . . . . 0.0 114.111 178.907 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 26.5 pt -63.27 157.14 4.39 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 C-N-CA 123.267 0.627 . . . . 0.0 111.276 164.679 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -130.09 145.93 51.72 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.523 1.129 . . . . 0.0 110.035 175.28 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -61.73 -26.82 68.29 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 123.773 0.829 . . . . 0.0 112.271 177.288 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.9 mp -69.99 -40.08 78.18 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.454 0 C-N-CA 125.993 1.717 . . . . 0.0 110.519 175.857 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 90.8 m -80.78 -41.31 23.63 Favored 'General case' 0 C--O 1.223 -0.292 0 O-C-N 121.64 -0.663 . . . . 0.0 109.522 179.209 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 17.0 tp -64.77 -35.65 81.78 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 125.014 1.326 . . . . 0.0 111.946 177.026 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.441 ' HA ' HG13 ' A' ' 66' ' ' ILE . 60.2 p -60.38 -24.62 65.26 Favored 'General case' 0 N--CA 1.476 0.841 0 CA-C-N 118.893 0.77 . . . . 0.0 113.006 170.449 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -100.94 -31.03 11.32 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 125.3 1.44 . . . . 0.0 114.107 -177.119 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 54.9 mmtt -63.76 -34.51 78.06 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 125.331 1.452 . . . . 0.0 111.582 177.875 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.4 mp -117.67 4.23 12.33 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 124.987 1.315 . . . . 0.0 114.415 -175.165 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 21.6 m-80 57.58 60.96 2.62 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 126.276 1.831 . . . . 0.0 113.375 -178.591 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.441 HG13 ' HA ' ' A' ' 61' ' ' SER . 1.1 pt -133.48 174.8 12.64 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.843 0 C-N-CA 126.771 2.028 . . . . 0.0 111.946 -171.536 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.3 p -76.72 157.9 31.36 Favored 'General case' 0 N--CA 1.478 0.945 0 O-C-N 121.096 -1.003 . . . . 0.0 111.352 173.082 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 89.5 t -62.92 -28.47 45.09 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 CA-C-O 118.838 -0.601 . . . . 0.0 111.421 173.637 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 65.3 mm-40 -81.75 -36.62 28.34 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 120.307 1.412 . . . . 0.0 110.825 -178.872 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 5.2 tmtm? -62.6 -44.67 95.73 Favored 'General case' 0 N--CA 1.464 0.268 0 C-N-CA 125.456 1.503 . . . . 0.0 110.348 175.249 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -66.25 -48.74 69.51 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.989 1.716 . . . . 0.0 112.757 173.927 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -71.12 -27.95 63.95 Favored 'General case' 0 CA--C 1.515 -0.376 0 O-C-N 120.976 -1.077 . . . . 0.0 111.673 -173.388 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -60.59 -36.6 78.93 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 119.929 -0.708 . . . . 0.0 111.306 178.029 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 23.9 m-85 -61.28 -41.22 96.6 Favored 'General case' 0 N--CA 1.463 0.2 0 O-C-N 121.312 -0.867 . . . . 0.0 111.742 174.063 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 61.1 mt -70.44 -29.12 37.51 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.643 0 C-N-CA 124.683 1.193 . . . . 0.0 110.903 179.598 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 7.3 tptm -76.49 -35.16 58.54 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 125.169 1.388 . . . . 0.0 111.862 174.707 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 96.0 m-20 . . . . . 0 N--CA 1.462 0.153 0 C-N-CA 126.405 1.882 . . . . 0.0 110.338 -172.775 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 . . . . . 0 CA--C 1.543 0.701 0 N-CA-C 111.403 0.149 . . . . 0.0 111.403 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 54.18 65.82 1.4 Allowed 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 126.094 1.758 . . . . 0.0 113.594 -179.225 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 21.0 t -130.17 72.49 0.43 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 C-N-CA 125.166 1.387 . . . . 0.0 110.428 179.272 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 45.4 t -163.82 -68.32 0.04 OUTLIER 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.766 0.826 . . . . 0.0 113.013 172.638 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 17.1 t -74.05 -31.92 63.09 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 123.611 0.765 . . . . 0.0 112.786 -175.403 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 97.2 mtp -127.29 137.25 52.8 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 125.949 1.7 . . . . 0.0 109.556 169.524 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 17.7 tt0 -153.85 41.66 0.52 Allowed 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 124.616 1.166 . . . . 0.0 111.046 -177.317 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 52.41 -141.87 0.8 Allowed 'General case' 0 CA--C 1.552 1.045 0 C-N-CA 125.233 1.413 . . . . 0.0 112.253 -165.694 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 66.9 mttm . . . . . 0 N--CA 1.476 0.838 0 C-N-CA 125.777 1.631 . . . . 0.0 111.512 177.294 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 16.9 ttt . . . . . 0 CA--C 1.548 0.894 0 N-CA-C 112.716 0.636 . . . . 0.0 112.716 . . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 11.6 t0 -138.97 121.68 10.56 Favored Pre-proline 0 CA--C 1.55 0.981 0 O-C-N 120.626 -1.296 . . . . 0.0 112.344 -170.053 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_endo -83.83 -2.32 10.26 Favored 'Trans proline' 0 C--N 1.352 0.726 0 C-N-CA 123.768 2.979 . . . . 0.0 114.971 179.054 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 75.7 mt -107.54 41.59 1.48 Allowed 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.867 1.667 . . . . 0.0 112.173 -176.82 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -106.91 0.83 24.13 Favored 'General case' 0 N--CA 1.476 0.873 0 N-CA-C 114.779 1.4 . . . . 0.0 114.779 178.345 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -120.05 -56.87 1.98 Allowed 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 124.396 1.079 . . . . 0.0 113.328 -167.975 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.0 pp -129.1 14.7 2.67 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.925 0 C-N-CA 126.176 1.791 . . . . 0.0 112.988 -171.888 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 14.1 tt -41.08 130.4 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.917 0 C-N-CA 125.496 1.518 . . . . 0.0 112.851 177.824 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 35.3 t30 -141.71 0.63 1.45 Allowed 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 115.332 1.604 . . . . 0.0 115.332 -176.881 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -85.1 11.25 10.08 Favored 'General case' 0 CA--C 1.546 0.805 0 N-CA-C 114.601 1.334 . . . . 0.0 114.601 -173.777 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 13.5 tt -147.97 27.17 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.913 0 C-N-CA 125.533 1.533 . . . . 0.0 113.694 -170.989 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 58.5 mtmt . . . . . 0 N--CA 1.477 0.909 0 N-CA-C 115.311 1.597 . . . . 0.0 115.311 179.392 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.9 mt . . . . . 0 CA--C 1.545 0.751 0 N-CA-C 109.227 -0.657 . . . . 0.0 109.227 . . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 23.3 t -71.95 163.46 27.81 Favored 'General case' 0 N--CA 1.48 1.052 0 O-C-N 121.878 -0.514 . . . . 0.0 110.26 170.253 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -56.26 -45.48 80.05 Favored 'General case' 0 N--CA 1.477 0.924 0 O-C-N 120.257 -1.527 . . . . 0.0 112.863 -174.175 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 9.4 tt0 -71.18 -43.15 68.03 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 123.526 0.73 . . . . 0.0 111.553 175.675 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 89.3 mt-30 -61.29 -38.28 86.21 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 123.302 0.641 . . . . 0.0 111.885 178.587 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 41.2 ttmt -62.91 -44.23 96.65 Favored 'General case' 0 N--CA 1.464 0.249 0 C-N-CA 124.86 1.264 . . . . 0.0 110.731 175.732 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 49.8 mt -65.65 -43.97 93.7 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 CA-C-O 118.45 -0.786 . . . . 0.0 110.924 177.117 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 52.6 mt -63.97 -46.44 94.01 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 CA-C-N 120.078 1.308 . . . . 0.0 110.299 179.296 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -59.04 -48.9 79.91 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 125.14 1.376 . . . . 0.0 110.931 178.263 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -63.82 -53.04 56.98 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 124.954 1.301 . . . . 0.0 112.185 177.096 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 17.0 mm-40 -60.13 -30.45 69.3 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 119.088 0.858 . . . . 0.0 112.5 179.476 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.404 ' CD2' ' HE2' ' A' ' 63' ' ' LYS . 1.4 t80 -66.2 -58.83 4.53 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 118.988 0.813 . . . . 0.0 110.705 175.592 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 70.6 mt -62.72 -35.02 68.72 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.329 0 C-N-CA 126.573 1.949 . . . . 0.0 111.622 179.884 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -74.65 -29.42 61.25 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.05 0.94 . . . . 0.0 112.415 178.98 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -82.69 -40.0 21.23 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.778 0.831 . . . . 0.0 112.183 174.621 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.8 m -104.15 -12.55 9.15 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.086 0 N-CA-C 114.386 1.254 . . . . 0.0 114.386 -173.612 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 91.59 27.85 16.16 Favored Glycine 0 CA--C 1.534 1.253 0 C-N-CA 125.108 1.337 . . . . 0.0 115.805 164.589 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 56.13 9.08 0.45 Allowed 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 127.427 2.291 . . . . 0.0 115.027 -173.9 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 2.5 pt20 -117.92 -7.96 10.84 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 125.798 1.639 . . . . 0.0 113.435 -167.087 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 67.3 m-80 -123.28 -1.4 8.68 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 125.094 1.358 . . . . 0.0 113.305 178.339 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 21.7 pt -72.16 150.39 8.7 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 CA-C-O 121.016 0.436 . . . . 0.0 111.417 177.734 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -138.04 143.61 40.62 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 124.448 1.099 . . . . 0.0 109.398 177.687 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -61.39 -26.62 67.97 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 118.787 0.722 . . . . 0.0 112.468 -179.418 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -66.96 -42.99 89.48 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 C-N-CA 125.654 1.582 . . . . 0.0 110.548 174.601 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 81.6 m -79.77 -46.46 16.94 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 123.681 0.793 . . . . 0.0 109.192 -177.466 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 17.3 tp -62.59 -34.69 77.5 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.561 1.544 . . . . 0.0 112.511 177.563 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.455 ' HA ' HG13 ' A' ' 66' ' ' ILE . 60.2 p -61.95 -25.2 67.46 Favored 'General case' 0 N--CA 1.475 0.81 0 N-CA-C 113.222 0.823 . . . . 0.0 113.222 171.667 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -101.55 -24.67 14.1 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 125.434 1.493 . . . . 0.0 114.115 -178.112 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.404 ' HE2' ' CD2' ' A' ' 46' ' ' TYR . 21.0 mmmt -65.74 -34.87 79.19 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.9 1.28 . . . . 0.0 111.497 172.82 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 49.6 mt -115.91 -1.1 12.64 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 125.931 1.692 . . . . 0.0 113.52 -169.319 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 26.7 m-80 57.0 61.63 2.52 Favored 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 126.683 1.993 . . . . 0.0 113.542 -177.342 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.455 HG13 ' HA ' ' A' ' 61' ' ' SER . 0.6 OUTLIER -136.17 178.18 5.4 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 C-N-CA 127.118 2.167 . . . . 0.0 111.548 -171.838 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -78.25 159.13 28.67 Favored 'General case' 0 N--CA 1.478 0.975 0 O-C-N 121.047 -1.033 . . . . 0.0 111.392 172.266 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 98.6 t -63.49 -31.44 52.91 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.955 0 O-C-N 121.605 -0.685 . . . . 0.0 111.187 172.808 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -78.4 -35.95 46.44 Favored 'General case' 0 N--CA 1.471 0.584 0 O-C-N 120.895 -1.128 . . . . 0.0 110.065 -177.353 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 5.4 tmtm? -65.24 -49.96 67.65 Favored 'General case' 0 C--O 1.223 -0.292 0 C-N-CA 125.316 1.447 . . . . 0.0 110.379 174.255 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -58.53 -42.9 88.81 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 125.036 1.334 . . . . 0.0 112.605 174.23 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 34.5 ttmt -71.73 -28.13 63.46 Favored 'General case' 0 CA--C 1.519 -0.219 0 CA-C-O 118.076 -0.964 . . . . 0.0 111.577 -176.586 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -50.58 -44.6 56.89 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 118.973 0.806 . . . . 0.0 111.145 175.849 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 40.3 m-85 -65.54 -38.1 88.63 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.815 0.846 . . . . 0.0 110.782 -177.191 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 35.5 mt -69.39 -27.63 35.13 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.674 0 C-N-CA 124.916 1.286 . . . . 0.0 110.724 176.967 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 45.1 mttt -79.11 -31.88 44.35 Favored 'General case' 0 N--CA 1.47 0.563 0 O-C-N 120.393 -1.442 . . . . 0.0 114.553 176.51 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 24.7 p30 . . . . . 0 N--CA 1.471 0.625 0 CA-C-N 119.844 1.202 . . . . 0.0 112.351 -176.155 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 2.7 pp20? . . . . . 0 N--CA 1.474 0.774 0 N-CA-C 112.234 0.457 . . . . 0.0 112.234 . . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -147.12 57.12 1.14 Allowed 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 124.155 0.982 . . . . 0.0 111.939 175.617 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 26.5 t -134.87 133.54 53.85 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.94 0 C-N-CA 124.126 0.97 . . . . 0.0 112.14 -179.361 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 9.2 t -114.38 78.37 1.15 Allowed 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 125.015 1.326 . . . . 0.0 111.294 177.025 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 6.1 t 47.37 74.52 0.16 Allowed 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 126.848 2.059 . . . . 0.0 114.364 175.821 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 91.4 mtp 54.21 61.74 2.9 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 125.743 1.617 . . . . 0.0 113.485 -176.032 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -79.05 47.31 0.76 Allowed 'General case' 0 CA--C 1.553 1.07 0 C-N-CA 125.126 1.371 . . . . 0.0 112.037 174.808 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -147.74 155.73 42.01 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 126.165 1.786 . . . . 0.0 112.02 -176.213 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 36.6 mtmm . . . . . 0 N--CA 1.475 0.819 0 C-N-CA 125.397 1.479 . . . . 0.0 111.002 -176.976 . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 83.6 mtp . . . . . 0 N--CA 1.475 0.803 0 CA-C-O 121.749 0.785 . . . . 0.0 111.175 . . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -119.99 148.25 46.31 Favored Pre-proline 0 CA--C 1.545 0.758 0 C-N-CA 125.552 1.541 . . . . 0.0 112.194 -170.852 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -69.24 -19.08 39.08 Favored 'Trans proline' 0 C--N 1.35 0.632 0 C-N-CA 123.284 2.656 . . . . 0.0 114.745 -175.04 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.44 HD23 ' H ' ' A' ' 4' ' ' LEU . 1.2 pt? -95.11 12.41 28.77 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 126.271 1.828 . . . . 0.0 114.343 -179.585 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -71.05 -8.04 50.62 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 115.189 1.551 . . . . 0.0 115.189 -176.809 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -116.72 -63.31 1.46 Allowed 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 124.796 1.238 . . . . 0.0 113.243 -163.631 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.3 pp -103.15 -18.09 6.79 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.85 0 C-N-CA 124.72 1.208 . . . . 0.0 113.053 -175.875 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . 0.287 11.3 tt 35.99 48.81 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.167 0 C-N-CA 127.301 2.24 . . . . 0.0 116.332 170.903 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -126.33 88.9 2.92 Favored 'General case' 0 CA--C 1.542 0.658 0 O-C-N 120.844 -1.16 . . . . 0.0 111.911 -177.136 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -138.17 79.98 1.77 Allowed 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.84 1.256 . . . . 0.0 110.813 -178.707 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . 0.358 9.5 tt 50.31 26.23 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.205 0 C-N-CA 127.708 2.403 . . . . 0.0 115.124 179.458 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 3.8 ttpt . . . . . 0 N--CA 1.473 0.679 0 C-N-CA 124.949 1.299 . . . . 0.0 114.462 -178.316 . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.4 mt . . . . . 0 CA--C 1.544 0.723 0 N-CA-C 109.898 -0.408 . . . . 0.0 109.898 . . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 67.1 m -74.3 165.09 25.77 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 123.199 0.6 . . . . 0.0 110.829 171.925 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -55.06 -43.99 74.35 Favored 'General case' 0 N--CA 1.48 1.037 0 O-C-N 120.665 -1.272 . . . . 0.0 113.54 -172.983 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 8.5 pt20 -77.82 -35.21 51.5 Favored 'General case' 0 N--CA 1.472 0.625 0 O-C-N 121.56 -0.713 . . . . 0.0 112.547 174.802 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 84.6 mt-30 -65.17 -38.47 90.63 Favored 'General case' 0 N--CA 1.466 0.369 0 O-C-N 121.616 -0.678 . . . . 0.0 111.397 178.961 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 23.4 ttmm -58.99 -42.34 89.78 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 124.555 1.142 . . . . 0.0 110.879 175.173 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 41.0 mt -71.01 -42.3 76.86 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.557 0 CA-C-O 118.265 -0.874 . . . . 0.0 110.977 178.818 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 43.3 mt -63.13 -44.34 99.38 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 CA-C-N 120.412 1.46 . . . . 0.0 110.215 177.246 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -59.0 -49.11 79.15 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 125.12 1.368 . . . . 0.0 110.897 178.069 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -63.25 -52.83 60.51 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 124.858 1.263 . . . . 0.0 112.435 176.374 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -58.52 -31.48 67.94 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-N 119.28 0.945 . . . . 0.0 112.771 179.205 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.432 ' CE2' HG22 ' A' ' 55' ' ' ILE . 1.2 t80 -66.83 -58.44 5.04 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 118.794 0.725 . . . . 0.0 110.593 177.296 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 72.3 mt -65.82 -33.48 63.89 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.442 0 C-N-CA 126.323 1.849 . . . . 0.0 111.615 -178.638 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -72.41 -26.83 62.01 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 123.693 0.797 . . . . 0.0 112.294 177.733 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -86.21 -40.88 15.14 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.039 0.935 . . . . 0.0 112.096 174.939 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.2 m -108.4 -5.57 10.7 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.241 0 N-CA-C 114.552 1.315 . . . . 0.0 114.552 -171.918 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 86.72 26.94 30.76 Favored Glycine 0 CA--C 1.532 1.1 0 C-N-CA 124.711 1.148 . . . . 0.0 115.519 160.543 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 55.99 10.11 0.55 Allowed 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 127.479 2.312 . . . . 0.0 115.322 -173.991 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 5.1 pt20 -123.18 -3.7 8.49 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 124.946 1.298 . . . . 0.0 113.694 -168.948 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 58.8 m-80 -122.43 0.88 9.52 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 124.995 1.318 . . . . 0.0 113.191 174.638 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 55' ' ' ILE . . . . . 0.432 HG22 ' CE2' ' A' ' 46' ' ' TYR . 18.0 pt -76.97 154.25 5.59 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 C-N-CA 123.039 0.535 . . . . 0.0 111.593 175.963 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -139.82 143.65 36.93 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 124.805 1.242 . . . . 0.0 109.634 179.623 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -60.65 -27.09 67.54 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 118.871 0.76 . . . . 0.0 112.379 179.698 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -67.14 -48.45 78.71 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.463 0 C-N-CA 125.644 1.577 . . . . 0.0 110.194 175.574 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 76.9 m -78.33 -43.65 27.25 Favored 'General case' 0 C--O 1.224 -0.257 0 C-N-CA 123.477 0.711 . . . . 0.0 109.97 -176.659 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 18.6 tp -60.17 -34.58 73.78 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 125.375 1.47 . . . . 0.0 112.082 173.713 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.55 ' HA ' HG13 ' A' ' 66' ' ' ILE . 35.1 t -52.92 -36.14 59.24 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 124.363 1.065 . . . . 0.0 112.571 168.527 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -100.66 -22.82 14.8 Favored 'General case' 0 CA--C 1.533 0.299 0 N-CA-C 114.405 1.261 . . . . 0.0 114.405 -173.088 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 66.6 mmtt -63.99 -34.64 78.46 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 124.721 1.208 . . . . 0.0 111.947 174.953 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.5 mp -117.72 2.67 12.29 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 124.866 1.266 . . . . 0.0 114.076 -174.781 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 12.9 m-80 56.57 46.4 20.52 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 125.613 1.565 . . . . 0.0 112.763 -172.917 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.55 HG13 ' HA ' ' A' ' 61' ' ' SER . 9.9 pt -105.15 -171.99 0.36 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.619 0 C-N-CA 125.913 1.685 . . . . 0.0 111.11 -179.953 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -89.33 158.16 17.91 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 123.523 0.729 . . . . 0.0 110.41 170.081 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 49.7 t -59.1 -31.23 45.41 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.119 0 O-C-N 121.595 -0.69 . . . . 0.0 111.422 170.059 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -80.41 -35.95 34.44 Favored 'General case' 0 CA--C 1.53 0.211 0 O-C-N 121.139 -0.976 . . . . 0.0 110.184 -177.111 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 26.0 tttt -65.97 -44.71 84.14 Favored 'General case' 0 C--N 1.344 0.341 0 C-N-CA 123.393 0.677 . . . . 0.0 110.731 174.06 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -58.51 -49.56 76.95 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.673 1.589 . . . . 0.0 112.35 173.923 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 35.0 ttmt -68.88 -30.0 68.41 Favored 'General case' 0 N--CA 1.463 0.18 0 O-C-N 121.11 -0.994 . . . . 0.0 111.195 -177.152 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -56.15 -37.28 69.29 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 122.97 0.508 . . . . 0.0 112.362 175.311 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 48.6 m-85 -68.55 -45.13 72.96 Favored 'General case' 0 N--CA 1.463 0.218 0 C-N-CA 125.482 1.513 . . . . 0.0 110.609 176.092 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 79.7 mt -64.33 -31.53 53.88 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 C-N-CA 124.961 1.304 . . . . 0.0 111.35 -179.535 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 47.9 mtmt -81.81 -33.65 30.66 Favored 'General case' 0 N--CA 1.469 0.521 0 N-CA-C 113.875 1.065 . . . . 0.0 113.875 -178.188 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 5.7 p30 . . . . . 0 N--CA 1.465 0.322 0 CA-C-N 119.417 1.008 . . . . 0.0 111.31 173.944 . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 . . . . . 0 CA--C 1.543 0.699 0 N-CA-C 112.331 0.493 . . . . 0.0 112.331 . . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 57.91 49.98 11.07 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 125.498 1.519 . . . . 0.0 114.41 179.671 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 45.3 t -130.27 137.52 56.14 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.743 0 C-N-CA 125.383 1.473 . . . . 0.0 110.546 176.066 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 13.7 t -136.81 -44.13 0.58 Allowed 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 123.829 0.851 . . . . 0.0 113.131 174.71 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 21.1 t -147.42 103.36 3.55 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.048 0.939 . . . . 0.0 111.826 175.101 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 24.8 mmt 52.13 31.92 9.73 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 126.04 1.736 . . . . 0.0 114.8 178.99 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 11.7 mt-10 -83.4 48.68 1.44 Allowed 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 125.657 1.583 . . . . 0.0 113.221 -176.227 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -119.23 155.44 31.71 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 126.642 1.977 . . . . 0.0 111.787 177.35 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 8.8 mptt . . . . . 0 N--CA 1.477 0.896 0 C-N-CA 125.091 1.357 . . . . 0.0 110.667 -178.963 . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 77.6 mtm . . . . . 0 N--CA 1.474 0.77 0 CA-C-O 121.308 0.575 . . . . 0.0 112.184 . . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -128.84 75.04 80.49 Favored Pre-proline 0 CA--C 1.551 0.986 0 C-N-CA 124.981 1.312 . . . . 0.0 112.049 176.79 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 80.3 Cg_endo -78.9 -3.83 13.51 Favored 'Trans proline' 0 C--N 1.352 0.735 0 C-N-CA 123.973 3.115 . . . . 0.0 114.909 -179.834 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 94.1 mt -108.76 41.34 1.61 Allowed 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 126.279 1.832 . . . . 0.0 112.167 -177.261 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -107.14 -5.04 18.24 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 114.472 1.286 . . . . 0.0 114.472 178.035 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.21 -58.29 2.15 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 124.296 1.038 . . . . 0.0 113.027 -162.508 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.1 pp -129.04 15.11 2.69 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 C-N-CA 126.615 1.966 . . . . 0.0 112.713 -174.981 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 10.2 tt -41.55 124.35 0.49 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.995 0 C-N-CA 125.413 1.485 . . . . 0.0 112.488 177.121 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -147.11 29.87 0.96 Allowed 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 124.027 0.931 . . . . 0.0 112.996 -175.113 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -106.19 11.57 31.1 Favored 'General case' 0 N--CA 1.476 0.841 0 O-C-N 120.899 -1.126 . . . . 0.0 113.553 -179.321 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 15.5 tt -150.13 36.78 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.477 0.876 0 C-N-CA 126.509 1.924 . . . . 0.0 111.799 -175.343 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 2.9 tppt? . . . . . 0 N--CA 1.478 0.935 0 N-CA-C 115.309 1.596 . . . . 0.0 115.309 -176.175 . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 6.9 mt . . . . . 0 CA--C 1.543 0.699 0 CA-C-O 120.303 0.097 . . . . 0.0 110.796 . . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 63.4 m -75.88 165.09 25.51 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 123.302 0.641 . . . . 0.0 110.528 171.628 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -55.15 -44.46 75.15 Favored 'General case' 0 N--CA 1.48 1.042 0 O-C-N 120.72 -1.237 . . . . 0.0 113.472 -173.526 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 8.9 pt20 -75.35 -36.64 60.95 Favored 'General case' 0 N--CA 1.469 0.51 0 O-C-N 121.601 -0.687 . . . . 0.0 112.486 175.306 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 76.4 mt-30 -65.75 -36.92 84.94 Favored 'General case' 0 N--CA 1.466 0.341 0 O-C-N 121.508 -0.745 . . . . 0.0 111.595 178.9 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 40.3 ttmt -61.59 -42.17 98.49 Favored 'General case' 0 N--CA 1.465 0.307 0 C-N-CA 124.405 1.082 . . . . 0.0 111.008 174.99 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 46.2 mt -69.03 -43.14 82.15 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 CA-C-O 118.449 -0.786 . . . . 0.0 111.045 176.732 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 44.0 mt -63.01 -44.25 99.54 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 CA-C-N 120.167 1.349 . . . . 0.0 110.343 178.73 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -59.53 -49.07 79.22 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.9 1.28 . . . . 0.0 110.794 176.586 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -67.42 -51.46 51.44 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 124.364 1.065 . . . . 0.0 112.799 -179.369 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 18.9 mm-40 -61.9 -24.12 66.75 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 118.968 0.804 . . . . 0.0 113.162 -178.385 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.502 ' CE2' HG22 ' A' ' 55' ' ' ILE . 1.4 t80 -70.29 -60.17 2.44 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 123.891 0.876 . . . . 0.0 110.841 174.031 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 64.7 mt -59.72 -35.15 58.24 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 C-N-CA 127.003 2.121 . . . . 0.0 111.762 177.846 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -70.86 -22.57 62.28 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 123.969 0.908 . . . . 0.0 113.116 178.143 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -94.9 -32.19 13.33 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.472 1.109 . . . . 0.0 112.731 178.013 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 4.5 m -118.57 -20.61 5.05 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.916 0 CA-C-N 119.552 1.069 . . . . 0.0 113.731 -173.461 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 83.2 141.98 4.54 Favored Glycine 0 CA--C 1.531 1.061 0 C-N-CA 124.787 1.184 . . . . 0.0 112.33 -171.312 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -66.83 -9.96 42.92 Favored 'General case' 0 N--CA 1.479 0.994 0 CA-C-O 122.721 1.248 . . . . 0.0 113.93 -171.485 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 5.6 pt20 -84.96 -11.74 54.85 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 126.268 1.827 . . . . 0.0 113.854 174.753 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 73.4 m-80 -114.35 -9.4 12.79 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 114.585 1.328 . . . . 0.0 114.585 -177.877 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 55' ' ' ILE . . . . . 0.502 HG22 ' CE2' ' A' ' 46' ' ' TYR . 21.8 pt -71.43 159.98 5.46 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 C-N-CA 123.574 0.749 . . . . 0.0 111.608 168.684 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.1 p -129.22 144.37 51.19 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 125.149 1.379 . . . . 0.0 110.014 173.805 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -63.9 -26.14 68.46 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.933 0.893 . . . . 0.0 112.169 175.875 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -63.49 -49.26 83.37 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.459 0 C-N-CA 125.291 1.436 . . . . 0.0 109.48 173.099 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 99.2 m -75.14 -43.02 54.89 Favored 'General case' 0 C--O 1.223 -0.309 0 C-N-CA 123.538 0.735 . . . . 0.0 110.156 -178.248 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 17.3 tp -62.22 -35.13 77.95 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.469 1.108 . . . . 0.0 112.093 176.23 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.47 ' HA ' HG13 ' A' ' 66' ' ' ILE . 47.2 t -53.79 -32.5 52.79 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.367 1.067 . . . . 0.0 113.015 168.349 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -100.74 -23.55 14.59 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 125.621 1.568 . . . . 0.0 114.008 -174.137 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 67.1 mmtt -66.05 -37.58 86.19 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 124.858 1.263 . . . . 0.0 111.343 173.977 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.3 mp -114.21 1.38 14.51 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 125.092 1.357 . . . . 0.0 114.256 -172.819 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 12.7 m-80 57.21 46.36 18.89 Favored 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 125.712 1.605 . . . . 0.0 112.868 -175.155 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.47 HG13 ' HA ' ' A' ' 61' ' ' SER . 7.0 pt -106.39 -166.42 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 C-N-CA 125.974 1.709 . . . . 0.0 111.537 -178.992 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -94.5 159.41 15.11 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 123.9 0.88 . . . . 0.0 110.491 167.644 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 93.8 t -60.39 -30.1 45.66 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 O-C-N 121.563 -0.711 . . . . 0.0 111.241 172.22 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -82.68 -32.52 28.06 Favored 'General case' 0 N--CA 1.465 0.287 0 O-C-N 121.049 -1.032 . . . . 0.0 110.567 -178.194 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 15.2 tttt -70.19 -41.59 73.52 Favored 'General case' 0 C--N 1.343 0.326 0 C-N-CA 123.313 0.645 . . . . 0.0 110.855 174.502 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -60.78 -47.33 86.8 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 125.56 1.544 . . . . 0.0 112.355 171.531 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 36.7 ttmt -72.78 -28.04 62.36 Favored 'General case' 0 CA--C 1.517 -0.296 0 CA-C-O 118.004 -0.998 . . . . 0.0 111.298 -173.519 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -49.72 -47.24 50.69 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 118.833 0.742 . . . . 0.0 110.408 174.272 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 18.9 m-85 -63.56 -43.19 97.75 Favored 'General case' 0 C--O 1.223 -0.326 0 C-N-CA 123.491 0.716 . . . . 0.0 110.43 -175.593 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 48.4 mt -67.92 -28.39 41.15 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.675 0 C-N-CA 125.435 1.494 . . . . 0.0 111.637 -178.773 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 28.4 mmmt -80.46 -23.41 40.23 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 125.423 1.489 . . . . 0.0 112.369 174.941 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 90.2 m-20 . . . . . 0 C--O 1.234 0.244 0 C-N-CA 126.326 1.85 . . . . 0.0 111.609 -173.502 . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 . . . . . 0 CA--C 1.542 0.671 0 N-CA-C 110.018 -0.364 . . . . 0.0 110.018 . . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -133.6 122.41 23.48 Favored 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 124.694 1.197 . . . . 0.0 110.721 -176.336 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 60.6 t -134.21 108.7 11.52 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.469 0 C-N-CA 125.375 1.47 . . . . 0.0 109.712 178.749 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 32.2 t -162.99 -79.32 0.04 OUTLIER 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 123.757 0.823 . . . . 0.0 112.126 169.014 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 42.9 m -95.3 -27.54 15.43 Favored 'General case' 0 N--CA 1.478 0.948 0 N-CA-C 114.079 1.14 . . . . 0.0 114.079 -172.588 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 65.6 mtt -137.57 110.41 7.65 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 125.419 1.488 . . . . 0.0 109.658 -179.69 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -144.52 85.98 1.8 Allowed 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 124.768 1.227 . . . . 0.0 109.145 -179.693 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -153.29 161.71 42.08 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 124.884 1.273 . . . . 0.0 112.566 -178.437 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 52.3 mmtt . . . . . 0 N--CA 1.481 1.086 0 C-N-CA 125.75 1.62 . . . . 0.0 111.88 174.24 . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 33.9 ttm . . . . . 0 CA--C 1.547 0.859 0 CA-C-O 121.349 0.595 . . . . 0.0 112.518 . . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 15.6 m-20 -126.96 156.23 74.47 Favored Pre-proline 0 CA--C 1.548 0.872 0 C-N-CA 125.691 1.597 . . . . 0.0 111.945 -177.001 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 91.7 Cg_endo -74.29 -0.25 9.4 Favored 'Trans proline' 0 CA--C 1.538 0.688 0 C-N-CA 123.468 2.778 . . . . 0.0 114.601 179.969 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 95.0 mt -117.28 36.69 4.14 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 125.878 1.671 . . . . 0.0 112.998 -175.296 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 27.9 m-20 -103.84 2.62 32.92 Favored 'General case' 0 N--CA 1.477 0.898 0 N-CA-C 114.301 1.223 . . . . 0.0 114.301 173.36 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -119.92 -57.17 1.97 Allowed 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 124.398 1.079 . . . . 0.0 113.525 -164.502 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.1 pp -131.36 16.39 1.87 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.94 0 C-N-CA 126.144 1.778 . . . . 0.0 112.869 -172.534 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 15.5 tt -42.03 -39.08 0.76 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.284 0 C-N-CA 126.156 1.782 . . . . 0.0 115.772 -177.164 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 15.9 m120 -121.54 108.38 13.54 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 125.514 1.526 . . . . 0.0 110.497 177.594 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 29.2 t0 -165.38 62.91 0.12 Allowed 'General case' 0 CA--C 1.533 0.29 0 CA-C-O 122.352 1.072 . . . . 0.0 110.655 -168.582 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 29.5 mt 50.08 59.36 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.742 0 C-N-CA 125.931 1.693 . . . . 0.0 110.626 -169.097 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.474 0.747 0 CA-C-N 114.62 -1.173 . . . . 0.0 112.064 -179.814 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 5.2 mt . . . . . 0 CA--C 1.544 0.717 0 CA-C-O 120.587 0.232 . . . . 0.0 111.104 . . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 18.3 t -73.57 165.89 24.25 Favored 'General case' 0 N--CA 1.479 0.99 0 O-C-N 121.965 -0.459 . . . . 0.0 110.396 167.54 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -59.57 -43.18 93.68 Favored 'General case' 0 CA--C 1.542 0.656 0 O-C-N 120.461 -1.399 . . . . 0.0 112.824 -173.724 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 10.2 tt0 -73.47 -41.88 62.6 Favored 'General case' 0 N--CA 1.469 0.524 0 O-C-N 121.299 -0.875 . . . . 0.0 111.43 175.743 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 30.4 mm-40 -57.06 -43.42 82.02 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 123.894 0.877 . . . . 0.0 111.032 176.637 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 40.8 ttmt -60.14 -42.31 94.57 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 124.981 1.313 . . . . 0.0 111.651 176.733 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 47.1 mt -68.88 -40.87 81.73 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 CA-C-O 118.413 -0.803 . . . . 0.0 111.053 177.535 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 43.6 mt -63.91 -44.22 97.95 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.933 0 CA-C-N 120.307 1.412 . . . . 0.0 110.385 177.705 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -59.22 -50.07 75.44 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.681 1.193 . . . . 0.0 110.396 176.105 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -65.68 -50.68 64.04 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.346 1.058 . . . . 0.0 112.93 -179.576 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.8 mm-40 -60.89 -24.38 65.92 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 118.997 0.817 . . . . 0.0 113.13 -179.145 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.435 ' CE2' HG22 ' A' ' 55' ' ' ILE . 1.7 t80 -73.23 -58.17 3.5 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 123.714 0.806 . . . . 0.0 111.31 175.865 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 15.3 mt -59.91 -33.79 53.91 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.583 0 C-N-CA 125.903 1.681 . . . . 0.0 111.629 175.815 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -69.78 -22.4 63.34 Favored 'General case' 0 CA--C 1.545 0.771 0 O-C-N 121.267 -0.895 . . . . 0.0 113.293 175.372 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -93.76 -32.96 13.78 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 124.526 1.13 . . . . 0.0 112.732 178.539 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 10.5 m -120.15 -19.68 5.04 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.911 0 N-CA-C 114.005 1.113 . . . . 0.0 114.005 -174.094 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 83.58 142.56 5.02 Favored Glycine 0 CA--C 1.531 1.052 0 C-N-CA 124.802 1.192 . . . . 0.0 112.145 -171.486 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 2.2 tt -65.48 -11.19 40.94 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 114.928 1.455 . . . . 0.0 114.928 -170.219 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 38.8 mt-30 -80.18 -20.69 44.19 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.672 1.589 . . . . 0.0 112.921 174.813 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 69.5 m-80 -109.63 -7.07 15.16 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 114.4 1.259 . . . . 0.0 114.4 -171.793 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 55' ' ' ILE . . . . . 0.435 HG22 ' CE2' ' A' ' 46' ' ' TYR . 16.5 pt -71.85 160.67 5.15 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 C-N-CA 123.676 0.791 . . . . 0.0 111.492 166.689 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.1 p -130.81 144.77 51.69 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 125.357 1.463 . . . . 0.0 109.991 173.923 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -62.98 -27.83 69.68 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 123.935 0.894 . . . . 0.0 112.239 176.679 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -62.83 -52.04 64.44 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.313 0 C-N-CA 125.41 1.484 . . . . 0.0 109.144 174.043 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 58.6 m -73.83 -42.89 60.22 Favored 'General case' 0 C--O 1.223 -0.303 0 C-N-CA 123.357 0.663 . . . . 0.0 110.442 -177.968 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 18.4 tp -59.79 -35.31 74.41 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.413 1.085 . . . . 0.0 111.996 174.819 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.489 ' HA ' HG13 ' A' ' 66' ' ' ILE . 47.7 t -55.39 -34.37 64.3 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 124.132 0.973 . . . . 0.0 113.124 170.156 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.1 -22.41 16.24 Favored 'General case' 0 CA--C 1.534 0.362 0 N-CA-C 114.533 1.308 . . . . 0.0 114.533 -177.448 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 68.0 mmtt -64.1 -38.44 91.06 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 119.508 1.049 . . . . 0.0 111.154 173.744 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.2 mp -112.34 -0.2 15.48 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 125.315 1.446 . . . . 0.0 114.363 -173.162 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 48.8 m-80 54.39 47.84 21.99 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 125.459 1.504 . . . . 0.0 112.84 -172.569 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.489 HG13 ' HA ' ' A' ' 61' ' ' SER . 8.2 pt -104.35 -162.63 0.14 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.766 0 C-N-CA 126.456 1.902 . . . . 0.0 110.849 178.72 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -100.2 159.22 15.28 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 124.364 1.066 . . . . 0.0 110.4 167.701 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 67.7 t -60.96 -29.18 45.06 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.958 0 O-C-N 121.634 -0.666 . . . . 0.0 111.26 172.425 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 85.6 mt-10 -80.16 -34.11 37.88 Favored 'General case' 0 N--CA 1.466 0.357 0 O-C-N 120.953 -1.092 . . . . 0.0 110.092 -178.766 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 13.5 tttp -69.7 -44.38 70.52 Favored 'General case' 0 C--N 1.345 0.378 0 C-N-CA 124.287 1.035 . . . . 0.0 110.344 175.984 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -59.85 -46.75 88.3 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 125.843 1.657 . . . . 0.0 112.688 173.293 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 38.8 ttmt -75.28 -25.12 57.71 Favored 'General case' 0 CA--C 1.518 -0.28 0 C-N-CA 124.099 0.96 . . . . 0.0 111.799 -172.42 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -52.79 -50.11 64.24 Favored 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 118.138 0.426 . . . . 0.0 110.47 171.597 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 19.0 m-85 -62.15 -39.16 91.67 Favored 'General case' 0 C--N 1.34 0.183 0 C-N-CA 124.113 0.965 . . . . 0.0 111.319 -175.847 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 73.8 mt -68.04 -37.78 78.79 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.409 0 C-N-CA 123.956 0.902 . . . . 0.0 110.122 179.4 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 15.8 ttmt -73.0 -40.42 65.24 Favored 'General case' 0 C--N 1.344 0.333 0 C-N-CA 124.338 1.055 . . . . 0.0 112.533 -176.618 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 23.9 p30 . . . . . 0 CA--C 1.532 0.256 0 C-N-CA 123.324 0.65 . . . . 0.0 111.696 -178.035 . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 . . . . . 0 N--CA 1.471 0.605 0 CA-C-O 120.851 0.357 . . . . 0.0 111.384 . . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -145.47 111.04 5.39 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.792 1.237 . . . . 0.0 110.512 176.223 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 57.8 t -141.26 133.65 29.5 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 C-N-CA 125.333 1.453 . . . . 0.0 109.651 178.936 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 42.7 t -162.94 -71.43 0.05 OUTLIER 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 123.701 0.8 . . . . 0.0 112.498 175.322 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 60.8 p -85.85 -20.57 28.92 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 124.881 1.272 . . . . 0.0 113.956 -176.179 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 97.0 mtp -124.02 113.79 18.89 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 126.076 1.75 . . . . 0.0 109.199 176.035 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -142.62 74.21 1.44 Allowed 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.084 1.354 . . . . 0.0 109.757 -177.461 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -147.39 147.88 30.74 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 124.779 1.232 . . . . 0.0 112.144 -179.076 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 30.1 mtpp . . . . . 0 N--CA 1.478 0.969 0 C-N-CA 125.946 1.698 . . . . 0.0 110.751 177.47 . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 11.2 mmt . . . . . 0 N--CA 1.478 0.945 0 N-CA-C 114.203 1.186 . . . . 0.0 114.203 . . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 46.5 t0 -148.4 108.76 3.62 Favored Pre-proline 0 CA--C 1.549 0.939 0 O-C-N 121.065 -1.022 . . . . 0.0 112.312 -178.183 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 65.2 Cg_endo -83.8 -2.09 10.21 Favored 'Trans proline' 0 C--N 1.351 0.682 0 C-N-CA 123.828 3.019 . . . . 0.0 114.712 178.333 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 96.8 mt -120.8 39.35 3.8 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 126.212 1.805 . . . . 0.0 111.78 -175.576 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -106.13 -3.58 21.31 Favored 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 114.253 1.205 . . . . 0.0 114.253 176.533 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.09 -57.06 2.31 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 124.233 1.013 . . . . 0.0 113.112 -161.017 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.9 pp -129.05 12.22 2.67 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.794 0 C-N-CA 126.389 1.876 . . . . 0.0 112.863 -175.118 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 8.4 tt -42.34 105.73 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.082 0 C-N-CA 126.0 1.72 . . . . 0.0 113.46 -176.459 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 4.3 t30 -150.52 10.94 0.67 Allowed 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 114.878 1.436 . . . . 0.0 114.878 179.87 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -81.6 5.25 18.7 Favored 'General case' 0 CA--C 1.545 0.771 0 N-CA-C 115.147 1.536 . . . . 0.0 115.147 -168.53 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 13.5 tt -148.33 27.57 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 C-N-CA 125.616 1.566 . . . . 0.0 113.975 -172.717 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 52.7 mtmt . . . . . 0 N--CA 1.477 0.883 0 N-CA-C 113.981 1.104 . . . . 0.0 113.981 176.555 . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.1 mt . . . . . 0 CA--C 1.543 0.704 0 N-CA-C 109.26 -0.644 . . . . 0.0 109.26 . . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 70.0 m -71.48 164.64 25.43 Favored 'General case' 0 N--CA 1.481 1.077 0 O-C-N 121.788 -0.57 . . . . 0.0 110.5 169.559 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -55.89 -43.76 77.55 Favored 'General case' 0 N--CA 1.481 1.078 0 O-C-N 120.492 -1.38 . . . . 0.0 113.181 -174.949 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 11.6 tt0 -72.24 -41.42 66.82 Favored 'General case' 0 CA--C 1.536 0.442 0 O-C-N 121.549 -0.719 . . . . 0.0 111.537 175.47 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 86.8 mt-30 -62.4 -39.29 92.75 Favored 'General case' 0 N--CA 1.466 0.374 0 O-C-N 121.657 -0.652 . . . . 0.0 111.79 178.465 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 40.0 ttmt -60.81 -41.32 95.45 Favored 'General case' 0 N--CA 1.465 0.281 0 C-N-CA 123.987 0.915 . . . . 0.0 110.625 175.764 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 46.7 mt -67.86 -43.46 86.03 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 CA-C-O 118.332 -0.842 . . . . 0.0 111.266 176.673 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 45.5 mt -64.74 -44.78 96.48 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.956 0 CA-C-N 120.518 1.508 . . . . 0.0 110.481 179.314 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -58.63 -48.77 79.88 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.434 1.494 . . . . 0.0 110.87 176.154 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -64.0 -51.7 63.0 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 124.042 0.937 . . . . 0.0 112.333 176.939 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 13.9 mm-40 -59.75 -23.0 62.86 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 119.318 0.963 . . . . 0.0 113.394 -179.745 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.443 ' CE2' HG22 ' A' ' 55' ' ' ILE . 1.4 t80 -71.47 -64.15 0.98 Allowed 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 119.001 0.819 . . . . 0.0 110.824 172.905 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 27.4 mt -58.84 -34.61 52.81 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 C-N-CA 126.534 1.934 . . . . 0.0 112.019 178.862 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -71.71 -23.45 61.64 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.265 1.026 . . . . 0.0 112.996 177.721 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -91.44 -36.28 13.87 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 124.327 1.051 . . . . 0.0 112.624 176.109 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 19.4 m -112.66 -23.56 4.32 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.269 0 N-CA-C 115.326 1.602 . . . . 0.0 115.326 -174.385 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 83.86 139.16 3.89 Favored Glycine 0 CA--C 1.533 1.183 0 C-N-CA 124.916 1.246 . . . . 0.0 112.288 -167.845 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.2 tt -65.64 -7.94 17.78 Favored 'General case' 0 CA--C 1.551 0.992 0 N-CA-C 114.16 1.17 . . . . 0.0 114.16 -173.4 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 37.7 mt-30 -74.26 -19.3 60.55 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 126.411 1.884 . . . . 0.0 113.566 -178.548 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 13.5 p30 -130.7 2.34 4.47 Favored 'General case' 0 N--CA 1.476 0.868 0 N-CA-C 115.741 1.756 . . . . 0.0 115.741 -176.166 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 55' ' ' ILE . . . . . 0.443 HG22 ' CE2' ' A' ' 46' ' ' TYR . 31.2 pt -63.01 156.98 4.33 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.655 0 CA-C-N 118.797 0.726 . . . . 0.0 111.707 164.826 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -130.63 144.79 51.67 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 125.139 1.376 . . . . 0.0 110.631 176.063 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -62.97 -26.39 68.81 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 124.005 0.922 . . . . 0.0 112.256 175.923 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -66.35 -41.07 88.27 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.502 0 C-N-CA 125.415 1.486 . . . . 0.0 110.562 174.222 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 98.7 m -80.84 -43.65 19.64 Favored 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 123.23 0.612 . . . . 0.0 109.738 -179.289 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.4 tt -66.06 -33.45 75.82 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 124.648 1.179 . . . . 0.0 112.333 178.158 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.444 ' HA ' HG13 ' A' ' 66' ' ' ILE . 60.4 p -60.91 -26.28 67.34 Favored 'General case' 0 N--CA 1.475 0.795 0 CA-C-N 119.232 0.924 . . . . 0.0 112.978 169.878 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -96.32 -31.27 12.97 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 125.026 1.33 . . . . 0.0 113.39 -178.497 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 8.3 mmtm -61.06 -36.53 79.85 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 125.255 1.422 . . . . 0.0 111.75 175.7 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.1 mt -118.22 9.31 12.53 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 125.678 1.591 . . . . 0.0 113.654 -171.1 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . 0.291 7.4 p30 47.31 60.32 3.53 Favored 'General case' 0 CA--C 1.551 0.996 0 C-N-CA 126.771 2.029 . . . . 0.0 114.132 -176.821 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.444 HG13 ' HA ' ' A' ' 61' ' ' SER . 0.6 OUTLIER -130.64 178.5 5.34 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 127.788 2.435 . . . . 0.0 111.359 -173.438 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.1 p -79.56 158.88 27.05 Favored 'General case' 0 N--CA 1.477 0.91 0 O-C-N 121.011 -1.056 . . . . 0.0 111.598 173.337 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 86.3 t -63.7 -29.94 48.59 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.029 0 O-C-N 121.628 -0.67 . . . . 0.0 111.36 172.468 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -76.68 -38.4 54.54 Favored 'General case' 0 N--CA 1.468 0.468 0 O-C-N 120.985 -1.072 . . . . 0.0 109.951 -178.344 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 5.6 tmtm? -65.06 -47.92 75.61 Favored 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 125.56 1.544 . . . . 0.0 110.771 176.359 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -60.62 -43.03 97.94 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 125.95 1.7 . . . . 0.0 113.479 174.062 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 34.8 ttmt -72.31 -27.09 62.22 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 124.633 1.173 . . . . 0.0 111.657 -179.352 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -56.91 -43.11 81.07 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-O 119.02 -0.515 . . . . 0.0 111.245 177.419 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 65.2 m-85 -60.9 -42.74 98.64 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 124.922 1.289 . . . . 0.0 111.571 175.243 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 62.5 mt -69.23 -21.05 24.85 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.765 0 C-N-CA 124.457 1.103 . . . . 0.0 111.168 -179.855 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 30.3 mmtm -92.96 -23.46 18.71 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 125.656 1.582 . . . . 0.0 113.394 178.547 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 10.3 p30 . . . . . 0 N--CA 1.468 0.466 0 N-CA-C 113.822 1.045 . . . . 0.0 113.822 177.986 . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 11.0 mp0 . . . . . 0 CA--C 1.549 0.939 0 CA-C-O 121.702 0.763 . . . . 0.0 112.427 . . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 24.5 tt0 -126.21 45.33 2.67 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 125.162 1.385 . . . . 0.0 112.325 -174.969 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 15.2 t -140.64 68.17 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 C-N-CA 124.978 1.311 . . . . 0.0 110.691 -179.911 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 36.0 t -161.49 -72.02 0.06 Allowed 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.375 0.67 . . . . 0.0 112.636 169.946 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 46.2 m -90.19 -22.67 21.57 Favored 'General case' 0 N--CA 1.478 0.972 0 N-CA-C 113.815 1.043 . . . . 0.0 113.815 -173.391 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 7.4 tpt -144.41 136.1 25.84 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 125.668 1.587 . . . . 0.0 109.358 174.823 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 13.6 tt0 -148.52 29.18 0.86 Allowed 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 124.191 0.996 . . . . 0.0 112.009 -172.904 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -123.59 151.18 43.23 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 125.326 1.45 . . . . 0.0 112.83 -171.678 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 52.2 mtmt . . . . . 0 N--CA 1.474 0.753 0 C-N-CA 125.474 1.509 . . . . 0.0 111.149 177.635 . . . . . . . . 0 0 . 1 . 026 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 79.7 mtp . . . . . 0 N--CA 1.48 1.026 0 N-CA-C 114.083 1.142 . . . . 0.0 114.083 . . . . . . . . . 0 0 . 1 . 026 nuclear build core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 10.9 t0 -88.2 123.69 68.06 Favored Pre-proline 0 CA--C 1.553 1.082 0 C-N-CA 124.422 1.089 . . . . 0.0 112.027 -175.49 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_endo -87.68 0.2 7.2 Favored 'Trans proline' 0 C--N 1.353 0.779 0 C-N-CA 123.607 2.871 . . . . 0.0 115.224 -178.136 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 74.8 mt -109.85 28.78 8.24 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 124.874 1.27 . . . . 0.0 113.94 -171.376 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -99.15 -5.52 29.94 Favored 'General case' 0 N--CA 1.478 0.93 0 N-CA-C 115.661 1.726 . . . . 0.0 115.661 176.889 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -130.47 -30.58 1.89 Allowed 'General case' 0 N--CA 1.481 1.109 0 N-CA-C 117.17 2.285 . . . . 0.0 117.17 -169.066 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.5 pp -135.4 17.82 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.334 0 C-N-CA 125.337 1.455 . . . . 0.0 113.601 -177.531 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 13.1 tt -51.22 135.16 11.87 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 C-N-CA 125.289 1.435 . . . . 0.0 112.876 -176.826 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -156.24 124.74 5.84 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.876 1.27 . . . . 0.0 110.097 -175.762 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 18.9 p-10 -163.23 62.82 0.18 Allowed 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 122.654 1.216 . . . . 0.0 110.793 -178.101 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 52.5 mt 53.31 59.01 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.75 0 C-N-CA 126.125 1.77 . . . . 0.0 110.378 -173.797 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 4.3 tmmm? . . . . . 0 N--CA 1.475 0.823 0 CA-C-N 114.807 -1.088 . . . . 0.0 113.67 -177.447 . . . . . . . . 0 0 . 1 . 026 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.3 mt . . . . . 0 CA--C 1.544 0.714 0 CA-C-O 120.53 0.205 . . . . 0.0 110.609 . . . . . . . . . 0 0 . 1 . 026 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 21.4 t -73.15 166.76 22.51 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 123.053 0.541 . . . . 0.0 110.509 166.95 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -57.52 -44.54 85.13 Favored 'General case' 0 N--CA 1.475 0.794 0 O-C-N 120.705 -1.247 . . . . 0.0 112.744 -175.131 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -74.58 -36.16 63.02 Favored 'General case' 0 N--CA 1.47 0.554 0 O-C-N 121.509 -0.744 . . . . 0.0 112.317 176.045 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 30.0 mm-40 -63.19 -41.47 99.19 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 123.669 0.788 . . . . 0.0 110.438 177.896 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 21.4 ttmm -60.02 -42.59 94.67 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 124.3 1.04 . . . . 0.0 111.159 176.18 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 46.5 mt -69.28 -42.6 81.44 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 CA-C-O 118.341 -0.838 . . . . 0.0 111.115 178.466 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 31.6 mt -63.67 -42.85 97.43 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 CA-C-N 120.586 1.539 . . . . 0.0 110.518 178.218 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -58.47 -47.69 83.23 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.629 1.172 . . . . 0.0 110.621 174.795 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -67.53 -50.42 58.82 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.569 1.147 . . . . 0.0 113.12 -179.597 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -60.46 -26.16 66.56 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-N 118.991 0.814 . . . . 0.0 113.188 -179.625 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 2.1 t80 -74.24 -54.37 7.86 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 123.606 0.762 . . . . 0.0 111.447 177.249 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 45.8 mt -58.81 -35.01 53.86 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 C-N-CA 125.053 1.341 . . . . 0.0 111.23 173.168 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -68.0 -21.07 65.06 Favored 'General case' 0 CA--C 1.547 0.835 0 N-CA-C 113.37 0.878 . . . . 0.0 113.37 175.655 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -95.34 -30.39 13.96 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.833 1.253 . . . . 0.0 113.165 178.406 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 7.7 m -124.54 -22.46 2.48 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 CA-C-N 119.695 1.134 . . . . 0.0 114.049 -173.659 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 89.12 143.96 10.14 Favored Glycine 0 CA--C 1.534 1.256 0 C-N-CA 125.56 1.552 . . . . 0.0 113.246 -172.96 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 58.2 tp -60.08 -17.96 43.49 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 125.707 1.603 . . . . 0.0 115.243 -172.218 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 1.2 pm0 -88.55 -13.4 40.21 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.13 1.372 . . . . 0.0 114.5 176.495 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 77.7 m-20 -110.83 -11.68 14.35 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 114.45 1.278 . . . . 0.0 114.45 -175.084 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 32.2 pt -64.38 156.46 5.46 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 C-N-CA 123.379 0.672 . . . . 0.0 111.205 166.101 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -126.81 144.05 51.08 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 124.752 1.221 . . . . 0.0 110.591 173.886 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -60.62 -26.73 67.23 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.723 0.809 . . . . 0.0 112.099 174.0 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 27.9 mm -63.9 -53.58 42.43 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.396 0 C-N-CA 124.831 1.252 . . . . 0.0 110.6 174.005 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 79.5 m -72.16 -41.52 67.0 Favored 'General case' 0 C--O 1.223 -0.338 0 C-N-CA 123.735 0.814 . . . . 0.0 109.895 -178.331 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 21.0 tp -62.86 -36.88 84.71 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.938 1.295 . . . . 0.0 111.868 177.052 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.498 ' HA ' HG13 ' A' ' 66' ' ' ILE . 43.5 t -54.04 -32.67 55.19 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 124.47 1.108 . . . . 0.0 113.143 168.724 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -100.44 -23.3 14.77 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 114.57 1.322 . . . . 0.0 114.57 -175.153 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 68.5 mmtt -65.76 -38.08 88.09 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 125.093 1.357 . . . . 0.0 111.262 172.861 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.4 mp -111.17 -0.61 16.46 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 125.342 1.457 . . . . 0.0 114.431 -173.535 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 42.7 m-80 55.21 49.51 17.12 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 125.535 1.534 . . . . 0.0 112.78 -173.513 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.498 HG13 ' HA ' ' A' ' 61' ' ' SER . 6.2 pt -109.14 -163.4 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 C-N-CA 126.467 1.907 . . . . 0.0 111.022 -179.33 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.2 p -99.16 161.45 13.62 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.33 1.052 . . . . 0.0 110.538 168.435 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 92.3 t -61.05 -29.11 45.05 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 O-C-N 121.601 -0.687 . . . . 0.0 111.196 173.339 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -82.27 -34.31 28.77 Favored 'General case' 0 N--CA 1.472 0.65 0 O-C-N 120.615 -1.303 . . . . 0.0 110.868 179.489 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 4.1 tttp -80.36 -3.83 51.15 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 126.341 1.856 . . . . 0.0 113.379 178.644 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -102.88 -46.35 4.71 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 129.248 3.019 . . . . 0.0 112.84 167.69 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 36.9 ttmt -69.92 -28.77 65.86 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 124.843 1.257 . . . . 0.0 111.14 -175.307 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 42.5 p-10 -45.7 -55.05 6.92 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 123.239 0.616 . . . . 0.0 111.07 171.646 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 25.0 m-85 -55.14 -42.1 72.6 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 126.021 1.728 . . . . 0.0 112.47 -179.844 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 50.5 mt -70.25 -26.53 29.52 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.728 0 C-N-CA 125.745 1.618 . . . . 0.0 111.467 -178.866 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 30.8 mmmt -87.17 -36.31 18.1 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 125.994 1.718 . . . . 0.0 112.27 175.641 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 73.6 m-20 . . . . . 0 CA--C 1.532 0.268 0 C-N-CA 125.858 1.663 . . . . 0.0 108.692 -175.381 . . . . . . . . 0 0 . 1 . 026 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 . . . . . 0 N--CA 1.476 0.862 0 N-CA-C 112.451 0.538 . . . . 0.0 112.451 . . . . . . . . . 0 0 . 1 . 026 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -141.19 39.29 1.76 Allowed 'General case' 0 N--CA 1.479 0.982 0 N-CA-C 114.431 1.271 . . . . 0.0 114.431 -171.488 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 34.4 m -83.34 148.75 4.87 Favored 'Isoleucine or valine' 0 C--O 1.234 0.279 0 C-N-CA 124.71 1.204 . . . . 0.0 112.663 177.662 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 43.4 t -164.96 -73.36 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 124.477 1.111 . . . . 0.0 112.475 168.919 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 18.2 t -74.64 -31.2 61.89 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 123.863 0.865 . . . . 0.0 112.476 -177.98 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 62.5 mtt -128.3 151.4 49.36 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 125.914 1.685 . . . . 0.0 110.742 169.367 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 20.2 tt0 -141.4 19.65 2.22 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 125.393 1.477 . . . . 0.0 111.822 -176.451 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -119.95 105.52 11.14 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 125.257 1.423 . . . . 0.0 112.048 -170.776 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 96.8 mttt . . . . . 0 N--CA 1.482 1.135 0 C-N-CA 125.802 1.641 . . . . 0.0 113.584 174.581 . . . . . . . . 0 0 . 1 . 027 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 16.9 ttp . . . . . 0 N--CA 1.477 0.919 0 N-CA-C 113.112 0.782 . . . . 0.0 113.112 . . . . . . . . . 0 0 . 1 . 027 nuclear build core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 -120.42 130.7 24.72 Favored Pre-proline 0 CA--C 1.547 0.833 0 C-N-CA 124.834 1.254 . . . . 0.0 111.848 -171.931 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -80.07 -15.73 11.53 Favored 'Trans proline' 0 C--N 1.352 0.75 0 C-N-CA 123.084 2.522 . . . . 0.0 114.992 -175.454 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 96.9 mt -116.78 42.05 2.57 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 126.165 1.786 . . . . 0.0 111.806 -174.884 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -113.18 1.29 15.2 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 114.307 1.225 . . . . 0.0 114.307 179.241 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -119.22 -56.0 2.11 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 124.767 1.227 . . . . 0.0 113.063 -167.762 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.1 pp -129.72 14.38 2.44 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.875 0 C-N-CA 126.407 1.883 . . . . 0.0 112.892 -173.199 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 9.4 tt -44.73 124.05 0.83 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 C-N-CA 125.12 1.368 . . . . 0.0 112.254 178.074 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -147.1 12.61 1.09 Allowed 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 113.812 1.042 . . . . 0.0 113.812 -176.62 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -88.46 7.86 30.76 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 114.696 1.369 . . . . 0.0 114.696 -171.753 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 14.2 tt -148.71 30.61 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 C-N-CA 125.763 1.625 . . . . 0.0 113.318 -172.034 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 60.0 tttp . . . . . 0 N--CA 1.476 0.837 0 N-CA-C 114.28 1.215 . . . . 0.0 114.28 -179.437 . . . . . . . . 0 0 . 1 . 027 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.9 mt . . . . . 0 CA--C 1.545 0.761 0 N-CA-C 110.044 -0.354 . . . . 0.0 110.044 . . . . . . . . . 0 0 . 1 . 027 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 17.9 m -71.41 167.56 19.33 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 123.749 0.819 . . . . 0.0 110.733 169.293 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -56.25 -45.37 80.06 Favored 'General case' 0 N--CA 1.478 0.94 0 O-C-N 120.591 -1.318 . . . . 0.0 113.357 -174.799 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 10.4 tt0 -74.61 -42.1 59.23 Favored 'General case' 0 N--CA 1.471 0.593 0 O-C-N 121.416 -0.802 . . . . 0.0 111.46 177.004 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 29.2 mm-40 -55.3 -44.94 76.21 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.079 0.952 . . . . 0.0 110.812 176.577 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt -60.55 -42.03 95.76 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 125.058 1.343 . . . . 0.0 111.396 178.457 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 45.4 mt -69.29 -40.59 80.4 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 CA-C-O 118.117 -0.944 . . . . 0.0 111.245 177.912 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 38.2 mt -64.08 -43.05 97.42 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.848 0 CA-C-N 120.256 1.389 . . . . 0.0 110.205 177.301 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -60.24 -47.67 85.01 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.372 1.069 . . . . 0.0 110.931 177.159 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -67.51 -50.29 59.53 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 124.886 1.274 . . . . 0.0 112.328 179.722 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -64.2 -26.06 68.35 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 118.999 0.818 . . . . 0.0 112.783 -176.61 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.462 ' CD1' ' HE2' ' A' ' 63' ' ' LYS . 1.1 t80 -67.61 -58.43 4.69 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 123.913 0.885 . . . . 0.0 110.509 174.421 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.0 mt -62.61 -35.63 71.25 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 C-N-CA 126.539 1.935 . . . . 0.0 111.368 179.512 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -70.96 -26.64 63.25 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 123.881 0.873 . . . . 0.0 112.617 178.25 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -88.11 -38.84 15.05 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.267 1.027 . . . . 0.0 112.541 175.329 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.5 m -108.56 -6.99 10.96 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.147 0 N-CA-C 114.529 1.307 . . . . 0.0 114.529 -172.616 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 87.52 26.46 30.09 Favored Glycine 0 CA--C 1.531 1.056 0 C-N-CA 124.695 1.141 . . . . 0.0 115.476 161.865 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 57.15 10.21 0.8 Allowed 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 127.223 2.209 . . . . 0.0 115.09 -174.957 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 4.7 pt20 -123.27 -3.78 8.44 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 125.141 1.376 . . . . 0.0 113.713 -168.561 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 59.5 m-80 -123.47 0.52 8.85 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.953 1.301 . . . . 0.0 113.196 174.75 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 55' ' ' ILE . . . . . 0.434 HG22 ' CE2' ' A' ' 46' ' ' TYR . 19.0 pt -74.9 152.33 6.66 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.57 0 CA-C-O 121.099 0.476 . . . . 0.0 111.223 175.125 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -140.04 143.84 36.58 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 124.668 1.187 . . . . 0.0 109.581 179.625 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -60.4 -28.24 68.08 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 123.417 0.687 . . . . 0.0 112.247 179.732 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -64.78 -48.81 82.95 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 C-N-CA 125.467 1.507 . . . . 0.0 110.157 175.222 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 78.2 m -80.71 -41.43 23.65 Favored 'General case' 0 C--O 1.223 -0.326 0 C-N-CA 124.103 0.961 . . . . 0.0 110.202 -174.722 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 20.0 tp -62.51 -35.6 79.9 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 125.214 1.406 . . . . 0.0 112.265 173.448 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.458 ' HA ' HG13 ' A' ' 66' ' ' ILE . 29.6 t -54.51 -33.47 59.96 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.706 1.203 . . . . 0.0 112.366 168.781 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -94.89 -31.85 13.5 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.755 1.222 . . . . 0.0 113.68 -176.322 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.462 ' HE2' ' CD1' ' A' ' 46' ' ' TYR . 1.0 OUTLIER -62.02 -32.75 73.27 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 125.42 1.488 . . . . 0.0 112.52 178.413 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.6 mp -118.6 8.34 11.95 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.751 1.221 . . . . 0.0 114.01 -177.97 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 44.9 m-80 53.37 56.22 7.66 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 126.243 1.817 . . . . 0.0 113.304 -178.659 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.458 HG13 ' HA ' ' A' ' 61' ' ' SER . 1.5 pt -122.08 -168.33 0.5 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.701 0 C-N-CA 127.132 2.173 . . . . 0.0 110.536 -173.738 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 2.4 p -93.48 160.2 14.9 Favored 'General case' 0 N--CA 1.476 0.835 0 O-C-N 121.264 -0.898 . . . . 0.0 111.04 170.641 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 86.9 t -61.73 -29.98 47.39 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 C-N-CA 123.086 0.554 . . . . 0.0 111.271 172.527 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -79.25 -37.73 37.23 Favored 'General case' 0 N--CA 1.468 0.429 0 O-C-N 120.854 -1.154 . . . . 0.0 110.283 -178.224 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 5.2 tmtm? -67.66 -45.31 75.65 Favored 'General case' 0 C--N 1.339 0.138 0 C-N-CA 124.56 1.144 . . . . 0.0 110.741 178.275 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -60.3 -45.86 91.9 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.713 1.605 . . . . 0.0 113.278 170.877 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 33.5 ttmt -69.46 -27.12 64.96 Favored 'General case' 0 N--CA 1.466 0.373 0 O-C-N 121.005 -1.059 . . . . 0.0 111.546 -177.251 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -55.67 -43.67 76.55 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-O 119.372 -0.347 . . . . 0.0 111.334 175.806 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 30.7 m-85 -62.16 -44.35 96.8 Favored 'General case' 0 C--O 1.224 -0.263 0 C-N-CA 125.269 1.428 . . . . 0.0 111.515 177.339 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 65.0 mt -64.59 -30.34 49.94 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.586 0 C-N-CA 123.947 0.899 . . . . 0.0 110.571 178.653 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -77.24 -38.01 52.03 Favored 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 125.0 1.32 . . . . 0.0 113.368 -178.704 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 8.3 p30 . . . . . 0 N--CA 1.466 0.36 0 CA-C-N 119.105 0.866 . . . . 0.0 111.587 178.841 . . . . . . . . 0 0 . 1 . 027 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 . . . . . 0 N--CA 1.474 0.739 0 CA-C-O 121.104 0.478 . . . . 0.0 111.858 . . . . . . . . . 0 0 . 1 . 027 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -83.11 88.09 6.9 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 124.226 1.01 . . . . 0.0 110.992 178.264 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 12.2 p -149.06 145.77 17.73 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 C-N-CA 124.909 1.284 . . . . 0.0 111.724 176.08 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 75.0 m -147.38 -54.19 0.22 Allowed 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 124.724 1.21 . . . . 0.0 112.814 -178.295 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 25.9 t -107.51 -46.52 3.82 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 124.521 1.128 . . . . 0.0 112.955 -175.424 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 94.8 mtp -88.86 51.49 2.18 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 125.021 1.328 . . . . 0.0 112.143 -176.162 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 21.7 tt0 -80.41 57.73 2.92 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 125.42 1.488 . . . . 0.0 112.126 -177.114 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -137.36 124.74 21.93 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.439 1.496 . . . . 0.0 111.196 -179.522 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 59.9 mtpt . . . . . 0 N--CA 1.482 1.159 0 C-N-CA 125.448 1.499 . . . . 0.0 112.587 -179.029 . . . . . . . . 0 0 . 1 . 028 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 12.1 tmm? . . . . . 0 CA--C 1.539 0.531 0 N-CA-C 109.956 -0.387 . . . . 0.0 109.956 . . . . . . . . . 0 0 . 1 . 028 nuclear build core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 77.4 m-20 39.72 58.66 6.8 Favored Pre-proline 0 CA--C 1.555 1.135 0 C-N-CA 127.346 2.258 . . . . 0.0 115.159 177.994 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 78.7 Cg_endo -70.02 -16.53 36.48 Favored 'Trans proline' 0 C--N 1.352 0.752 0 C-N-CA 123.29 2.66 . . . . 0.0 115.365 -170.801 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.445 HD23 ' H ' ' A' ' 4' ' ' LEU . 2.4 pt? -113.93 13.1 18.25 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 126.148 1.779 . . . . 0.0 115.011 -176.974 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -74.94 -2.03 25.2 Favored 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 115.166 1.543 . . . . 0.0 115.166 -175.768 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -125.65 -61.86 1.23 Allowed 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 125.407 1.483 . . . . 0.0 112.951 -163.392 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.4 pp -104.16 -14.83 8.46 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 C-N-CA 124.681 1.193 . . . . 0.0 113.53 -177.105 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . 0.291 14.2 tt 34.44 48.95 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.27 0 C-N-CA 127.502 2.321 . . . . 0.0 116.234 170.04 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -95.94 37.33 1.23 Allowed 'General case' 0 CA--C 1.547 0.83 0 O-C-N 120.418 -1.426 . . . . 0.0 113.077 -170.902 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 -109.44 10.72 25.29 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 113.851 1.056 . . . . 0.0 113.851 -176.635 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 6.9 tp -150.14 31.34 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.48 1.047 0 C-N-CA 125.013 1.325 . . . . 0.0 113.61 -173.299 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 7.0 tmtm? . . . . . 0 N--CA 1.475 0.785 0 C-N-CA 123.717 0.807 . . . . 0.0 113.045 -176.827 . . . . . . . . 0 0 . 1 . 028 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.7 mt . . . . . 0 CA--C 1.545 0.759 0 N-CA-C 110.194 -0.298 . . . . 0.0 110.194 . . . . . . . . . 0 0 . 1 . 028 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 18.9 t -75.31 166.77 23.11 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 123.178 0.591 . . . . 0.0 110.503 169.727 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -55.83 -46.04 78.21 Favored 'General case' 0 N--CA 1.476 0.844 0 O-C-N 120.591 -1.318 . . . . 0.0 113.077 -173.017 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 11.8 tt0 -72.29 -42.22 65.77 Favored 'General case' 0 N--CA 1.47 0.566 0 O-C-N 121.53 -0.731 . . . . 0.0 111.268 176.796 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 14.8 mm100 -60.22 -42.25 94.78 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.797 0.839 . . . . 0.0 110.695 179.744 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 41.4 ttmt -60.73 -43.07 98.35 Favored 'General case' 0 N--CA 1.466 0.332 0 C-N-CA 125.194 1.398 . . . . 0.0 111.008 176.538 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 53.2 mt -67.25 -41.59 86.83 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 CA-C-O 118.179 -0.915 . . . . 0.0 111.155 177.185 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 44.1 mt -63.89 -45.38 97.14 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.928 0 CA-C-N 120.593 1.542 . . . . 0.0 110.166 178.097 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -58.18 -49.6 76.46 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.709 1.204 . . . . 0.0 110.87 176.953 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -65.59 -52.18 54.08 Favored 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 125.028 1.331 . . . . 0.0 112.677 179.515 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 -61.43 -29.21 69.8 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-N 119.169 0.895 . . . . 0.0 112.798 -179.294 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.46 ' CE1' HG22 ' A' ' 55' ' ' ILE . 1.4 t80 -66.83 -56.42 10.45 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 118.685 0.675 . . . . 0.0 110.849 175.342 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 81.1 mt -65.03 -32.01 56.44 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 C-N-CA 126.886 2.074 . . . . 0.0 111.763 178.856 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -73.0 -28.06 62.15 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 123.9 0.88 . . . . 0.0 112.436 176.149 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -85.29 -39.92 17.16 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.01 0.924 . . . . 0.0 112.165 176.054 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.1 m -109.94 -3.62 10.56 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.199 0 N-CA-C 114.152 1.167 . . . . 0.0 114.152 -173.761 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 86.43 19.87 55.86 Favored Glycine 0 N--CA 1.474 1.172 0 C-N-CA 125.539 1.542 . . . . 0.0 115.525 160.538 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 57.13 5.53 0.26 Allowed 'General case' 0 CA--C 1.555 1.164 0 C-N-CA 127.057 2.143 . . . . 0.0 114.706 -166.778 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 15.9 mt-30 -98.81 -14.31 19.74 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 125.901 1.681 . . . . 0.0 112.751 -173.481 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 39.2 m-80 -131.22 6.23 4.51 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 113.937 1.088 . . . . 0.0 113.937 -171.962 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 55' ' ' ILE . . . . . 0.46 HG22 ' CE1' ' A' ' 46' ' ' TYR . 20.1 pt -77.23 154.38 5.49 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 CA-C-N 118.691 0.678 . . . . 0.0 111.81 176.123 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -133.15 144.01 49.61 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 124.374 1.069 . . . . 0.0 110.306 175.959 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -60.58 -29.17 69.01 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.959 0.904 . . . . 0.0 111.756 177.995 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.9 mp -63.43 -57.18 12.97 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.218 0 C-N-CA 124.81 1.244 . . . . 0.0 108.903 173.93 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 52.9 m -68.42 -45.67 71.98 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 123.696 0.799 . . . . 0.0 109.764 -175.138 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 19.0 tp -57.87 -35.77 71.42 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.915 1.286 . . . . 0.0 112.175 174.324 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.447 ' HA ' HG13 ' A' ' 66' ' ' ILE . 19.4 p -63.91 -20.67 66.02 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 113.883 1.068 . . . . 0.0 113.883 172.551 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 13.6 mptt -103.82 -31.4 9.82 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 125.224 1.409 . . . . 0.0 113.351 -178.287 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 7.2 mtpp -65.87 -28.98 69.36 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 120.035 1.289 . . . . 0.0 112.105 176.836 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.9 mp -115.55 4.48 14.2 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.402 1.481 . . . . 0.0 114.381 -178.653 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 31.9 m-80 56.19 59.57 3.63 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 125.998 1.719 . . . . 0.0 113.651 179.611 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.447 HG13 ' HA ' ' A' ' 61' ' ' SER . 0.9 OUTLIER -135.41 176.63 8.11 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 C-N-CA 126.607 1.963 . . . . 0.0 111.492 -169.853 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.4 p -77.09 158.73 30.3 Favored 'General case' 0 N--CA 1.479 0.985 0 O-C-N 120.947 -1.095 . . . . 0.0 111.317 172.006 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 98.8 t -64.33 -28.5 45.03 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.984 0 O-C-N 121.684 -0.635 . . . . 0.0 111.349 173.644 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -77.86 -38.13 46.72 Favored 'General case' 0 N--CA 1.469 0.475 0 O-C-N 121.183 -0.948 . . . . 0.0 110.055 179.449 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 5.5 tmtm? -67.25 -43.24 82.4 Favored 'General case' 0 N--CA 1.462 0.175 0 C-N-CA 125.138 1.375 . . . . 0.0 111.346 177.244 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -60.7 -50.0 75.25 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.861 1.264 . . . . 0.0 112.92 170.277 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 33.8 ttmt -68.44 -24.79 64.77 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 124.615 1.166 . . . . 0.0 111.846 -176.525 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -53.64 -40.05 65.49 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 123.679 0.792 . . . . 0.0 111.444 171.899 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -70.79 -42.41 70.37 Favored 'General case' 0 C--O 1.224 -0.24 0 C-N-CA 124.152 0.981 . . . . 0.0 111.633 176.593 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 42.9 mt -65.45 -30.82 51.36 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 C-N-CA 124.711 1.204 . . . . 0.0 111.414 -179.289 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 12.4 tppt? -89.47 -22.8 22.3 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.808 1.643 . . . . 0.0 113.002 179.924 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 56.6 m-20 . . . . . 0 N--CA 1.466 0.347 0 C-N-CA 124.942 1.297 . . . . 0.0 110.409 172.961 . . . . . . . . 0 0 . 1 . 028 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 . . . . . 0 N--CA 1.474 0.758 0 CA-C-O 120.66 0.267 . . . . 0.0 111.108 . . . . . . . . . 0 0 . 1 . 028 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -99.99 97.71 8.54 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 124.49 1.116 . . . . 0.0 110.159 175.696 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 25.8 t -129.18 -67.48 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 C-N-CA 124.56 1.144 . . . . 0.0 112.589 -172.311 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 31.2 p 51.43 11.41 0.12 Allowed 'General case' 0 CA--C 1.547 0.851 0 N-CA-C 118.89 2.922 . . . . 0.0 118.89 177.31 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 27.6 t -123.79 -44.27 2.09 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 125.349 1.46 . . . . 0.0 113.318 -178.161 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 3.0 tmm? -137.36 60.05 1.66 Allowed 'General case' 0 N--CA 1.474 0.775 0 CA-C-O 123.388 1.566 . . . . 0.0 110.148 178.552 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 22.1 tt0 -82.5 53.78 2.43 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 126.022 1.729 . . . . 0.0 112.63 -170.716 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -75.5 94.01 3.07 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 124.846 1.258 . . . . 0.0 111.769 -178.741 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 20.0 mmmt . . . . . 0 N--CA 1.477 0.907 0 C-N-CA 126.494 1.918 . . . . 0.0 109.439 -177.746 . . . . . . . . 0 0 . 1 . 029 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 17.7 ttt . . . . . 0 CA--C 1.547 0.854 0 CA-C-O 121.444 0.64 . . . . 0.0 111.617 . . . . . . . . . 0 0 . 1 . 029 nuclear build core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 -119.65 94.11 48.15 Favored Pre-proline 0 CA--C 1.545 0.778 0 C-N-CA 125.102 1.361 . . . . 0.0 111.481 -172.224 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -78.83 -13.77 14.23 Favored 'Trans proline' 0 C--N 1.351 0.658 0 C-N-CA 122.977 2.451 . . . . 0.0 114.9 -178.949 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 96.8 mt -101.71 46.07 0.95 Allowed 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 126.015 1.726 . . . . 0.0 113.189 -170.709 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -109.79 -2.66 17.19 Favored 'General case' 0 N--CA 1.479 0.975 0 N-CA-C 114.885 1.439 . . . . 0.0 114.885 171.693 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -128.63 -55.76 1.22 Allowed 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 124.303 1.041 . . . . 0.0 113.18 -166.384 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.8 pp -108.4 9.12 9.21 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 C-N-CA 125.593 1.557 . . . . 0.0 112.882 -178.201 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 10.0 tt -54.09 117.62 0.99 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.825 0 C-N-CA 123.781 0.833 . . . . 0.0 111.769 178.301 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -150.35 15.48 0.8 Allowed 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 124.131 0.972 . . . . 0.0 113.621 -178.167 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -85.2 5.2 31.12 Favored 'General case' 0 CA--C 1.545 0.763 0 N-CA-C 114.931 1.456 . . . . 0.0 114.931 -169.183 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 13.6 tt -146.77 24.4 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.805 0 C-N-CA 125.396 1.478 . . . . 0.0 114.262 -170.217 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 35.4 ttpt . . . . . 0 N--CA 1.475 0.789 0 N-CA-C 114.546 1.313 . . . . 0.0 114.546 177.98 . . . . . . . . 0 0 . 1 . 029 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 36.6 mt . . . . . 0 CA--C 1.541 0.621 0 CA-C-O 120.531 0.205 . . . . 0.0 110.885 . . . . . . . . . 0 0 . 1 . 029 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 71.2 m -71.66 165.15 24.56 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 122.976 0.51 . . . . 0.0 110.412 169.741 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -53.79 -44.9 70.49 Favored 'General case' 0 N--CA 1.478 0.952 0 O-C-N 120.952 -1.092 . . . . 0.0 112.877 -176.19 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 6.9 pt20 -72.41 -36.0 68.53 Favored 'General case' 0 N--CA 1.47 0.539 0 O-C-N 121.733 -0.605 . . . . 0.0 112.211 176.683 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 86.7 mt-30 -67.87 -40.21 83.61 Favored 'General case' 0 CA--C 1.534 0.348 0 O-C-N 121.662 -0.648 . . . . 0.0 111.271 179.373 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 17.6 ttmm -59.65 -40.87 89.16 Favored 'General case' 0 N--CA 1.471 0.595 0 O-C-N 121.469 -0.769 . . . . 0.0 110.687 174.359 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 51.5 mt -69.73 -41.54 79.99 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 CA-C-O 117.865 -1.065 . . . . 0.0 111.638 176.969 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 35.9 mt -64.0 -43.08 97.53 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.943 0 CA-C-N 121.144 1.793 . . . . 0.0 110.04 177.598 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -58.12 -49.62 76.35 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.605 1.162 . . . . 0.0 110.688 177.381 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -62.77 -52.93 61.28 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 124.776 1.23 . . . . 0.0 112.834 175.78 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -59.06 -30.99 68.47 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-N 119.154 0.888 . . . . 0.0 112.729 -179.838 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.416 ' CE1' HG22 ' A' ' 55' ' ' ILE . 1.3 t80 -67.73 -57.31 6.56 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 123.35 0.66 . . . . 0.0 110.644 176.871 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 89.0 mt -64.15 -33.63 63.65 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 C-N-CA 126.212 1.805 . . . . 0.0 111.352 179.686 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -71.42 -27.24 63.16 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.016 0.926 . . . . 0.0 112.544 177.097 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -88.19 -37.61 15.98 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.085 0.954 . . . . 0.0 112.533 176.151 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.5 m -109.9 -4.79 10.9 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.223 0 N-CA-C 114.488 1.292 . . . . 0.0 114.488 -174.087 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 83.13 25.8 47.03 Favored Glycine 0 N--CA 1.471 1.004 0 C-N-CA 125.028 1.299 . . . . 0.0 115.049 162.203 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 57.6 6.65 0.45 Allowed 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 127.511 2.325 . . . . 0.0 115.175 -172.061 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 27.2 mt-30 -102.17 -15.34 16.71 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 125.55 1.54 . . . . 0.0 113.181 -172.637 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 42.4 m-80 -126.49 5.68 6.89 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.167 0.987 . . . . 0.0 113.569 -172.543 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 55' ' ' ILE . . . . . 0.416 HG22 ' CE1' ' A' ' 46' ' ' TYR . 15.1 pt -79.35 152.45 4.8 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.555 0 O-C-N 121.903 -0.498 . . . . 0.0 111.309 173.978 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -139.52 144.99 38.15 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 124.55 1.14 . . . . 0.0 109.592 178.915 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -61.94 -23.16 66.19 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 119.193 0.906 . . . . 0.0 112.59 -179.255 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 2.0 mp -70.29 -55.01 16.04 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.232 0 C-N-CA 125.336 1.454 . . . . 0.0 109.091 172.662 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 91.2 m -68.92 -43.32 75.41 Favored 'General case' 0 N--CA 1.464 0.274 0 O-C-N 121.535 -0.728 . . . . 0.0 110.385 -176.895 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 13.7 tp -60.8 -34.87 75.17 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 125.665 1.586 . . . . 0.0 112.241 173.43 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.486 ' HA ' HG13 ' A' ' 66' ' ' ILE . 4.4 t -57.11 -28.82 62.99 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 124.092 0.957 . . . . 0.0 112.685 169.806 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 8.7 mptt -105.56 -23.24 12.82 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.853 1.261 . . . . 0.0 113.789 -174.949 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 58.6 mmtt -66.46 -33.69 76.26 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 124.533 1.133 . . . . 0.0 111.458 175.316 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.0 mp -119.07 5.82 11.31 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 124.831 1.252 . . . . 0.0 114.364 -175.85 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 19.1 m-80 57.84 58.12 3.82 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 126.262 1.825 . . . . 0.0 113.221 -178.733 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.486 HG13 ' HA ' ' A' ' 61' ' ' SER . 3.4 pt -134.89 168.26 23.97 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 C-N-CA 126.072 1.749 . . . . 0.0 112.49 -170.082 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 30.5 p -69.57 151.72 45.63 Favored 'General case' 0 N--CA 1.47 0.525 0 O-C-N 121.382 -0.824 . . . . 0.0 111.405 174.918 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 91.7 t -61.09 -27.06 40.92 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.861 0 C-N-CA 123.095 0.558 . . . . 0.0 111.054 171.211 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -75.6 -41.92 53.24 Favored 'General case' 0 C--O 1.235 0.323 0 O-C-N 120.96 -1.088 . . . . 0.0 110.155 -176.839 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.25 -32.01 49.47 Favored 'General case' 0 C--N 1.346 0.416 0 CA-C-N 118.311 0.505 . . . . 0.0 111.627 179.626 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -63.86 -46.75 83.59 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.797 1.239 . . . . 0.0 112.194 171.502 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 39.4 ttmt -67.94 -29.46 68.53 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 124.3 1.04 . . . . 0.0 111.334 -178.861 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -55.35 -38.94 69.44 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 122.806 0.442 . . . . 0.0 112.071 176.393 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 35.2 m-85 -65.52 -45.57 82.98 Favored 'General case' 0 C--O 1.224 -0.264 0 C-N-CA 124.699 1.2 . . . . 0.0 111.398 175.664 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 61.6 mt -65.18 -30.59 50.75 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.592 0 C-N-CA 124.115 0.966 . . . . 0.0 110.79 -178.611 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt -79.2 -36.82 39.6 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 124.713 1.205 . . . . 0.0 113.144 179.018 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 6.3 p30 . . . . . 0 C--N 1.345 0.387 0 CA-C-N 120.019 1.282 . . . . 0.0 111.737 179.682 . . . . . . . . 0 0 . 1 . 029 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 . . . . . 0 CA--C 1.544 0.726 0 CA-C-O 121.038 0.447 . . . . 0.0 111.225 . . . . . . . . . 0 0 . 1 . 029 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -149.4 71.37 1.11 Allowed 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 124.658 1.183 . . . . 0.0 110.912 -179.784 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 28.0 t -139.7 80.69 0.35 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 124.836 1.254 . . . . 0.0 110.1 177.519 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 47.5 t -163.23 -76.86 0.04 OUTLIER 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 123.935 0.894 . . . . 0.0 112.329 169.375 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 55.5 p -88.74 -29.14 20.04 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 125.028 1.331 . . . . 0.0 113.321 -176.744 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 43.9 mtt -126.61 142.41 51.55 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 126.465 1.906 . . . . 0.0 109.752 167.809 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -157.86 90.78 1.09 Allowed 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.839 1.655 . . . . 0.0 107.823 172.829 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -146.33 157.78 43.82 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 124.3 1.04 . . . . 0.0 113.273 -171.858 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 96.7 mttt . . . . . 0 N--CA 1.475 0.811 0 C-N-CA 125.907 1.683 . . . . 0.0 111.776 -174.894 . . . . . . . . 0 0 . 1 . 030 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.2 ttt . . . . . 0 N--CA 1.479 0.975 0 N-CA-C 113.388 0.884 . . . . 0.0 113.388 . . . . . . . . . 0 0 . 1 . 030 nuclear build core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 8.6 t0 -101.85 123.01 45.37 Favored Pre-proline 0 CA--C 1.551 1.012 0 C-N-CA 124.471 1.109 . . . . 0.0 112.156 -176.614 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 69.1 Cg_endo -82.67 -3.42 11.27 Favored 'Trans proline' 0 C--N 1.352 0.725 0 C-N-CA 123.501 2.8 . . . . 0.0 115.147 179.437 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 81.8 mt -108.24 43.58 1.21 Allowed 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.799 1.64 . . . . 0.0 112.314 -175.793 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -104.81 0.5 28.17 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 115.013 1.486 . . . . 0.0 115.013 178.633 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -120.52 -57.72 1.89 Allowed 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 124.408 1.083 . . . . 0.0 113.489 -166.751 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.1 pp -129.71 15.87 2.44 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 C-N-CA 126.249 1.819 . . . . 0.0 112.76 -172.188 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 16.9 tt -38.88 120.66 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 C-N-CA 125.825 1.65 . . . . 0.0 113.369 178.027 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 1.9 m120 -165.01 108.1 0.85 Allowed 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.584 1.154 . . . . 0.0 109.685 179.372 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 23.3 t0 -166.44 81.91 0.26 Allowed 'General case' 0 N--CA 1.466 0.353 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 -178.82 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 46.1 mm 53.0 63.21 0.21 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.831 0 CA-C-O 123.169 1.461 . . . . 0.0 111.096 -170.463 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 1.3 mmmt . . . . . 0 N--CA 1.48 1.069 0 C-N-CA 124.781 1.233 . . . . 0.0 113.968 179.595 . . . . . . . . 0 0 . 1 . 030 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 86.9 mt . . . . . 0 CA--C 1.544 0.733 0 CA-C-O 120.595 0.236 . . . . 0.0 111.294 . . . . . . . . . 0 0 . 1 . 030 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 26.8 m -72.04 169.51 15.84 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 124.32 1.048 . . . . 0.0 110.871 169.889 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -57.33 -43.54 83.44 Favored 'General case' 0 CA--C 1.545 0.773 0 O-C-N 120.427 -1.421 . . . . 0.0 113.324 -173.46 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 12.6 tt0 -74.69 -43.3 55.87 Favored 'General case' 0 N--CA 1.472 0.661 0 O-C-N 121.129 -0.982 . . . . 0.0 111.696 176.856 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 11.7 mm-40 -53.46 -45.32 69.48 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.0 1.32 . . . . 0.0 111.449 174.521 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 41.0 ttmt -60.45 -38.12 83.12 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 125.31 1.444 . . . . 0.0 111.761 176.889 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 49.9 mt -76.16 -35.81 29.17 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 CA-C-O 118.075 -0.964 . . . . 0.0 111.93 178.565 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 48.8 mt -60.51 -40.97 86.01 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.035 0 CA-C-N 120.766 1.621 . . . . 0.0 109.825 172.752 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.454 HD22 HD11 ' A' ' 60' ' ' LEU . 0.4 OUTLIER -59.45 -52.4 65.75 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.177 0.991 . . . . 0.0 110.649 175.0 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -65.36 -49.27 70.0 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 124.419 1.088 . . . . 0.0 113.42 -177.662 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 18.8 mm-40 -62.46 -25.05 67.78 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 123.941 0.896 . . . . 0.0 113.065 -179.297 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -71.87 -54.82 8.88 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 123.367 0.667 . . . . 0.0 110.999 175.883 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 52.7 mt -59.35 -36.17 62.4 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 C-N-CA 125.134 1.374 . . . . 0.0 111.262 174.202 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -67.84 -20.86 65.2 Favored 'General case' 0 CA--C 1.546 0.791 0 N-CA-C 113.266 0.839 . . . . 0.0 113.266 176.771 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -96.41 -29.72 13.78 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.882 1.273 . . . . 0.0 113.228 178.358 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 5.3 m -123.19 -22.79 2.77 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.993 0 CA-C-N 119.791 1.178 . . . . 0.0 114.068 -173.815 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 89.92 143.51 10.43 Favored Glycine 0 CA--C 1.534 1.251 0 C-N-CA 125.531 1.539 . . . . 0.0 113.082 -172.017 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 30.6 tp -59.89 -17.19 35.12 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 126.116 1.766 . . . . 0.0 114.932 -173.377 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 37.6 mt-30 -89.55 -18.99 25.55 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 126.474 1.91 . . . . 0.0 112.923 179.753 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 57.9 m-80 -108.67 -9.11 15.3 Favored 'General case' 0 N--CA 1.472 0.648 0 N-CA-C 114.35 1.241 . . . . 0.0 114.35 -173.748 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 30.5 pt -65.62 159.49 4.14 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.471 0 C-N-CA 123.787 0.835 . . . . 0.0 111.134 162.396 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -132.43 143.14 49.6 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 125.494 1.518 . . . . 0.0 109.904 175.612 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -59.44 -26.65 65.38 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 123.826 0.851 . . . . 0.0 112.219 174.679 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 27.7 mm -66.07 -44.33 92.01 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.495 0 C-N-CA 125.286 1.434 . . . . 0.0 111.686 175.36 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 56.2 m -83.4 -38.85 21.4 Favored 'General case' 0 C--O 1.222 -0.364 0 C-N-CA 123.175 0.59 . . . . 0.0 109.461 -178.515 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.454 HD11 HD22 ' A' ' 43' ' ' LEU . 14.3 tp -62.64 -37.82 87.84 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 125.0 1.32 . . . . 0.0 111.538 175.651 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.462 ' HA ' HG13 ' A' ' 66' ' ' ILE . 53.1 p -61.26 -25.76 67.3 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 113.2 0.815 . . . . 0.0 113.2 171.747 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -99.38 -28.29 13.35 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 125.092 1.357 . . . . 0.0 114.234 -177.196 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 51.9 mmtt -64.65 -36.47 84.36 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 125.806 1.642 . . . . 0.0 111.506 175.701 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.0 mp -115.31 3.64 14.26 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 125.408 1.483 . . . . 0.0 114.054 -174.0 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 42.3 m-80 56.13 61.13 2.87 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 126.347 1.859 . . . . 0.0 113.291 -179.171 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.462 HG13 ' HA ' ' A' ' 61' ' ' SER . 0.9 OUTLIER -134.82 178.11 5.9 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.715 0 C-N-CA 127.64 2.376 . . . . 0.0 111.226 -171.979 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.3 p -80.54 159.97 25.33 Favored 'General case' 0 N--CA 1.48 1.044 0 O-C-N 120.82 -1.175 . . . . 0.0 111.656 173.175 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 84.3 t -62.3 -29.13 45.98 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 C-N-CA 123.384 0.674 . . . . 0.0 111.303 172.943 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -81.28 -36.87 29.32 Favored 'General case' 0 N--CA 1.468 0.458 0 O-C-N 120.917 -1.114 . . . . 0.0 110.433 -179.436 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 9.7 tmtt? -64.08 -45.26 89.51 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 125.129 1.372 . . . . 0.0 110.702 175.922 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -60.0 -49.69 76.67 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 125.877 1.671 . . . . 0.0 113.008 170.335 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 34.7 ttmt -71.44 -23.14 61.79 Favored 'General case' 0 N--CA 1.466 0.332 0 O-C-N 121.003 -1.061 . . . . 0.0 111.876 -174.353 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -52.9 -40.34 63.44 Favored 'General case' 0 CA--C 1.546 0.796 0 CA-C-N 118.211 0.459 . . . . 0.0 111.324 172.039 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 27.8 m-85 -68.78 -40.72 79.52 Favored 'General case' 0 C--O 1.224 -0.238 0 C-N-CA 123.781 0.832 . . . . 0.0 111.486 179.5 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 61.2 mt -69.71 -26.85 31.53 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.676 0 C-N-CA 125.471 1.509 . . . . 0.0 111.121 179.666 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 71.2 mmtt -82.03 -32.0 30.69 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 125.016 1.326 . . . . 0.0 112.78 172.843 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 38.6 m-20 . . . . . 0 C--O 1.232 0.161 0 C-N-CA 124.42 1.088 . . . . 0.0 111.082 -177.522 . . . . . . . . 0 0 . 1 . 030 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 63.5 mm-40 . . . . . 0 N--CA 1.473 0.714 0 CA-C-O 121.212 0.529 . . . . 0.0 112.247 . . . . . . . . . 0 0 . 1 . 030 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -123.09 101.53 7.46 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 125.308 1.443 . . . . 0.0 110.244 174.219 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 8.5 p -149.94 131.54 5.34 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 C-N-CA 124.982 1.313 . . . . 0.0 110.874 177.814 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 45.4 t -162.8 -64.93 0.05 OUTLIER 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 124.135 0.974 . . . . 0.0 112.247 173.697 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 11.1 t -89.31 -27.84 20.26 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 124.09 0.956 . . . . 0.0 113.336 -175.303 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 65.5 mtt -130.89 134.66 46.98 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 125.67 1.588 . . . . 0.0 110.259 173.359 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -136.5 5.26 2.93 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 125.449 1.5 . . . . 0.0 113.924 -175.364 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -114.64 159.49 20.42 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.871 1.669 . . . . 0.0 113.003 -174.595 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 9.5 mtpm? . . . . . 0 N--CA 1.477 0.896 0 C-N-CA 125.739 1.616 . . . . 0.0 110.309 179.666 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.564 0 N-CA-C 111.221 -0.752 . . . . 0.0 111.221 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 23.8 t -144.22 135.17 25.22 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 124.833 1.253 . . . . 0.0 111.111 176.316 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 27.1 t-80 -154.96 158.26 38.95 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 125.471 1.508 . . . . 0.0 111.278 179.712 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 26.7 ttt -148.24 143.56 27.06 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 124.801 1.24 . . . . 0.0 111.841 178.615 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -130.79 152.5 50.06 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.644 1.177 . . . . 0.0 112.57 171.607 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 7.8 t -157.42 167.27 30.72 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 125.757 1.623 . . . . 0.0 110.585 173.955 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 64.6 ttp -122.64 128.15 50.26 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 125.44 1.496 . . . . 0.0 111.247 174.537 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -141.24 159.17 62.25 Favored Pre-proline 0 CA--C 1.547 0.861 0 C-N-CA 126.181 1.792 . . . . 0.0 111.098 178.167 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -71.17 -13.07 30.91 Favored 'Trans proline' 0 C--N 1.35 0.658 0 C-N-CA 122.777 2.318 . . . . 0.0 114.624 176.556 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 97.8 mt -107.64 45.96 0.97 Allowed 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 126.186 1.795 . . . . 0.0 112.918 -173.414 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 37.3 m-20 -105.49 -0.57 25.8 Favored 'General case' 0 N--CA 1.48 1.036 0 N-CA-C 114.67 1.359 . . . . 0.0 114.67 173.421 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -126.92 -58.8 1.29 Allowed 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 124.165 0.986 . . . . 0.0 113.625 -164.99 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.6 pp -109.19 5.37 9.24 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.786 0 C-N-CA 125.767 1.627 . . . . 0.0 113.227 -175.947 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 14.1 tt -45.57 -45.62 4.39 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.085 0 N-CA-C 115.398 1.629 . . . . 0.0 115.398 -170.638 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -144.74 22.86 1.6 Allowed 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 124.874 1.27 . . . . 0.0 112.892 -168.407 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -83.05 12.72 4.68 Favored 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 115.526 1.676 . . . . 0.0 115.526 -161.441 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 12.9 tt -146.23 26.51 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.913 0 C-N-CA 125.538 1.535 . . . . 0.0 113.7 -178.715 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -129.91 -46.02 1.15 Allowed 'General case' 0 N--CA 1.476 0.871 0 N-CA-C 114.195 1.183 . . . . 0.0 114.195 177.936 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 36.4 mmtt -146.22 145.98 30.61 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 126.241 1.816 . . . . 0.0 111.919 -169.443 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 5.9 mp0 -126.23 150.86 48.1 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 125.157 1.383 . . . . 0.0 111.697 172.7 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -156.67 172.2 19.01 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.517 1.527 . . . . 0.0 111.831 -174.896 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 -144.52 130.97 19.82 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 124.648 1.179 . . . . 0.0 110.676 176.985 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 13.9 m-20 -136.63 151.22 49.07 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 125.403 1.481 . . . . 0.0 111.471 -178.543 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 71.2 p -81.72 -7.0 59.55 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 115.257 1.577 . . . . 0.0 115.257 -176.649 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -174.69 98.65 0.13 Allowed Glycine 0 CA--C 1.527 0.827 0 O-C-N 121.892 -0.505 . . . . 0.0 113.509 170.081 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 15.0 p -144.55 135.89 21.1 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 C-N-CA 125.37 1.468 . . . . 0.0 110.761 172.75 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 61.9 m 61.54 156.75 0.04 OUTLIER 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 126.883 2.073 . . . . 0.0 115.478 178.428 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -140.18 17.62 2.43 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 116.199 1.925 . . . . 0.0 116.199 -176.647 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -151.38 113.32 3.03 Favored Pre-proline 0 CA--C 1.548 0.881 0 C-N-CA 124.465 1.106 . . . . 0.0 112.818 -175.411 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -87.07 -29.75 0.37 Allowed 'Trans proline' 0 CA--C 1.542 0.912 0 C-N-CA 122.836 2.357 . . . . 0.0 113.508 176.668 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 22.4 tp -153.07 64.86 0.77 Allowed 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 125.136 1.374 . . . . 0.0 111.201 -175.743 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 49.7 m 56.22 36.52 27.6 Favored 'General case' 0 N--CA 1.478 0.949 0 N-CA-C 114.742 1.386 . . . . 0.0 114.742 174.869 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 9.5 p -154.25 144.06 15.4 Favored Pre-proline 0 N--CA 1.474 0.757 0 C-N-CA 126.242 1.817 . . . . 0.0 109.45 -173.606 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 83.2 Cg_endo -76.61 64.99 7.48 Favored 'Trans proline' 0 CA--C 1.55 1.278 0 C-N-CA 123.534 2.822 . . . . 0.0 112.803 -177.929 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 34.5 tptt 58.25 114.96 0.02 OUTLIER Pre-proline 0 N--CA 1.482 1.125 0 C-N-CA 129.941 3.296 . . . . 0.0 114.331 -172.409 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 96.3 Cg_endo -75.12 145.31 30.9 Favored 'Trans proline' 0 CA--C 1.538 0.703 0 C-N-CA 122.774 2.316 . . . . 0.0 111.663 -178.965 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 17.9 ptmt -72.35 140.22 48.34 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 124.173 0.989 . . . . 0.0 112.744 -177.935 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 14.9 tp -140.55 140.16 35.14 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.95 1.7 . . . . 0.0 110.907 -173.857 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -148.39 48.42 1.04 Allowed 'General case' 0 N--CA 1.476 0.86 0 CA-C-O 122.85 1.309 . . . . 0.0 113.081 -179.353 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 -107.37 80.88 1.46 Allowed 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.977 1.311 . . . . 0.0 113.465 -171.744 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 65.0 mt -129.69 160.42 33.41 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 126.892 2.077 . . . . 0.0 112.17 173.756 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 18.8 t -73.21 168.4 19.2 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 123.579 0.752 . . . . 0.0 110.642 170.938 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -57.76 -46.94 83.84 Favored 'General case' 0 N--CA 1.475 0.791 0 O-C-N 120.49 -1.381 . . . . 0.0 112.657 -175.465 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 10.4 tt0 -70.79 -42.42 70.36 Favored 'General case' 0 N--CA 1.47 0.529 0 O-C-N 121.5 -0.75 . . . . 0.0 111.105 177.985 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 31.1 mm-40 -57.37 -45.71 84.13 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.952 0.901 . . . . 0.0 111.095 176.297 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 41.3 ttmt -61.49 -40.59 95.12 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 124.514 1.126 . . . . 0.0 111.292 177.966 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 56.4 mt -66.85 -40.42 85.81 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 CA-C-O 118.103 -0.951 . . . . 0.0 111.327 175.261 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 42.7 mt -63.51 -45.29 98.18 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.98 0 CA-C-N 120.828 1.649 . . . . 0.0 110.468 177.343 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -58.75 -48.91 79.57 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.359 1.064 . . . . 0.0 110.917 176.328 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -67.21 -52.1 45.3 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.97 1.308 . . . . 0.0 112.978 -179.19 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.9 mm-40 -60.84 -27.65 68.24 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-N 119.104 0.866 . . . . 0.0 112.793 -179.247 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -68.04 -58.15 4.96 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 123.392 0.677 . . . . 0.0 110.967 175.061 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 79.7 mt -62.6 -34.11 63.36 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.453 0 C-N-CA 126.649 1.979 . . . . 0.0 111.447 178.987 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -70.39 -25.86 63.44 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.105 0.962 . . . . 0.0 112.791 176.808 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -89.75 -39.11 13.35 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.26 1.024 . . . . 0.0 112.214 175.954 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.3 m -111.12 -5.2 11.21 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.147 0 N-CA-C 114.541 1.312 . . . . 0.0 114.541 -172.02 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 86.98 26.13 32.4 Favored Glycine 0 N--CA 1.473 1.117 0 C-N-CA 124.641 1.115 . . . . 0.0 115.737 159.508 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 55.9 10.98 0.63 Allowed 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 127.42 2.288 . . . . 0.0 115.18 -175.013 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 5.2 pt20 -124.06 -3.99 8.02 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 125.338 1.455 . . . . 0.0 113.573 -170.453 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 61.9 m-80 -122.01 0.4 9.66 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.09 1.356 . . . . 0.0 113.034 174.377 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 18.8 pt -76.86 154.52 5.63 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 C-N-CA 123.219 0.608 . . . . 0.0 111.597 176.364 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -139.16 145.05 38.89 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 125.045 1.338 . . . . 0.0 109.59 179.417 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -62.01 -27.58 68.97 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 118.875 0.761 . . . . 0.0 112.049 179.35 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -65.26 -49.94 76.15 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.432 0 C-N-CA 125.241 1.416 . . . . 0.0 109.888 175.179 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 76.5 m -78.49 -43.0 28.1 Favored 'General case' 0 C--O 1.222 -0.394 0 C-N-CA 123.685 0.794 . . . . 0.0 109.967 -175.04 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 24.2 tp -61.13 -34.35 74.85 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 124.962 1.305 . . . . 0.0 112.045 174.085 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.471 ' HA ' HG13 ' A' ' 66' ' ' ILE . 47.0 t -56.05 -31.51 63.23 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.149 0.98 . . . . 0.0 113.179 168.368 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -101.93 -19.06 15.4 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 125.254 1.422 . . . . 0.0 114.441 -175.565 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 68.8 mmtt -66.89 -40.35 87.74 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 124.386 1.074 . . . . 0.0 110.5 171.551 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.7 mp -106.74 -2.4 21.6 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.254 1.422 . . . . 0.0 114.438 -175.159 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 50.6 m-80 54.79 49.05 18.77 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 125.521 1.528 . . . . 0.0 112.457 -172.947 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.471 HG13 ' HA ' ' A' ' 61' ' ' SER . 15.3 pt -107.05 -162.01 0.15 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.662 0 C-N-CA 126.419 1.887 . . . . 0.0 110.994 -179.309 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 47.0 p -97.02 159.75 14.73 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 124.508 1.123 . . . . 0.0 111.316 167.125 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 93.5 t -62.06 -23.78 32.63 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.876 0 O-C-N 121.574 -0.704 . . . . 0.0 111.21 169.559 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 13.7 mp0 -81.43 -32.24 32.77 Favored 'General case' 0 CA--C 1.531 0.236 0 O-C-N 120.689 -1.257 . . . . 0.0 110.298 -176.654 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 41.0 mttm -66.79 -52.99 37.6 Favored 'General case' 0 C--N 1.346 0.43 0 CA-C-N 118.634 0.652 . . . . 0.0 110.256 165.044 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -57.8 -41.5 82.3 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 124.052 0.941 . . . . 0.0 112.362 -172.393 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt -73.36 -27.65 61.61 Favored 'General case' 0 N--CA 1.463 0.184 0 C-N-CA 125.489 1.516 . . . . 0.0 111.976 179.347 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -60.74 -45.37 94.57 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 118.067 0.394 . . . . 0.0 111.571 176.929 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 66.2 m-85 -59.96 -44.98 94.08 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 124.875 1.27 . . . . 0.0 111.046 179.153 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 95.3 mt -64.39 -29.58 47.75 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.709 0 C-N-CA 124.459 1.104 . . . . 0.0 111.308 -178.572 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 50.0 mmtt -83.21 -36.57 24.53 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 125.472 1.509 . . . . 0.0 113.509 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 5.7 p30 -93.75 -43.37 8.66 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 119.976 1.262 . . . . 0.0 112.004 -179.915 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 20.8 m -102.01 97.2 7.56 Favored 'General case' 0 C--O 1.231 0.088 0 C-N-CA 123.386 0.675 . . . . 0.0 111.27 -177.823 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 -140.49 -58.27 0.53 Allowed 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 113.461 0.912 . . . . 0.0 113.461 -174.118 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 2.2 mpt_? -79.01 -19.83 50.56 Favored 'General case' 0 N--CA 1.484 1.26 0 N-CA-C 113.453 0.908 . . . . 0.0 113.453 179.371 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 6.5 tt -60.54 -36.1 77.61 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 124.662 1.185 . . . . 0.0 111.371 174.314 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -90.57 9.01 78.9 Favored Glycine 0 CA--C 1.54 1.594 0 C-N-CA 125.026 1.298 . . . . 0.0 116.017 175.341 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 8.2 mmt85 -101.31 -88.96 0.36 Allowed 'General case' 0 N--CA 1.477 0.923 0 CA-C-N 119.253 1.526 . . . . 0.0 110.696 176.725 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 4.3 t -157.61 124.81 5.12 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 124.438 1.095 . . . . 0.0 110.709 178.507 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 6.3 p30 -150.83 15.16 0.75 Allowed 'General case' 0 CA--C 1.552 1.031 0 C-N-CA 125.708 1.603 . . . . 0.0 112.956 -176.997 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 47.8 t30 -99.29 44.73 1.01 Allowed 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 125.79 1.636 . . . . 0.0 112.198 -176.396 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 6.8 tp -149.89 163.71 37.32 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.164 1.385 . . . . 0.0 110.899 -177.485 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 58.6 pttt -121.8 12.43 10.57 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 126.182 1.793 . . . . 0.0 113.458 -171.373 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 14.6 t -148.85 125.76 11.25 Favored 'General case' 0 C--O 1.233 0.209 0 C-N-CA 125.043 1.337 . . . . 0.0 109.97 173.171 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -138.0 1.78 0.72 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.725 0 C-N-CA 125.86 1.664 . . . . 0.0 113.602 -177.932 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 63.22 14.82 55.23 Favored Glycine 0 CA--C 1.539 1.542 0 O-C-N 121.0 -1.063 . . . . 0.0 114.952 -172.7 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . 0.271 3.1 mt 53.89 42.27 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.991 0 C-N-CA 126.685 1.994 . . . . 0.0 111.818 175.293 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 11.4 tp 54.52 25.38 6.15 Favored 'General case' 0 CA--C 1.552 1.046 0 C-N-CA 126.4 1.88 . . . . 0.0 114.581 -179.836 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 33.3 mt-30 -133.15 23.4 4.15 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 125.628 1.571 . . . . 0.0 113.017 -167.772 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -74.66 -62.93 1.36 Allowed 'General case' 0 N--CA 1.475 0.783 0 O-C-N 120.974 -1.079 . . . . 0.0 112.404 -179.856 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 55.79 48.13 18.88 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 125.951 1.701 . . . . 0.0 114.885 -179.128 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 20.8 t -131.52 135.89 58.36 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 C-N-CA 124.929 1.292 . . . . 0.0 111.434 178.221 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 50.1 m 52.72 31.96 11.24 Favored 'General case' 0 N--CA 1.483 1.184 0 N-CA-C 116.018 1.859 . . . . 0.0 116.018 170.053 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 32.3 t -149.54 -46.44 0.14 Allowed 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 124.354 1.062 . . . . 0.0 112.614 178.812 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 62.5 mtt -127.02 51.94 1.83 Allowed 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 125.414 1.486 . . . . 0.0 111.163 179.741 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -77.96 50.87 0.91 Allowed 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 125.9 1.68 . . . . 0.0 112.488 -178.485 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -135.87 166.11 24.06 Favored 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 125.989 1.716 . . . . 0.0 112.943 -172.852 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 65.2 pttt -140.04 168.46 19.75 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 125.902 1.681 . . . . 0.0 112.589 176.297 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 9.3 t -132.48 165.12 25.05 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 125.915 1.686 . . . . 0.0 111.127 171.954 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 10.1 ttt -142.79 158.94 43.13 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 125.129 1.372 . . . . 0.0 112.031 -175.78 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 9.2 m -98.58 143.22 29.22 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 124.839 1.256 . . . . 0.0 111.429 176.248 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 18.7 m-90 . . . . . 0 C--O 1.252 1.22 0 C-N-CA 126.276 1.83 . . . . 0.0 111.734 171.366 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.641 0 N-CA-C 111.319 -0.712 . . . . 0.0 111.319 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 21.3 t -72.14 146.92 47.13 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.799 0.84 . . . . 0.0 112.557 179.457 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 35.3 t-80 -95.59 81.2 3.5 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 124.776 1.23 . . . . 0.0 110.929 179.082 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 59.6 ttp -146.3 133.23 20.2 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 125.075 1.35 . . . . 0.0 111.063 177.718 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -151.74 163.48 39.04 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 124.645 1.178 . . . . 0.0 112.335 174.282 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 80.2 p -142.61 135.64 28.37 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 124.698 1.199 . . . . 0.0 112.382 -175.933 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 58.6 ttm -159.53 129.64 5.61 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.598 1.559 . . . . 0.0 109.954 175.396 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 -136.68 153.58 75.93 Favored Pre-proline 0 CA--C 1.547 0.857 0 C-N-CA 125.049 1.34 . . . . 0.0 112.05 179.019 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 96.1 Cg_endo -79.56 -0.68 10.9 Favored 'Trans proline' 0 C--N 1.35 0.651 0 C-N-CA 123.581 2.854 . . . . 0.0 114.909 -178.718 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 89.1 mt -112.27 42.57 1.77 Allowed 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.899 1.68 . . . . 0.0 112.535 -174.584 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -112.6 0.8 15.54 Favored 'General case' 0 N--CA 1.478 0.969 0 N-CA-C 114.652 1.353 . . . . 0.0 114.652 175.761 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -117.4 -55.67 2.29 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 124.311 1.044 . . . . 0.0 113.175 -168.453 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -130.07 17.7 2.26 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.767 0 C-N-CA 126.138 1.775 . . . . 0.0 112.928 -175.301 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 9.9 tt -46.25 125.62 1.54 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 C-N-CA 124.461 1.105 . . . . 0.0 112.282 177.304 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -145.99 5.86 1.01 Allowed 'General case' 0 CA--C 1.545 0.759 0 N-CA-C 113.83 1.048 . . . . 0.0 113.83 -179.467 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -83.19 10.23 8.81 Favored 'General case' 0 CA--C 1.547 0.831 0 N-CA-C 114.553 1.316 . . . . 0.0 114.553 -172.55 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 7.1 tp -143.64 28.39 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.775 0 C-N-CA 126.607 1.963 . . . . 0.0 112.434 -177.416 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -126.8 -43.33 1.71 Allowed 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 114.523 1.305 . . . . 0.0 114.523 -178.438 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 13.5 ttpp -133.13 158.07 43.72 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 125.65 1.58 . . . . 0.0 112.659 -174.091 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -117.65 169.69 9.37 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 126.275 1.83 . . . . 0.0 111.966 176.49 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -149.35 155.06 39.9 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 126.01 1.724 . . . . 0.0 111.198 176.993 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 17.0 t-20 -81.98 -26.52 33.84 Favored 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 113.417 0.895 . . . . 0.0 113.417 -177.998 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 23.8 m-20 -138.52 142.11 39.32 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 126.429 1.892 . . . . 0.0 110.816 172.729 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 23.0 t -149.21 102.5 3.23 Favored 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 124.619 1.168 . . . . 0.0 109.86 172.309 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 128.29 -6.71 6.73 Favored Glycine 0 N--CA 1.476 1.32 0 C-N-CA 125.265 1.412 . . . . 0.0 115.821 174.676 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 7.5 p -137.58 126.55 34.31 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.6 0 C-N-CA 125.26 1.424 . . . . 0.0 110.86 178.098 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -155.64 158.66 38.69 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 124.779 1.232 . . . . 0.0 112.904 179.622 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 3.3 mp -98.93 88.37 3.97 Favored 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 126.044 1.738 . . . . 0.0 110.315 -175.46 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -150.84 105.19 3.03 Favored Pre-proline 0 CA--C 1.548 0.901 0 CA-C-N 115.513 -0.767 . . . . 0.0 112.395 -157.213 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -81.1 -37.5 0.3 Allowed 'Trans proline' 0 C--N 1.354 0.829 0 C-N-CA 122.481 2.12 . . . . 0.0 113.716 -174.399 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 18.3 mt -143.18 67.33 1.3 Allowed 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 125.67 1.588 . . . . 0.0 111.347 -175.89 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 1.4 t 56.65 35.19 25.76 Favored 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 114.253 1.205 . . . . 0.0 114.253 174.043 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 9.5 p -156.09 141.58 12.6 Favored Pre-proline 0 N--CA 1.472 0.625 0 C-N-CA 126.461 1.904 . . . . 0.0 109.393 -174.039 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -77.36 67.76 7.66 Favored 'Trans proline' 0 CA--C 1.547 1.147 0 C-N-CA 123.546 2.831 . . . . 0.0 112.099 -178.607 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 43.7 tptt 60.67 112.98 0.02 OUTLIER Pre-proline 0 N--CA 1.481 1.092 0 C-N-CA 129.472 3.109 . . . . 0.0 113.425 -172.788 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -69.55 147.66 64.72 Favored 'Trans proline' 0 CA--C 1.537 0.672 0 C-N-CA 122.617 2.211 . . . . 0.0 111.757 -175.767 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.96 139.67 57.25 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.021 0.928 . . . . 0.0 111.823 -176.897 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.6 tp -154.38 130.38 10.23 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 124.939 1.295 . . . . 0.0 111.746 176.113 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -137.23 129.41 29.44 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 126.212 1.805 . . . . 0.0 108.03 156.994 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -145.11 70.41 1.27 Allowed 'General case' 0 CA--C 1.54 0.57 0 CA-C-O 122.572 1.177 . . . . 0.0 110.188 -177.718 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 27.3 mt -125.28 155.64 39.85 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 126.233 1.813 . . . . 0.0 111.032 -170.279 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 19.2 t -72.0 170.52 13.66 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.29 0.636 . . . . 0.0 110.417 167.341 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -58.95 -47.37 85.32 Favored 'General case' 0 N--CA 1.473 0.678 0 O-C-N 120.479 -1.388 . . . . 0.0 112.404 -175.9 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 12.0 tt0 -70.06 -41.27 74.38 Favored 'General case' 0 N--CA 1.471 0.575 0 O-C-N 121.494 -0.754 . . . . 0.0 111.256 178.454 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 38.4 mm-40 -58.55 -44.23 89.57 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.831 1.252 . . . . 0.0 111.301 175.45 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 19.7 ttmm -63.14 -41.89 99.37 Favored 'General case' 0 N--CA 1.471 0.604 0 O-C-N 121.056 -1.028 . . . . 0.0 111.065 175.106 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 57.3 mt -67.61 -40.86 84.93 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 CA-C-O 117.713 -1.137 . . . . 0.0 111.879 178.583 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 34.8 mt -63.82 -43.89 98.02 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 CA-C-N 121.384 1.902 . . . . 0.0 109.954 176.967 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -59.39 -45.95 90.05 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.651 1.18 . . . . 0.0 110.91 177.214 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -66.45 -51.59 55.26 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.949 1.3 . . . . 0.0 112.984 176.55 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -58.18 -31.34 67.2 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 119.289 0.949 . . . . 0.0 112.752 179.716 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -66.5 -56.36 11.27 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 118.516 0.598 . . . . 0.0 110.748 177.492 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 84.1 mt -63.32 -33.26 60.12 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.417 0 C-N-CA 126.758 2.023 . . . . 0.0 111.478 177.72 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -71.54 -27.72 63.37 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 123.873 0.869 . . . . 0.0 112.552 176.825 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -87.54 -39.72 14.9 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.317 1.047 . . . . 0.0 112.206 176.47 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.4 m -108.27 -4.16 10.4 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.161 0 N-CA-C 114.221 1.193 . . . . 0.0 114.221 -173.854 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 84.47 23.03 52.41 Favored Glycine 0 N--CA 1.471 1.01 0 C-N-CA 125.134 1.35 . . . . 0.0 115.345 160.972 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 58.33 5.0 0.37 Allowed 'General case' 0 CA--C 1.554 1.126 0 C-N-CA 127.382 2.273 . . . . 0.0 115.104 -171.028 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 29.1 mt-30 -101.5 -16.22 16.87 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 125.66 1.584 . . . . 0.0 112.857 -172.964 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 42.3 m-80 -125.88 5.74 7.33 Favored 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 113.804 1.038 . . . . 0.0 113.804 -172.789 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 21.1 pt -77.61 154.09 5.36 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 O-C-N 121.776 -0.578 . . . . 0.0 111.781 174.678 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -140.02 142.74 36.21 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 124.777 1.231 . . . . 0.0 109.427 177.999 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -59.47 -26.3 65.12 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 119.252 0.933 . . . . 0.0 112.597 -179.121 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.9 mp -69.71 -42.31 80.25 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 C-N-CA 126.101 1.76 . . . . 0.0 110.864 175.95 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 95.9 m -80.9 -42.31 21.61 Favored 'General case' 0 C--O 1.224 -0.288 0 C-N-CA 123.472 0.709 . . . . 0.0 109.777 -179.133 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 14.5 tp -61.97 -37.96 86.73 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 125.978 1.711 . . . . 0.0 111.523 175.324 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.446 ' HA ' HG13 ' A' ' 66' ' ' ILE . 57.3 p -62.28 -23.81 66.93 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 113.363 0.875 . . . . 0.0 113.363 172.119 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 66.5 mttm -101.72 -28.48 12.45 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 125.221 1.409 . . . . 0.0 114.278 -176.432 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 10.7 mmtm -63.13 -33.23 75.02 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 125.396 1.479 . . . . 0.0 111.846 174.548 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.9 mt -118.75 0.81 11.52 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 126.531 1.932 . . . . 0.0 113.011 -169.497 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 42.5 m-80 53.69 59.07 4.56 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 126.222 1.809 . . . . 0.0 113.028 -178.288 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.446 HG13 ' HA ' ' A' ' 61' ' ' SER . 0.8 OUTLIER -131.47 175.39 11.35 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.717 0 C-N-CA 126.93 2.092 . . . . 0.0 111.693 -172.277 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -74.6 154.84 38.38 Favored 'General case' 0 N--CA 1.473 0.706 0 O-C-N 121.408 -0.807 . . . . 0.0 111.144 172.748 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 69.3 t -64.89 -27.65 42.94 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 C-N-CA 123.816 0.846 . . . . 0.0 111.565 171.406 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -79.69 -29.77 40.88 Favored 'General case' 0 N--CA 1.466 0.366 0 O-C-N 121.086 -1.008 . . . . 0.0 110.822 179.768 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 4.7 ttmm -72.82 -46.21 54.31 Favored 'General case' 0 C--N 1.341 0.201 0 C-N-CA 124.225 1.01 . . . . 0.0 110.717 171.619 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -60.49 -49.04 79.14 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 125.059 1.344 . . . . 0.0 112.621 178.355 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 18.3 ptmt -69.43 -27.03 64.91 Favored 'General case' 0 N--CA 1.469 0.475 0 O-C-N 121.165 -0.96 . . . . 0.0 111.471 -177.463 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -57.16 -36.3 70.59 Favored 'General case' 0 CA--C 1.549 0.909 0 CA-C-N 118.152 0.433 . . . . 0.0 112.135 177.539 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 29.5 m-85 -68.2 -45.17 74.1 Favored 'General case' 0 C--O 1.225 -0.19 0 C-N-CA 125.084 1.353 . . . . 0.0 110.744 175.659 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 56.1 mt -65.55 -33.6 64.73 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.562 0 C-N-CA 124.47 1.108 . . . . 0.0 111.145 -179.702 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 72.6 mmtt -75.49 -38.25 59.65 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 124.205 1.002 . . . . 0.0 112.609 -178.033 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 6.7 p30 -85.97 -44.92 11.96 Favored 'General case' 0 C--N 1.344 0.341 0 CA-C-N 119.514 1.052 . . . . 0.0 110.703 176.471 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 7.8 t -95.87 87.78 4.73 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-O 121.305 0.574 . . . . 0.0 110.408 -174.269 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -141.86 -50.99 0.41 Allowed 'General case' 0 CA--C 1.539 0.536 0 N-CA-C 113.907 1.077 . . . . 0.0 113.907 -171.973 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 3.2 mpt_? -80.04 -10.23 59.75 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 124.291 1.036 . . . . 0.0 113.515 -179.529 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.0 mt -76.53 -46.79 24.99 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.641 1.176 . . . . 0.0 112.675 175.701 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -88.28 105.9 3.18 Favored Glycine 0 CA--C 1.533 1.2 0 C-N-CA 123.781 0.705 . . . . 0.0 111.631 178.177 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 14.3 mmm-85 -113.69 157.45 22.16 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 125.356 1.463 . . . . 0.0 113.008 -169.183 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 6.9 t -71.42 -26.65 62.84 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 125.431 1.492 . . . . 0.0 113.526 -178.806 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 73.8 m-80 -83.17 121.82 27.57 Favored 'General case' 0 CA--C 1.541 0.624 0 O-C-N 121.559 -0.713 . . . . 0.0 112.126 -178.546 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 56.5 t30 -150.47 175.28 12.02 Favored 'General case' 0 CA--C 1.551 1.01 0 C-N-CA 126.886 2.075 . . . . 0.0 109.553 177.54 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 10.2 tp 58.87 32.57 22.37 Favored 'General case' 0 CA--C 1.551 0.985 0 C-N-CA 125.044 1.338 . . . . 0.0 113.473 178.564 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 17.2 ptmt -123.31 2.47 9.13 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 126.559 1.944 . . . . 0.0 114.244 -173.712 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 14.0 t -149.52 123.44 9.36 Favored 'General case' 0 N--CA 1.465 0.282 0 C-N-CA 125.138 1.375 . . . . 0.0 109.712 174.46 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -139.86 4.59 0.58 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.83 0 C-N-CA 126.016 1.726 . . . . 0.0 113.069 -178.078 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 69.84 5.73 53.1 Favored Glycine 0 CA--C 1.538 1.505 0 O-C-N 120.885 -1.134 . . . . 0.0 114.941 -171.042 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . 0.251 14.3 mm 53.81 31.57 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.139 0 C-N-CA 126.741 2.016 . . . . 0.0 112.117 176.061 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 11.9 tp 52.65 29.96 8.06 Favored 'General case' 0 CA--C 1.554 1.114 0 C-N-CA 126.415 1.886 . . . . 0.0 114.578 -178.896 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 7.2 pt20 -130.65 29.34 4.8 Favored 'General case' 0 N--CA 1.476 0.831 0 N-CA-C 114.358 1.244 . . . . 0.0 114.358 -173.608 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -128.11 142.24 51.26 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 124.707 1.203 . . . . 0.0 112.528 -175.748 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -82.73 60.28 5.2 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 125.78 1.632 . . . . 0.0 112.72 -174.304 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 88.8 t -137.64 148.24 25.81 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 C-N-CA 125.838 1.655 . . . . 0.0 110.524 -178.792 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 10.7 t 65.44 -54.65 0.34 Allowed 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 128.061 2.544 . . . . 0.0 115.735 179.03 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 50.0 m -65.56 -33.08 75.07 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 124.159 0.984 . . . . 0.0 112.316 176.629 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 22.4 mmt -138.6 143.67 39.45 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 126.759 2.024 . . . . 0.0 109.419 165.003 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 15.1 tt0 -146.55 3.37 0.86 Allowed 'General case' 0 CA--C 1.551 1.001 0 N-CA-C 113.573 0.953 . . . . 0.0 113.573 -179.332 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -81.96 153.24 26.36 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 124.767 1.227 . . . . 0.0 113.044 -177.996 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 75.8 mmtt -121.91 5.7 9.89 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 125.816 1.646 . . . . 0.0 113.99 179.551 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 42.0 p -81.95 159.01 23.69 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 125.463 1.505 . . . . 0.0 113.211 179.005 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 1.3 mpt? -86.19 151.68 23.45 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.796 1.238 . . . . 0.0 112.323 178.054 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 7.0 t -86.37 166.95 15.18 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 124.418 1.087 . . . . 0.0 112.229 168.637 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 48.4 t-105 . . . . . 0 C--O 1.253 1.255 0 C-N-CA 125.727 1.611 . . . . 0.0 112.671 -173.251 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.692 0 N-CA-C 112.09 -0.404 . . . . 0.0 112.09 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 35.9 t -143.41 -61.11 0.41 Allowed 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 124.357 1.063 . . . . 0.0 112.049 177.451 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 53.5 t60 -147.74 93.53 2.22 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.734 1.214 . . . . 0.0 110.371 175.348 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 16.7 ptp -145.45 37.97 1.13 Allowed 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 124.874 1.27 . . . . 0.0 113.332 -173.732 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -147.94 168.49 22.13 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.035 0.934 . . . . 0.0 113.406 -175.357 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 99.7 p -132.97 161.26 34.78 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 126.246 1.818 . . . . 0.0 111.98 -177.283 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 52.0 ttm -121.2 105.04 10.21 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 125.277 1.431 . . . . 0.0 109.98 -178.559 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -152.17 138.49 11.85 Favored Pre-proline 0 CA--C 1.551 1.002 0 C-N-CA 124.645 1.178 . . . . 0.0 111.749 -173.42 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 81.6 Cg_endo -82.8 -2.57 10.95 Favored 'Trans proline' 0 C--N 1.352 0.732 0 C-N-CA 123.287 2.658 . . . . 0.0 115.919 -176.993 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 67.3 mt -109.54 38.99 2.19 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 125.366 1.466 . . . . 0.0 113.227 -174.066 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -104.68 -0.49 27.44 Favored 'General case' 0 N--CA 1.48 1.035 0 N-CA-C 115.387 1.625 . . . . 0.0 115.387 175.454 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -115.68 -56.28 2.35 Favored 'General case' 0 N--CA 1.484 1.231 0 N-CA-C 113.598 0.962 . . . . 0.0 113.598 -167.534 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.9 pp -129.3 12.68 2.59 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.896 0 C-N-CA 126.005 1.722 . . . . 0.0 112.963 -171.599 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 12.9 tt -40.95 123.84 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.947 0 C-N-CA 125.646 1.579 . . . . 0.0 113.902 -177.419 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -153.67 120.85 5.76 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.452 1.501 . . . . 0.0 108.787 172.473 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 30.1 t0 -161.96 70.7 0.33 Allowed 'General case' 0 N--CA 1.469 0.51 0 CA-C-O 122.352 1.072 . . . . 0.0 109.148 -178.81 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 54.7 mt 53.41 63.01 0.21 Allowed 'Isoleucine or valine' 0 CA--C 1.548 0.867 0 C-N-CA 125.699 1.6 . . . . 0.0 110.414 -169.922 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 4.0 tmmm? -151.51 -44.98 0.11 Allowed 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.882 1.273 . . . . 0.0 112.325 176.245 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 62.0 mttm -109.04 164.93 11.98 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 126.104 1.762 . . . . 0.0 112.547 174.885 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -132.8 149.02 52.31 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 126.193 1.797 . . . . 0.0 110.91 -177.567 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -142.03 153.69 44.42 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.813 1.245 . . . . 0.0 112.677 -177.914 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 7.7 t30 -79.16 -32.64 44.36 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 123.704 0.801 . . . . 0.0 113.033 -178.09 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 -139.42 98.9 3.6 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 125.585 1.554 . . . . 0.0 110.181 -177.77 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 80.7 p -132.88 -5.78 3.15 Favored 'General case' 0 N--CA 1.479 1.023 0 N-CA-C 115.776 1.769 . . . . 0.0 115.776 -173.492 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -176.51 41.21 0.1 Allowed Glycine 0 CA--C 1.53 0.997 0 O-C-N 121.716 -0.615 . . . . 0.0 114.292 177.281 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 12.0 p -141.78 17.13 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.017 0 C-N-CA 125.319 1.448 . . . . 0.0 112.528 -165.355 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.411 HG22 ' H ' ' A' ' 22' ' ' LEU . 0.2 OUTLIER -117.88 166.99 11.82 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 125.503 1.521 . . . . 0.0 112.056 -172.074 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.411 ' H ' HG22 ' A' ' 21' ' ' THR . 17.7 mt -81.05 28.09 0.37 Allowed 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 127.202 2.201 . . . . 0.0 114.133 -166.785 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -153.4 116.25 2.72 Favored Pre-proline 0 CA--C 1.548 0.894 0 C-N-CA 124.926 1.29 . . . . 0.0 112.286 -163.356 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_endo -84.42 -29.12 0.9 Allowed 'Trans proline' 0 CA--C 1.541 0.846 0 C-N-CA 122.653 2.236 . . . . 0.0 113.898 -178.771 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 17.6 tp -150.71 58.92 0.93 Allowed 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 124.517 1.127 . . . . 0.0 111.962 -173.207 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 1.9 t 56.95 36.92 28.42 Favored 'General case' 0 N--CA 1.48 1.029 0 N-CA-C 114.255 1.205 . . . . 0.0 114.255 179.647 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 7.4 p -155.3 141.26 12.86 Favored Pre-proline 0 N--CA 1.472 0.63 0 C-N-CA 126.215 1.806 . . . . 0.0 109.186 -175.502 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 93.0 Cg_endo -78.3 64.13 8.42 Favored 'Trans proline' 0 CA--C 1.549 1.256 0 C-N-CA 123.496 2.797 . . . . 0.0 112.716 -175.497 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 25.1 tptp 58.55 114.87 0.02 OUTLIER Pre-proline 0 N--CA 1.484 1.274 0 C-N-CA 129.392 3.077 . . . . 0.0 113.022 -168.535 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_endo -74.21 147.49 37.73 Favored 'Trans proline' 0 CA--C 1.538 0.681 0 C-N-CA 122.287 1.991 . . . . 0.0 111.977 -177.434 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 26.8 mmmt -61.8 143.36 56.41 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 124.763 1.225 . . . . 0.0 111.28 175.204 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.489 HD23 HD21 ' A' ' 73' ' ' ASN . 14.0 tp -138.8 137.26 36.48 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.988 1.315 . . . . 0.0 111.044 -177.913 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -139.54 114.97 9.87 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 125.48 1.512 . . . . 0.0 108.878 167.431 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -146.59 40.55 1.1 Allowed 'General case' 0 N--CA 1.476 0.855 0 CA-C-O 122.986 1.374 . . . . 0.0 114.148 -176.331 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 70.5 mt -106.69 149.91 26.79 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 125.28 1.432 . . . . 0.0 112.705 -173.113 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 28.1 m -73.43 166.94 22.28 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 124.2 1.0 . . . . 0.0 110.332 170.982 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -54.37 -43.63 71.52 Favored 'General case' 0 N--CA 1.474 0.765 0 O-C-N 121.132 -0.98 . . . . 0.0 113.052 -175.246 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 8.3 pt20 -75.06 -35.46 61.85 Favored 'General case' 0 N--CA 1.471 0.621 0 O-C-N 121.472 -0.767 . . . . 0.0 112.532 176.603 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 15.6 mm-40 -66.73 -41.09 88.44 Favored 'General case' 0 CA--C 1.537 0.445 0 O-C-N 121.686 -0.634 . . . . 0.0 110.487 179.789 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 15.3 ttmm -59.5 -41.68 90.46 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 123.867 0.867 . . . . 0.0 111.114 174.116 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 56.8 mt -68.41 -39.5 80.89 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.656 0 CA-C-O 117.856 -1.069 . . . . 0.0 111.388 176.945 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 27.5 mt -66.58 -42.42 89.91 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.976 0 CA-C-N 121.254 1.843 . . . . 0.0 110.629 178.003 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -55.47 -48.57 74.33 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 124.092 0.957 . . . . 0.0 110.017 175.004 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -67.55 -52.28 40.67 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.763 1.225 . . . . 0.0 113.659 178.649 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 52.8 mt-10 -60.15 -29.06 68.41 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-N 119.077 0.853 . . . . 0.0 112.889 -179.048 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -69.11 -54.04 17.08 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 118.613 0.642 . . . . 0.0 111.216 177.149 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 46.5 mt -61.01 -33.92 57.77 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.537 0 C-N-CA 125.281 1.432 . . . . 0.0 111.342 174.281 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -70.21 -22.83 62.88 Favored 'General case' 0 CA--C 1.546 0.816 0 O-C-N 121.211 -0.931 . . . . 0.0 113.064 175.982 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -93.03 -32.78 14.37 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.794 1.237 . . . . 0.0 112.916 178.644 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 4.7 m -121.9 -19.09 4.61 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.953 0 CA-C-N 119.595 1.089 . . . . 0.0 113.832 -174.006 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 86.18 142.19 6.59 Favored Glycine 0 CA--C 1.532 1.154 0 C-N-CA 125.247 1.404 . . . . 0.0 112.7 -171.787 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 46.4 tp -57.84 -19.75 31.19 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 125.484 1.514 . . . . 0.0 114.406 -177.432 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 35.9 mt-30 -80.75 -17.01 52.36 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 126.911 2.084 . . . . 0.0 113.033 -179.884 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 68.9 m-80 -115.81 -8.68 11.96 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 114.837 1.421 . . . . 0.0 114.837 -173.402 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 20.9 pt -68.21 156.8 6.75 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.546 0 C-N-CA 123.388 0.675 . . . . 0.0 111.736 169.871 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -131.25 149.61 52.5 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 124.269 1.027 . . . . 0.0 111.175 177.028 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -64.3 -27.07 68.78 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 123.645 0.778 . . . . 0.0 111.939 178.442 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -66.57 -50.21 68.5 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.399 0 C-N-CA 124.6 1.16 . . . . 0.0 109.13 173.882 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 82.9 m -73.01 -43.2 62.41 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 123.373 0.669 . . . . 0.0 110.868 -176.743 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 20.2 tp -63.95 -34.92 79.07 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.14 1.376 . . . . 0.0 111.862 176.101 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.508 ' HA ' HG13 ' A' ' 66' ' ' ILE . 25.7 t -55.8 -30.21 60.98 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 124.836 1.255 . . . . 0.0 112.727 169.629 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 11.8 mptt -100.52 -28.7 12.76 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 125.373 1.469 . . . . 0.0 113.51 -175.531 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 15.9 mmtm -64.46 -38.13 89.96 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.932 1.293 . . . . 0.0 111.373 177.868 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.3 mp -111.37 7.72 21.03 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 125.013 1.325 . . . . 0.0 113.823 -178.988 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 17.0 t30 55.01 57.01 5.96 Favored 'General case' 0 CA--C 1.552 1.052 0 CA-C-O 122.393 1.092 . . . . 0.0 111.605 177.185 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.508 HG13 ' HA ' ' A' ' 61' ' ' SER . 3.4 pt -127.57 -168.8 0.58 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.772 0 C-N-CA 126.617 1.967 . . . . 0.0 110.424 -173.627 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 41.7 p -89.25 160.63 16.83 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 123.935 0.894 . . . . 0.0 111.594 171.446 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 64.7 t -64.5 -23.67 33.92 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.944 0 O-C-N 121.658 -0.651 . . . . 0.0 111.209 168.406 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 26.3 mm-40 -78.61 -35.06 46.19 Favored 'General case' 0 N--CA 1.464 0.267 0 O-C-N 120.815 -1.178 . . . . 0.0 110.387 -177.481 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 35.2 mttm -65.05 -54.18 34.18 Favored 'General case' 0 C--N 1.346 0.432 0 CA-C-N 118.446 0.566 . . . . 0.0 110.587 166.836 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -56.75 -45.19 82.18 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.931 1.292 . . . . 0.0 112.311 -173.022 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 22.5 ttmm -68.65 -32.34 72.11 Favored 'General case' 0 CA--C 1.519 -0.228 0 C-N-CA 124.537 1.135 . . . . 0.0 111.203 178.459 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' ASN . . . . . 0.489 HD21 HD23 ' A' ' 32' ' ' LEU . 0.0 OUTLIER -63.34 -37.97 89.33 Favored 'General case' 0 CA--C 1.546 0.806 0 CA-C-O 118.793 -0.622 . . . . 0.0 112.578 179.575 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 79.5 m-85 -62.9 -42.91 99.95 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.52 1.128 . . . . 0.0 110.749 174.648 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 87.4 mt -71.03 -22.66 22.91 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.755 0 C-N-CA 125.057 1.343 . . . . 0.0 111.24 179.36 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 75.7 tttt -89.65 -32.96 16.83 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 125.572 1.549 . . . . 0.0 112.721 -177.885 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 8.9 p30 -86.92 -39.39 15.8 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 118.938 0.79 . . . . 0.0 111.617 170.918 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -109.55 102.57 11.41 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-O 121.398 0.618 . . . . 0.0 111.097 -174.196 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -154.75 143.78 21.0 Favored 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 112.517 0.562 . . . . 0.0 112.517 -178.098 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 39.5 mmt-85 53.31 8.27 0.11 Allowed 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 126.698 1.999 . . . . 0.0 115.928 -176.14 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 34.3 tp -132.41 -39.42 1.02 Allowed 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 125.676 1.59 . . . . 0.0 113.165 -167.118 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -78.37 76.78 1.79 Allowed Glycine 0 CA--C 1.536 1.367 0 C-N-CA 123.367 0.508 . . . . 0.0 113.431 -179.651 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 56.4 mmt-85 -87.38 157.81 19.16 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 125.06 1.344 . . . . 0.0 110.758 175.315 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 10.2 t -65.29 107.14 1.52 Allowed 'General case' 0 N--CA 1.472 0.634 0 CA-C-O 122.169 0.985 . . . . 0.0 111.872 178.051 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 38.9 m-80 -133.77 146.57 50.84 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.961 1.704 . . . . 0.0 110.849 176.723 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 8.4 t30 -149.95 -53.25 0.15 Allowed 'General case' 0 N--CA 1.474 0.75 0 N-CA-C 113.521 0.934 . . . . 0.0 113.521 175.198 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 6.6 mt -152.17 169.54 22.18 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 127.554 2.341 . . . . 0.0 110.624 -179.587 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 56.5 pttt -125.97 14.34 7.93 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 126.303 1.841 . . . . 0.0 113.513 -178.058 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 14.7 t -150.42 130.23 13.28 Favored 'General case' 0 C--O 1.234 0.257 0 C-N-CA 125.578 1.551 . . . . 0.0 109.628 175.365 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -137.49 3.93 0.77 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.764 0 C-N-CA 126.023 1.729 . . . . 0.0 113.72 -175.386 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 69.29 7.08 56.68 Favored Glycine 0 CA--C 1.538 1.494 0 O-C-N 120.768 -1.208 . . . . 0.0 115.049 -173.195 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . 0.275 42.3 mm 58.72 26.3 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.029 0 C-N-CA 125.977 1.711 . . . . 0.0 112.608 173.489 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 10.6 tp 58.55 21.42 8.6 Favored 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 126.551 1.94 . . . . 0.0 114.844 -177.951 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 35.7 mt-30 -96.23 58.97 1.87 Allowed 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 125.555 1.542 . . . . 0.0 112.061 -176.997 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 22.1 mm-40 -81.09 -45.71 16.07 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 123.976 0.911 . . . . 0.0 113.051 -177.423 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . 0.256 35.9 mt-10 52.65 38.96 27.41 Favored 'General case' 0 N--CA 1.48 1.062 0 N-CA-C 116.868 2.173 . . . . 0.0 116.868 172.139 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 33.1 t -81.7 146.82 6.74 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.327 0 C-N-CA 124.841 1.257 . . . . 0.0 111.671 -176.253 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 50.8 m 57.44 26.63 12.82 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 126.694 1.997 . . . . 0.0 115.252 177.721 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 23.2 t -149.65 -41.82 0.14 Allowed 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.559 1.144 . . . . 0.0 112.79 176.337 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 30.3 tpp -123.95 37.32 4.43 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 125.298 1.439 . . . . 0.0 111.889 -179.536 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -76.54 75.23 3.26 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 125.339 1.455 . . . . 0.0 111.504 -176.584 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -144.44 162.86 35.45 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 126.342 1.857 . . . . 0.0 111.979 -178.187 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 67.3 mttm -107.78 142.22 38.15 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 125.643 1.577 . . . . 0.0 111.53 178.292 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 80.5 p -153.86 165.17 36.9 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 125.433 1.493 . . . . 0.0 112.319 -178.479 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 99.1 mtp -137.96 159.87 40.87 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 125.64 1.576 . . . . 0.0 111.897 179.946 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 10.9 t -106.99 166.53 10.54 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 125.49 1.516 . . . . 0.0 111.864 170.663 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 29.8 t-105 . . . . . 0 C--O 1.253 1.239 0 C-N-CA 125.624 1.57 . . . . 0.0 112.827 -171.581 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.575 0 N-CA-C 111.576 -0.609 . . . . 0.0 111.576 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 50.0 m -113.74 137.68 51.29 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 124.855 1.262 . . . . 0.0 112.317 -176.202 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 90.4 m-70 -135.6 -35.47 0.8 Allowed 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 124.828 1.251 . . . . 0.0 113.745 179.462 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 9.2 tpt -145.13 130.7 18.86 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 124.797 1.239 . . . . 0.0 110.894 178.967 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -152.91 168.79 24.64 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 124.384 1.073 . . . . 0.0 112.849 -176.438 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 5.3 t -114.11 167.99 10.2 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.683 1.593 . . . . 0.0 111.907 174.095 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.8 ttt -116.98 123.19 46.31 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 125.511 1.524 . . . . 0.0 111.018 -177.555 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 -141.24 147.02 45.29 Favored Pre-proline 0 CA--C 1.549 0.916 0 C-N-CA 125.241 1.417 . . . . 0.0 112.277 -175.955 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_endo -79.79 -22.42 7.66 Favored 'Trans proline' 0 C--N 1.35 0.641 0 C-N-CA 123.303 2.669 . . . . 0.0 115.199 -175.762 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 96.9 mt -113.17 42.43 1.92 Allowed 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.981 1.713 . . . . 0.0 112.084 -173.566 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -109.13 0.28 19.73 Favored 'General case' 0 N--CA 1.474 0.728 0 N-CA-C 114.661 1.356 . . . . 0.0 114.661 -177.927 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -126.26 -56.1 1.43 Allowed 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 124.574 1.149 . . . . 0.0 113.423 -164.308 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.9 pp -124.39 13.05 4.78 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 C-N-CA 126.223 1.809 . . . . 0.0 112.772 -173.478 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 11.4 tt -44.23 109.87 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.48 1.068 0 C-N-CA 125.693 1.597 . . . . 0.0 113.345 -177.602 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -150.95 14.95 0.73 Allowed 'General case' 0 N--CA 1.476 0.84 0 N-CA-C 115.173 1.546 . . . . 0.0 115.173 -177.373 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -86.3 8.84 19.77 Favored 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 115.15 1.537 . . . . 0.0 115.15 -170.346 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 6.8 tp -143.45 22.35 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.96 0 C-N-CA 125.547 1.539 . . . . 0.0 114.26 -173.153 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 50.1 mtmt -118.67 -44.17 2.65 Favored 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 114.508 1.299 . . . . 0.0 114.508 179.333 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 63.2 mttp 46.0 36.99 3.32 Favored 'General case' 0 N--CA 1.488 1.442 0 C-N-CA 125.91 1.684 . . . . 0.0 114.208 -175.538 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 55.43 93.84 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 127.086 2.154 . . . . 0.0 113.304 -169.329 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -146.44 156.85 43.6 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 125.069 1.347 . . . . 0.0 112.081 179.288 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -84.4 51.65 2.15 Favored 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 125.041 1.337 . . . . 0.0 112.037 -177.937 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -136.59 132.46 35.16 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 125.66 1.584 . . . . 0.0 111.408 -178.97 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 66.0 m -137.45 94.0 2.87 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 125.155 1.382 . . . . 0.0 110.593 -177.31 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 84.72 104.93 0.62 Allowed Glycine 0 CA--C 1.534 1.231 0 C-N-CA 125.198 1.38 . . . . 0.0 112.558 -178.021 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 61.2 t -108.36 -1.56 9.94 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.219 0 C-N-CA 125.46 1.504 . . . . 0.0 113.07 -175.222 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -137.57 168.81 18.91 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 125.017 1.327 . . . . 0.0 113.017 -166.917 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 17.4 mt -79.01 16.79 0.84 Allowed 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 126.756 2.022 . . . . 0.0 115.018 -168.189 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -156.73 102.03 1.98 Allowed Pre-proline 0 CA--C 1.547 0.828 0 C-N-CA 125.312 1.445 . . . . 0.0 111.478 -163.301 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_endo -79.44 -39.68 0.3 Allowed 'Trans proline' 0 CA--C 1.539 0.756 0 C-N-CA 122.422 2.081 . . . . 0.0 112.774 -179.226 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 15.3 mt -145.56 84.16 1.68 Allowed 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 126.003 1.721 . . . . 0.0 110.697 178.239 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . 0.253 54.8 p 52.59 28.92 6.57 Favored 'General case' 0 N--CA 1.477 0.876 0 N-CA-C 116.602 2.075 . . . . 0.0 116.602 167.974 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 4.6 p -155.0 145.91 16.4 Favored Pre-proline 0 N--CA 1.475 0.789 0 C-N-CA 126.612 1.965 . . . . 0.0 109.891 -174.084 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_endo -74.73 70.13 5.15 Favored 'Trans proline' 0 CA--C 1.547 1.152 0 C-N-CA 123.575 2.85 . . . . 0.0 112.484 178.882 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 34.8 tptt 60.2 110.48 0.02 OUTLIER Pre-proline 0 N--CA 1.482 1.133 0 C-N-CA 129.823 3.249 . . . . 0.0 114.096 -175.577 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_endo -73.46 150.74 46.76 Favored 'Trans proline' 0 C--N 1.352 0.735 0 C-N-CA 122.906 2.404 . . . . 0.0 111.928 -178.069 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -70.72 140.67 51.47 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 123.989 0.915 . . . . 0.0 111.788 -178.758 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 13.1 tp -142.67 138.82 30.9 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 125.683 1.593 . . . . 0.0 110.59 -177.134 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -147.57 39.3 0.97 Allowed 'General case' 0 N--CA 1.478 0.959 0 CA-C-O 123.105 1.431 . . . . 0.0 113.951 179.162 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 29.6 mt-10 -92.3 80.4 4.98 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 125.562 1.545 . . . . 0.0 112.081 -173.684 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.8 mt -124.96 158.76 32.82 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 127.293 2.237 . . . . 0.0 110.517 -178.234 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 26.0 p -68.98 169.76 11.1 Favored 'General case' 0 N--CA 1.478 0.969 0 O-C-N 121.82 -0.55 . . . . 0.0 111.159 167.713 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -56.85 -44.36 82.05 Favored 'General case' 0 N--CA 1.473 0.71 0 O-C-N 120.909 -1.12 . . . . 0.0 111.766 176.377 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 9.3 tt0 -70.89 -44.91 65.32 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 123.587 0.755 . . . . 0.0 111.44 177.53 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 90.6 mt-30 -63.79 -37.19 86.43 Favored 'General case' 0 CA--C 1.534 0.363 0 O-C-N 121.722 -0.612 . . . . 0.0 111.777 179.433 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 23.6 ttmm -62.21 -43.5 98.68 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 123.805 0.842 . . . . 0.0 111.105 174.053 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 51.5 mt -65.24 -44.81 95.05 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 CA-C-N 119.021 0.828 . . . . 0.0 111.176 176.722 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 49.3 mt -64.81 -45.26 95.56 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 CA-C-N 120.095 1.316 . . . . 0.0 110.352 -179.711 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -57.09 -49.03 77.13 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 124.783 1.233 . . . . 0.0 110.357 176.838 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -65.94 -52.62 48.2 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 124.436 1.094 . . . . 0.0 112.601 179.116 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 18.7 mm-40 -60.96 -26.04 67.26 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 119.161 0.891 . . . . 0.0 113.089 -179.375 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.493 ' CE2' HG22 ' A' ' 55' ' ' ILE . 1.6 t80 -70.99 -59.12 2.96 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 123.979 0.912 . . . . 0.0 111.228 175.075 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 54.2 mt -60.12 -34.48 57.0 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 C-N-CA 126.229 1.812 . . . . 0.0 111.984 177.051 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -69.68 -24.82 63.65 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 123.953 0.901 . . . . 0.0 112.775 176.899 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -92.87 -29.41 15.95 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.497 1.119 . . . . 0.0 113.184 179.182 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 5.1 m -123.74 -22.82 2.6 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.981 0 N-CA-C 114.202 1.186 . . . . 0.0 114.202 -174.597 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 86.86 144.34 8.39 Favored Glycine 0 CA--C 1.534 1.275 0 C-N-CA 125.183 1.373 . . . . 0.0 113.373 -172.851 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -69.41 -5.37 23.2 Favored 'General case' 0 N--CA 1.478 0.967 0 N-CA-C 114.706 1.372 . . . . 0.0 114.706 -166.588 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -101.54 -6.06 24.38 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 125.415 1.486 . . . . 0.0 114.087 173.63 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 76.4 m-20 -107.5 -12.08 15.36 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 124.57 1.148 . . . . 0.0 113.759 175.935 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.493 HG22 ' CE2' ' A' ' 46' ' ' TYR . 40.5 pt -68.07 157.49 6.28 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 C-N-CA 123.949 0.899 . . . . 0.0 111.27 164.691 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.3 p -124.54 144.24 50.24 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 125.002 1.321 . . . . 0.0 110.292 174.299 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -61.81 -30.77 71.05 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 124.182 0.993 . . . . 0.0 111.103 175.892 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -61.42 -58.33 8.06 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.256 0 C-N-CA 124.772 1.229 . . . . 0.0 108.565 174.811 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 46.7 m -69.91 -41.35 74.81 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 123.255 0.622 . . . . 0.0 110.649 -174.413 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 24.4 tp -60.94 -36.38 79.21 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 123.631 0.772 . . . . 0.0 112.032 174.197 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.468 ' HA ' HG13 ' A' ' 66' ' ' ILE . 10.8 p -62.21 -19.63 63.34 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 113.859 1.059 . . . . 0.0 113.859 173.667 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -105.21 -25.19 12.56 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 125.244 1.418 . . . . 0.0 114.665 176.299 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 22.1 mmtt -62.35 -35.8 80.24 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-N 119.778 1.172 . . . . 0.0 110.951 172.404 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 85.8 mt -113.8 -1.33 13.94 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 125.92 1.688 . . . . 0.0 114.029 -171.324 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 32.2 m-80 56.7 61.51 2.62 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 126.066 1.746 . . . . 0.0 113.386 -177.089 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.468 HG13 ' HA ' ' A' ' 61' ' ' SER . 0.5 OUTLIER -135.97 176.64 7.84 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.907 0 C-N-CA 126.486 1.915 . . . . 0.0 112.118 -171.0 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -71.22 154.19 41.86 Favored 'General case' 0 N--CA 1.476 0.829 0 O-C-N 121.307 -0.871 . . . . 0.0 111.535 173.007 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 86.3 t -65.13 -24.47 35.38 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 C-N-CA 124.084 0.954 . . . . 0.0 111.839 175.35 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 75.4 mm-40 -85.97 -35.36 20.47 Favored 'General case' 0 N--CA 1.469 0.484 0 O-C-N 120.907 -1.12 . . . . 0.0 110.67 176.942 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 45.3 tttt -65.01 -42.52 94.36 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 123.521 0.728 . . . . 0.0 111.117 177.904 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -58.56 -40.31 82.73 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 125.095 1.358 . . . . 0.0 112.296 170.617 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 23.0 ttpt -70.0 -32.17 70.22 Favored 'General case' 0 C--O 1.224 -0.261 0 C-N-CA 124.672 1.189 . . . . 0.0 111.29 -178.943 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -57.53 -37.69 73.48 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 123.168 0.587 . . . . 0.0 112.511 179.921 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 63.5 m-85 -66.25 -44.26 84.2 Favored 'General case' 0 N--CA 1.464 0.227 0 C-N-CA 125.088 1.355 . . . . 0.0 110.424 178.151 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 74.6 mt -64.62 -45.86 94.19 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.437 0 C-N-CA 124.751 1.22 . . . . 0.0 109.51 178.371 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 22.7 mmmt -65.72 -32.47 74.04 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 125.449 1.5 . . . . 0.0 112.712 -175.746 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 6.5 p30 -91.38 -39.02 12.24 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 119.259 0.936 . . . . 0.0 111.763 176.539 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 2.3 t -95.37 -9.17 33.6 Favored 'General case' 0 N--CA 1.474 0.745 0 N-CA-C 115.56 1.689 . . . . 0.0 115.56 -163.66 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 7.1 p30 -61.36 143.84 55.06 Favored 'General case' 0 CA--C 1.55 0.971 0 O-C-N 120.362 -1.461 . . . . 0.0 114.065 -176.401 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 1.9 mpp_? 54.33 17.55 1.57 Allowed 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 127.935 2.494 . . . . 0.0 116.224 -169.353 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.8 tt -136.87 -42.02 0.59 Allowed 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.066 0.946 . . . . 0.0 113.069 -177.977 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -77.31 71.44 2.27 Favored Glycine 0 CA--C 1.534 1.279 0 C-N-CA 124.115 0.864 . . . . 0.0 114.681 -176.553 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 48.4 mtp85 -130.48 -79.11 0.54 Allowed 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 125.038 1.335 . . . . 0.0 111.904 173.129 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 3.1 t -159.29 132.55 7.12 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 124.804 1.242 . . . . 0.0 110.67 -179.903 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 63.2 m-80 -137.93 -0.56 2.08 Favored 'General case' 0 CA--C 1.551 0.996 0 C-N-CA 124.741 1.216 . . . . 0.0 113.633 -175.906 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 2.4 p-10 -100.99 15.75 27.64 Favored 'General case' 0 CA--C 1.549 0.927 0 N-CA-C 115.303 1.594 . . . . 0.0 115.303 -165.056 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -105.99 -1.73 23.64 Favored 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 114.988 1.477 . . . . 0.0 114.988 -170.377 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -131.35 14.33 5.06 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 126.131 1.772 . . . . 0.0 114.08 178.739 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 15.4 t -154.73 117.54 4.37 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 125.539 1.536 . . . . 0.0 109.525 178.351 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -141.43 2.23 0.47 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.808 0 N-CA-C 114.202 1.186 . . . . 0.0 114.202 -174.875 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 67.28 5.14 33.43 Favored Glycine 0 CA--C 1.54 1.653 0 O-C-N 120.841 -1.162 . . . . 0.0 115.138 -173.014 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . 0.281 2.9 mp 48.5 37.65 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.549 0.932 0 C-N-CA 127.52 2.328 . . . . 0.0 111.99 -179.9 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 11.3 tp 53.18 25.76 4.54 Favored 'General case' 0 CA--C 1.553 1.059 0 C-N-CA 126.988 2.115 . . . . 0.0 115.272 178.62 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -132.88 64.9 1.6 Allowed 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 125.24 1.416 . . . . 0.0 112.012 -168.091 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 63.2 mm-40 -84.44 -39.24 19.2 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 124.116 0.966 . . . . 0.0 113.165 176.733 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 42.6 59.44 2.76 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 127.082 2.153 . . . . 0.0 115.09 175.46 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 12.3 t -77.23 61.04 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 C-N-CA 126.385 1.874 . . . . 0.0 112.277 -172.017 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 27.5 t -165.39 -42.73 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 125.375 1.47 . . . . 0.0 112.112 176.809 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 46.3 m -126.01 -22.71 4.07 Favored 'General case' 0 N--CA 1.479 0.999 0 N-CA-C 115.055 1.502 . . . . 0.0 115.055 -173.066 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 60.9 mtt -137.53 40.16 2.42 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 124.798 1.239 . . . . 0.0 111.72 -176.244 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 28.5 tt0 -77.2 70.39 3.59 Favored 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 126.168 1.787 . . . . 0.0 112.001 -176.202 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -143.84 149.78 37.48 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.153 1.381 . . . . 0.0 112.706 -178.922 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -133.95 -26.14 1.55 Allowed 'General case' 0 N--CA 1.483 1.189 0 N-CA-C 114.943 1.461 . . . . 0.0 114.943 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 78.8 p -149.17 160.96 42.9 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 125.201 1.4 . . . . 0.0 112.373 -177.793 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 97.9 mtp -140.21 154.16 46.81 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 125.501 1.52 . . . . 0.0 111.898 -178.976 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 9.1 t -88.42 167.65 13.3 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 124.5 1.12 . . . . 0.0 112.046 168.648 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 19.4 t-105 . . . . . 0 C--O 1.253 1.243 0 C-N-CA 125.414 1.486 . . . . 0.0 113.104 -170.907 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.543 0 N-CA-C 112.238 -0.345 . . . . 0.0 112.238 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 79.5 p -139.55 160.14 40.55 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 125.802 1.641 . . . . 0.0 111.821 178.181 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 47.7 t60 -146.29 147.56 31.51 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 124.402 1.081 . . . . 0.0 112.188 -176.155 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 11.7 tpt 47.57 59.49 4.1 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 126.346 1.858 . . . . 0.0 114.024 176.311 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -140.78 148.52 40.77 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.315 1.046 . . . . 0.0 113.383 -177.89 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 58.4 m -147.31 134.2 20.19 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 126.251 1.82 . . . . 0.0 110.817 -174.955 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 95.2 mtp -144.76 137.14 26.26 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 125.359 1.464 . . . . 0.0 110.815 177.444 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 17.6 m-20 -143.3 119.77 6.64 Favored Pre-proline 0 CA--C 1.549 0.924 0 C-N-CA 124.813 1.245 . . . . 0.0 111.405 178.252 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_endo -84.47 -12.1 7.92 Favored 'Trans proline' 0 C--N 1.351 0.661 0 C-N-CA 123.417 2.745 . . . . 0.0 115.173 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -107.9 29.66 7.06 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 125.549 1.539 . . . . 0.0 114.387 -166.601 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -104.66 -6.72 20.17 Favored 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 116.149 1.907 . . . . 0.0 116.149 -173.124 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.14 -28.55 1.71 Allowed 'General case' 0 N--CA 1.481 1.088 0 N-CA-C 117.059 2.244 . . . . 0.0 117.059 -169.482 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.3 pp -134.63 14.14 1.18 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.338 0 C-N-CA 125.545 1.538 . . . . 0.0 113.682 -178.036 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -56.1 114.02 0.59 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.848 0 C-N-CA 124.987 1.315 . . . . 0.0 111.792 -173.213 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -146.91 0.26 0.73 Allowed 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 113.862 1.06 . . . . 0.0 113.862 179.692 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -81.37 2.85 26.58 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 115.372 1.619 . . . . 0.0 115.372 -163.923 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 13.1 tt -145.31 24.71 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 C-N-CA 125.907 1.683 . . . . 0.0 113.637 -176.804 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 41.4 ttmt -112.72 -54.36 2.63 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 123.835 0.854 . . . . 0.0 113.125 174.158 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 18.4 tptm -163.23 130.95 3.61 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 125.079 1.352 . . . . 0.0 111.663 -172.488 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -155.26 107.38 2.67 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.786 1.234 . . . . 0.0 109.973 170.916 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -155.39 164.68 38.41 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.911 1.284 . . . . 0.0 112.168 178.913 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 69.2 m-80 -93.38 47.53 1.26 Allowed 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 125.504 1.522 . . . . 0.0 112.71 -179.269 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 21.2 t70 56.18 38.07 29.48 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 125.793 1.637 . . . . 0.0 114.713 175.988 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 24.0 m -77.3 102.03 6.54 Favored 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 113.305 0.854 . . . . 0.0 113.305 -169.451 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 63.75 38.87 96.82 Favored Glycine 0 CA--C 1.533 1.167 0 C-N-CA 124.707 1.146 . . . . 0.0 115.635 167.771 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 14.9 p -133.14 35.31 0.83 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.983 0 C-N-CA 124.958 1.303 . . . . 0.0 112.469 -163.561 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -136.89 169.97 16.88 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 124.771 1.229 . . . . 0.0 113.756 -173.014 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 20.3 mt -87.05 32.36 0.69 Allowed 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 127.697 2.399 . . . . 0.0 113.408 -166.69 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -158.11 141.01 10.74 Favored Pre-proline 0 CA--C 1.548 0.875 0 C-N-CA 125.507 1.523 . . . . 0.0 111.141 -167.583 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -78.68 -29.86 3.35 Favored 'Trans proline' 0 CA--C 1.54 0.794 0 C-N-CA 122.729 2.286 . . . . 0.0 113.364 -177.92 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -157.86 -168.78 2.63 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 126.445 1.898 . . . . 0.0 109.369 179.942 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 8.0 t -75.33 63.02 1.36 Allowed 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 125.105 1.362 . . . . 0.0 111.464 171.257 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 14.1 p -155.24 142.21 13.57 Favored Pre-proline 0 N--CA 1.471 0.615 0 C-N-CA 126.733 2.013 . . . . 0.0 109.75 -172.625 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_endo -77.01 73.38 5.46 Favored 'Trans proline' 0 CA--C 1.539 0.74 0 C-N-CA 122.857 2.371 . . . . 0.0 111.193 173.425 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.424 ' HA ' ' HD2' ' A' ' 30' ' ' PRO . 0.0 OUTLIER 36.87 93.41 0.05 OUTLIER Pre-proline 0 CA--C 1.548 0.87 0 C-N-CA 128.757 2.823 . . . . 0.0 115.948 171.398 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.424 ' HD2' ' HA ' ' A' ' 29' ' ' LYS . 73.5 Cg_endo -63.92 163.61 24.67 Favored 'Trans proline' 0 CA--C 1.539 0.769 0 C-N-CA 122.117 1.878 . . . . 0.0 112.119 170.572 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 35.8 mmtt -44.08 124.38 3.85 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 125.726 1.61 . . . . 0.0 112.084 177.728 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.8 tt -124.92 125.41 43.9 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.926 1.29 . . . . 0.0 111.609 -170.245 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -131.91 59.22 1.71 Allowed 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.897 1.279 . . . . 0.0 111.685 -168.288 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -118.32 78.37 1.25 Allowed 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 125.691 1.596 . . . . 0.0 110.856 -174.766 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 5.0 mt -132.01 151.51 51.7 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 127.166 2.186 . . . . 0.0 110.136 -177.586 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 73.4 m -72.95 164.02 27.29 Favored 'General case' 0 N--CA 1.479 1.009 0 O-C-N 121.869 -0.519 . . . . 0.0 110.514 170.162 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -55.42 -44.06 75.89 Favored 'General case' 0 N--CA 1.48 1.027 0 O-C-N 120.674 -1.266 . . . . 0.0 113.347 -172.832 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 6.1 pt20 -74.67 -36.75 62.81 Favored 'General case' 0 N--CA 1.47 0.565 0 O-C-N 121.482 -0.761 . . . . 0.0 112.486 174.953 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 89.7 mt-30 -63.81 -38.7 92.07 Favored 'General case' 0 N--CA 1.466 0.353 0 O-C-N 121.609 -0.682 . . . . 0.0 111.329 177.963 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 40.8 ttmt -61.91 -42.44 99.09 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 124.29 1.036 . . . . 0.0 111.063 176.763 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 44.5 mt -69.34 -42.44 81.23 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 CA-C-O 118.378 -0.82 . . . . 0.0 111.064 176.868 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 45.6 mt -63.6 -45.5 97.42 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.002 0 CA-C-N 120.278 1.399 . . . . 0.0 110.069 178.32 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -58.51 -48.65 80.11 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 125.301 1.44 . . . . 0.0 110.753 178.099 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -64.05 -52.63 58.51 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 124.461 1.104 . . . . 0.0 112.822 176.156 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.6 mm-40 -60.48 -32.15 71.14 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 118.964 0.802 . . . . 0.0 112.52 -179.456 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.5 t80 -65.71 -55.86 15.12 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 118.716 0.689 . . . . 0.0 110.642 176.939 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 66.6 mt -64.21 -34.59 69.97 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.251 0 C-N-CA 126.786 2.035 . . . . 0.0 111.739 179.205 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -68.82 -38.64 80.0 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 123.486 0.714 . . . . 0.0 111.336 175.705 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -77.42 -38.55 49.45 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.506 0.722 . . . . 0.0 112.548 179.525 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.3 m -108.64 -6.14 10.86 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.162 0 N-CA-C 114.25 1.204 . . . . 0.0 114.25 -174.206 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 86.75 26.02 33.42 Favored Glycine 0 N--CA 1.473 1.161 0 C-N-CA 124.775 1.179 . . . . 0.0 115.316 161.973 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 54.49 11.22 0.4 Allowed 'General case' 0 CA--C 1.554 1.115 0 C-N-CA 127.602 2.361 . . . . 0.0 115.32 -173.118 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 4.7 pt20 -121.47 -2.34 9.48 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 125.237 1.415 . . . . 0.0 113.546 -170.956 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 53.8 m-80 -125.59 2.73 7.58 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.03 1.332 . . . . 0.0 113.21 174.753 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 18.1 pt -75.16 152.19 6.55 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 CA-C-N 118.443 0.565 . . . . 0.0 111.459 175.214 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -138.81 145.06 39.64 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 124.327 1.051 . . . . 0.0 109.724 178.481 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -60.6 -26.66 67.14 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 119.259 0.936 . . . . 0.0 112.38 -179.296 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -70.27 -41.35 78.67 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.463 0 C-N-CA 126.086 1.754 . . . . 0.0 110.745 175.869 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 73.7 m -81.14 -44.57 17.71 Favored 'General case' 0 C--O 1.222 -0.365 0 O-C-N 121.81 -0.556 . . . . 0.0 109.53 -178.591 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 14.2 tp -61.15 -37.25 82.18 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.76 1.624 . . . . 0.0 111.682 176.214 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.446 ' HA ' HG13 ' A' ' 66' ' ' ILE . 59.7 p -61.42 -24.04 66.25 Favored 'General case' 0 N--CA 1.477 0.879 0 N-CA-C 113.488 0.922 . . . . 0.0 113.488 171.645 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -104.04 -26.54 12.56 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 125.489 1.515 . . . . 0.0 114.236 -175.149 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 60.0 mmtt -64.66 -35.04 79.75 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 125.336 1.454 . . . . 0.0 111.48 173.305 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 6.9 mt -116.39 -2.07 12.15 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 126.274 1.83 . . . . 0.0 112.908 -166.702 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 26.4 m-80 56.11 61.75 2.63 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 126.744 2.018 . . . . 0.0 113.282 -176.547 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.446 HG13 ' HA ' ' A' ' 61' ' ' SER . 0.6 OUTLIER -134.11 176.3 9.21 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 C-N-CA 126.875 2.07 . . . . 0.0 111.441 -173.137 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.4 p -78.72 158.78 28.22 Favored 'General case' 0 N--CA 1.479 1.007 0 O-C-N 121.069 -1.019 . . . . 0.0 111.231 172.943 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 92.0 t -63.88 -28.56 45.2 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.045 0 O-C-N 121.509 -0.744 . . . . 0.0 111.416 172.863 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -78.74 -38.76 38.01 Favored 'General case' 0 N--CA 1.469 0.497 0 O-C-N 120.923 -1.11 . . . . 0.0 109.722 -177.644 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 5.0 tmtm? -66.54 -47.28 73.38 Favored 'General case' 0 N--CA 1.463 0.213 0 C-N-CA 125.737 1.615 . . . . 0.0 110.615 175.245 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -58.24 -47.71 82.68 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.072 1.349 . . . . 0.0 112.9 172.514 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 35.0 ttmt -69.54 -25.35 63.97 Favored 'General case' 0 N--CA 1.464 0.252 0 O-C-N 120.993 -1.067 . . . . 0.0 111.473 -176.866 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -55.21 -41.44 72.04 Favored 'General case' 0 CA--C 1.545 0.753 0 CA-C-N 118.097 0.408 . . . . 0.0 111.576 173.886 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 53.4 m-85 -65.18 -45.61 84.18 Favored 'General case' 0 C--O 1.221 -0.408 0 C-N-CA 124.68 1.192 . . . . 0.0 111.03 176.089 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 65.3 mt -65.27 -24.87 35.94 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.7 0 C-N-CA 124.128 0.971 . . . . 0.0 111.363 -178.706 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 72.8 mmtt -87.57 -24.87 23.88 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 125.404 1.482 . . . . 0.0 114.547 179.637 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 10.6 p30 -95.28 -42.58 8.46 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 120.463 1.483 . . . . 0.0 112.103 169.087 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 65.0 m -99.64 105.15 16.97 Favored 'General case' 0 C--O 1.231 0.118 0 C-N-CA 124.063 0.945 . . . . 0.0 110.531 179.543 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 -145.5 -75.88 0.21 Allowed 'General case' 0 CA--C 1.539 0.545 0 N-CA-C 113.577 0.954 . . . . 0.0 113.577 -174.866 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 39.7 mmt-85 -86.31 -18.95 30.62 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 124.493 1.117 . . . . 0.0 113.777 -177.434 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 6.7 tt -75.7 -38.38 58.68 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.382 1.473 . . . . 0.0 112.227 -176.805 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 73.46 -158.7 52.78 Favored Glycine 0 CA--C 1.536 1.385 0 C-N-CA 123.907 0.765 . . . . 0.0 113.379 -175.186 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 19.7 mtp85 -150.07 150.78 32.22 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 126.298 1.839 . . . . 0.0 110.43 161.624 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 8.9 t -65.82 121.59 15.39 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 123.564 0.746 . . . . 0.0 110.963 167.995 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 46.7 m-80 -133.72 -77.38 0.47 Allowed 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.492 1.117 . . . . 0.0 111.799 178.196 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 31.8 t-20 53.63 -166.34 0.08 Allowed 'General case' 0 CA--C 1.559 1.291 0 C-N-CA 125.693 1.597 . . . . 0.0 113.193 -175.208 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 8.7 mp 56.11 36.84 28.11 Favored 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 126.476 1.911 . . . . 0.0 112.912 177.093 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 60.7 pttt -115.97 -5.34 11.99 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 126.097 1.759 . . . . 0.0 114.109 -172.509 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 14.7 t -149.4 124.65 10.16 Favored 'General case' 0 C--O 1.234 0.254 0 C-N-CA 125.208 1.403 . . . . 0.0 109.806 172.387 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -140.09 5.84 0.56 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.779 0 C-N-CA 125.988 1.715 . . . . 0.0 113.11 -177.029 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 67.9 6.87 46.92 Favored Glycine 0 CA--C 1.539 1.567 0 O-C-N 120.835 -1.166 . . . . 0.0 114.733 -171.137 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . 0.259 3.5 mp 51.2 39.19 0.32 Allowed 'Isoleucine or valine' 0 CA--C 1.549 0.938 0 C-N-CA 126.863 2.065 . . . . 0.0 111.536 178.697 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 12.6 tp 51.14 26.89 3.08 Favored 'General case' 0 CA--C 1.553 1.069 0 C-N-CA 127.076 2.15 . . . . 0.0 114.614 -176.757 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -127.38 52.16 1.84 Allowed 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 126.526 1.93 . . . . 0.0 110.895 -172.412 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -132.84 158.72 41.79 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 126.297 1.839 . . . . 0.0 111.706 175.371 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -135.3 113.7 11.52 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 124.844 1.258 . . . . 0.0 110.43 -179.017 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 7.7 t -142.64 151.46 17.81 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 C-N-CA 125.621 1.568 . . . . 0.0 109.95 -174.301 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 38.4 t -138.13 -64.06 0.54 Allowed 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 124.1 0.96 . . . . 0.0 112.456 176.989 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 15.8 t -65.85 -31.94 73.18 Favored 'General case' 0 N--CA 1.478 0.96 0 O-C-N 121.455 -0.778 . . . . 0.0 113.009 -177.948 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 98.4 mmm -107.25 18.43 21.66 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.891 1.676 . . . . 0.0 113.106 179.003 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 24.3 tt0 -79.79 53.46 1.64 Allowed 'General case' 0 CA--C 1.553 1.063 0 C-N-CA 124.757 1.223 . . . . 0.0 112.373 -176.144 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 56.32 -179.4 0.04 OUTLIER 'General case' 0 CA--C 1.552 1.05 0 C-N-CA 127.0 2.12 . . . . 0.0 114.713 -170.867 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -149.0 161.25 42.29 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 125.757 1.623 . . . . 0.0 112.081 177.495 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 50.1 p -147.47 -85.23 0.1 Allowed 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.574 1.15 . . . . 0.0 111.881 177.149 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 18.2 ttt -155.59 146.17 22.05 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 125.699 1.6 . . . . 0.0 111.381 179.673 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 9.9 m -81.22 142.1 33.51 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.876 0.871 . . . . 0.0 111.009 171.44 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 28.1 t-105 . . . . . 0 C--O 1.254 1.314 0 C-N-CA 125.646 1.579 . . . . 0.0 113.06 -175.9 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.653 0 N-CA-C 111.893 -0.483 . . . . 0.0 111.893 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 24.4 m -79.31 58.08 2.49 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 125.655 1.582 . . . . 0.0 114.059 -170.783 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 9.5 m170 -77.19 115.08 16.67 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 124.4 1.08 . . . . 0.0 111.024 177.675 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 59.4 ttp -152.17 143.76 23.5 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 125.662 1.585 . . . . 0.0 110.619 176.456 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -141.88 162.29 35.86 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.05 0.94 . . . . 0.0 113.463 -177.364 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 96.1 p -145.87 150.63 36.49 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 125.713 1.605 . . . . 0.0 112.019 -175.805 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 95.8 mtp -144.16 89.02 1.99 Allowed 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 125.154 1.382 . . . . 0.0 110.151 -175.082 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 -142.51 149.41 50.76 Favored Pre-proline 0 CA--C 1.549 0.905 0 C-N-CA 124.772 1.229 . . . . 0.0 112.422 -174.241 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -78.48 -2.93 12.92 Favored 'Trans proline' 0 C--N 1.353 0.766 0 C-N-CA 124.05 3.167 . . . . 0.0 114.61 178.048 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 94.7 mt -107.86 44.16 1.13 Allowed 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 126.218 1.807 . . . . 0.0 111.526 179.787 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -101.56 -19.04 15.65 Favored 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 114.648 1.351 . . . . 0.0 114.648 176.986 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.7 -32.37 5.18 Favored 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 115.94 1.83 . . . . 0.0 115.94 -166.267 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.2 pp -132.88 12.06 1.5 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.237 0 C-N-CA 125.011 1.324 . . . . 0.0 113.979 -176.957 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 14.9 tt -51.44 125.79 5.59 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 C-N-CA 124.805 1.242 . . . . 0.0 112.773 -173.717 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -146.52 -1.71 0.7 Allowed 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 114.154 1.168 . . . . 0.0 114.154 -179.399 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -88.06 9.98 20.69 Favored 'General case' 0 CA--C 1.544 0.715 0 N-CA-C 114.754 1.39 . . . . 0.0 114.754 -169.34 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 14.2 tt -144.08 23.2 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 C-N-CA 126.428 1.891 . . . . 0.0 113.065 -175.181 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 38.1 ttpt -122.93 -39.73 2.48 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 115.108 1.521 . . . . 0.0 115.108 -173.287 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 58.7 tttm -146.7 120.0 8.95 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 125.006 1.322 . . . . 0.0 111.876 -175.461 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -141.81 129.46 21.53 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 125.691 1.597 . . . . 0.0 110.605 179.56 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -153.64 6.44 0.34 Allowed 'General case' 0 CA--C 1.549 0.935 0 N-CA-C 115.229 1.566 . . . . 0.0 115.229 -169.557 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 48.6 t30 -111.59 90.48 3.35 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 124.557 1.143 . . . . 0.0 112.243 -169.676 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 5.8 t0 -152.36 161.87 41.99 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 125.228 1.411 . . . . 0.0 111.123 171.207 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 71.1 m -124.46 81.17 1.91 Allowed 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 125.665 1.586 . . . . 0.0 111.368 -173.589 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 88.3 102.09 0.95 Allowed Glycine 0 CA--C 1.531 1.078 0 C-N-CA 125.341 1.448 . . . . 0.0 112.415 179.757 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 45.0 t -117.05 129.27 73.88 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.919 0 C-N-CA 125.347 1.459 . . . . 0.0 110.609 -179.174 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 54.0 -157.77 0.18 Allowed 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 125.822 1.649 . . . . 0.0 113.073 -178.747 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 42.4 mt -116.71 26.13 10.07 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 126.333 1.853 . . . . 0.0 112.669 -171.091 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -151.12 104.12 2.98 Favored Pre-proline 0 CA--C 1.549 0.941 0 C-N-CA 125.612 1.565 . . . . 0.0 110.575 -166.963 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_endo -78.95 -18.38 11.53 Favored 'Trans proline' 0 CA--C 1.541 0.873 0 C-N-CA 123.222 2.615 . . . . 0.0 113.304 -177.92 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 8.2 tp -148.26 -159.16 0.99 Allowed 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 127.297 2.239 . . . . 0.0 108.285 178.301 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 5.2 t -77.08 52.82 0.92 Allowed 'General case' 0 N--CA 1.479 0.977 0 O-C-N 120.867 -1.146 . . . . 0.0 112.382 174.101 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 8.9 p -157.27 140.53 11.09 Favored Pre-proline 0 CA--C 1.543 0.682 0 C-N-CA 126.387 1.875 . . . . 0.0 110.462 -174.538 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 71.4 Cg_endo -78.76 65.43 8.73 Favored 'Trans proline' 0 CA--C 1.545 1.06 0 C-N-CA 123.738 2.959 . . . . 0.0 111.334 175.799 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 48.1 tptt 62.42 117.59 0.02 OUTLIER Pre-proline 0 N--CA 1.482 1.175 0 C-N-CA 129.048 2.939 . . . . 0.0 114.009 -173.38 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_endo -75.84 148.23 31.87 Favored 'Trans proline' 0 CA--C 1.54 0.782 0 C-N-CA 122.853 2.369 . . . . 0.0 112.041 -178.836 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 55.3 mtmt -68.89 142.33 54.8 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 124.526 1.13 . . . . 0.0 112.781 -176.918 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 51.8 tp -131.03 145.32 52.0 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 126.008 1.723 . . . . 0.0 111.136 -175.255 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -138.23 69.54 1.39 Allowed 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 125.666 1.586 . . . . 0.0 110.381 179.972 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -134.85 84.93 2.14 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 124.871 1.268 . . . . 0.0 112.063 -176.261 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.1 mt -131.55 152.27 50.9 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 127.543 2.337 . . . . 0.0 109.466 170.658 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 71.1 m -73.38 165.13 25.63 Favored 'General case' 0 N--CA 1.48 1.059 0 O-C-N 121.883 -0.511 . . . . 0.0 110.644 169.879 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -55.77 -43.48 76.79 Favored 'General case' 0 N--CA 1.48 1.058 0 O-C-N 120.588 -1.32 . . . . 0.0 113.382 -174.586 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 12.7 tt0 -73.64 -41.44 62.75 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 123.374 0.67 . . . . 0.0 111.464 175.111 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 85.8 mt-30 -62.78 -37.89 88.47 Favored 'General case' 0 CA--C 1.535 0.37 0 O-C-N 121.648 -0.658 . . . . 0.0 111.967 179.334 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 19.8 ttmm -59.4 -41.47 89.5 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 124.355 1.062 . . . . 0.0 110.978 174.348 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 43.3 mt -70.01 -42.37 79.5 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.561 0 CA-C-O 118.234 -0.889 . . . . 0.0 111.099 177.715 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 42.6 mt -64.71 -43.88 96.56 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.891 0 CA-C-N 120.467 1.485 . . . . 0.0 110.35 177.999 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -57.24 -49.18 76.85 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.955 1.302 . . . . 0.0 110.254 177.386 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -65.45 -52.22 54.66 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 124.256 1.022 . . . . 0.0 112.854 177.272 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.0 mm-40 -60.58 -27.56 67.8 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 119.165 0.893 . . . . 0.0 113.038 -178.91 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.452 ' CE2' HG22 ' A' ' 55' ' ' ILE . 1.6 t80 -70.89 -57.4 4.63 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 123.714 0.806 . . . . 0.0 111.153 176.186 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 75.6 mt -60.3 -34.26 56.81 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.49 0 C-N-CA 126.657 1.983 . . . . 0.0 111.338 176.744 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -70.69 -24.42 62.67 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 124.12 0.968 . . . . 0.0 113.111 176.032 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -91.25 -32.41 15.76 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.396 1.078 . . . . 0.0 112.621 178.375 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 5.3 m -121.0 -19.81 4.66 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.981 0 N-CA-C 113.992 1.108 . . . . 0.0 113.992 -173.3 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 83.58 141.47 4.58 Favored Glycine 0 CA--C 1.531 1.085 0 C-N-CA 125.034 1.302 . . . . 0.0 112.205 -171.092 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -65.06 -12.82 54.87 Favored 'General case' 0 N--CA 1.477 0.921 0 CA-C-O 122.986 1.374 . . . . 0.0 113.859 -172.611 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 35.3 mt-30 -78.98 -15.78 57.81 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 126.01 1.724 . . . . 0.0 112.976 175.229 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 60.6 m-80 -116.22 -6.16 11.86 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 114.713 1.375 . . . . 0.0 114.713 -173.061 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.452 HG22 ' CE2' ' A' ' 46' ' ' TYR . 15.5 pt -72.82 160.72 5.2 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 C-N-CA 123.753 0.821 . . . . 0.0 111.644 167.988 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -133.38 146.89 51.67 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 125.025 1.33 . . . . 0.0 110.577 176.004 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -63.05 -28.22 69.94 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.806 0.843 . . . . 0.0 112.135 177.672 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -64.04 -48.8 84.35 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.513 0 C-N-CA 125.275 1.43 . . . . 0.0 109.689 174.574 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 99.3 m -77.68 -40.02 42.91 Favored 'General case' 0 C--O 1.224 -0.277 0 C-N-CA 123.77 0.828 . . . . 0.0 110.721 -176.765 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 17.3 tp -63.44 -37.07 85.89 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.632 1.173 . . . . 0.0 111.774 173.611 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.442 ' HA ' HG13 ' A' ' 66' ' ' ILE . 40.1 t -55.2 -29.56 58.17 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.849 1.259 . . . . 0.0 112.753 169.341 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 59.5 mttm -95.41 -36.33 11.39 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 125.007 1.323 . . . . 0.0 113.569 -178.036 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 10.3 mmtm -61.94 -35.66 79.1 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 125.486 1.514 . . . . 0.0 112.193 -178.856 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.2 mp -115.53 6.67 14.72 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 114.113 1.153 . . . . 0.0 114.113 -176.987 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 13.9 m-80 57.21 59.11 3.53 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 126.431 1.893 . . . . 0.0 113.214 -179.327 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.442 HG13 ' HA ' ' A' ' 61' ' ' SER . 0.9 OUTLIER -125.67 -168.06 0.53 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.789 0 C-N-CA 126.755 2.022 . . . . 0.0 110.982 -172.427 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.5 p -96.35 160.11 14.59 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.311 1.044 . . . . 0.0 110.85 171.052 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 63.9 t -63.66 -28.75 45.63 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.893 0 O-C-N 121.748 -0.595 . . . . 0.0 111.417 173.801 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 44.4 mm-40 -78.55 -39.57 37.39 Favored 'General case' 0 N--CA 1.468 0.431 0 O-C-N 121.046 -1.034 . . . . 0.0 110.123 -179.16 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 5.4 tmtm? -64.38 -47.19 80.18 Favored 'General case' 0 N--CA 1.463 0.181 0 C-N-CA 125.245 1.418 . . . . 0.0 110.604 176.271 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -58.68 -48.14 82.11 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 125.687 1.595 . . . . 0.0 113.233 172.264 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 20.0 ttmm -68.34 -27.64 66.45 Favored 'General case' 0 N--CA 1.466 0.348 0 O-C-N 120.941 -1.1 . . . . 0.0 111.251 -177.928 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -56.96 -38.75 73.4 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 122.898 0.479 . . . . 0.0 112.152 176.403 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 68.1 m-85 -64.42 -45.43 87.61 Favored 'General case' 0 N--CA 1.464 0.272 0 C-N-CA 125.215 1.406 . . . . 0.0 110.956 175.091 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 81.5 mt -69.53 -26.81 31.92 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.649 0 C-N-CA 125.205 1.402 . . . . 0.0 111.468 -177.319 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 53.9 mtmt -79.56 -37.64 35.94 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.595 1.158 . . . . 0.0 113.21 177.168 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 5.9 p30 -87.67 -41.1 13.61 Favored 'General case' 0 C--N 1.342 0.275 0 CA-C-N 119.431 1.014 . . . . 0.0 111.915 177.642 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 10.7 t -109.94 116.62 31.95 Favored 'General case' 0 C--N 1.339 0.13 0 O-C-N 123.648 0.593 . . . . 0.0 111.499 178.271 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 8.5 t-20 -150.13 -48.71 0.13 Allowed 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 113.525 0.935 . . . . 0.0 113.525 -165.332 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 1.4 mpp_? -111.65 17.34 20.03 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 125.901 1.68 . . . . 0.0 113.328 175.744 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.8 tt -126.01 -61.62 1.22 Allowed 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 125.647 1.579 . . . . 0.0 111.648 -175.199 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 64.32 -108.54 2.32 Favored Glycine 0 CA--C 1.538 1.471 0 CA-C-N 118.553 0.615 . . . . 0.0 112.737 -171.531 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 76.7 mtp85 -112.09 -85.5 0.57 Allowed 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 125.887 1.675 . . . . 0.0 111.916 178.168 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 2.7 t -155.14 107.47 2.71 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 125.278 1.431 . . . . 0.0 109.687 176.616 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 11.3 p30 -155.81 -14.98 0.11 Allowed 'General case' 0 CA--C 1.548 0.902 0 N-CA-C 114.659 1.355 . . . . 0.0 114.659 -171.91 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 60.4 t30 -84.65 159.28 20.61 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.447 1.099 . . . . 0.0 111.907 179.163 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 1.2 tp 63.99 169.45 0.17 Allowed 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 126.061 1.744 . . . . 0.0 113.384 -173.341 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 56.8 pttt -107.25 4.72 26.92 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 126.177 1.791 . . . . 0.0 112.677 -178.245 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 13.7 t -150.74 123.18 8.43 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 126.174 1.79 . . . . 0.0 109.227 172.82 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -140.12 3.11 0.56 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.755 0 C-N-CA 125.048 1.339 . . . . 0.0 113.68 -177.007 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 68.06 9.54 57.21 Favored Glycine 0 CA--C 1.539 1.578 0 O-C-N 120.762 -1.211 . . . . 0.0 114.652 -170.585 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . 0.257 3.5 mp 50.23 41.34 0.35 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.886 0 C-N-CA 127.111 2.164 . . . . 0.0 111.861 176.345 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 11.4 tp 51.99 26.67 3.87 Favored 'General case' 0 CA--C 1.552 1.049 0 C-N-CA 126.729 2.011 . . . . 0.0 114.608 -179.498 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 29.9 mt-30 -122.56 55.78 1.15 Allowed 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 125.98 1.712 . . . . 0.0 111.561 -170.065 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -73.24 151.93 41.22 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 124.881 1.272 . . . . 0.0 111.608 171.677 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -108.03 109.61 21.1 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 124.885 1.274 . . . . 0.0 111.563 -176.643 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 53.4 t -127.86 91.41 1.7 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 C-N-CA 125.671 1.589 . . . . 0.0 109.099 174.939 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 38.0 t -169.77 -36.54 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 124.777 1.231 . . . . 0.0 111.949 176.658 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 28.1 t -139.82 130.22 25.46 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 125.142 1.377 . . . . 0.0 111.247 177.211 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 76.3 mtm 51.64 46.06 27.13 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 126.438 1.895 . . . . 0.0 113.835 173.987 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -85.51 4.92 33.64 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 126.328 1.851 . . . . 0.0 114.431 -177.809 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -74.3 163.22 28.07 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 125.529 1.532 . . . . 0.0 114.078 -177.333 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 62.3 mtpt -113.18 154.14 27.17 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 126.344 1.858 . . . . 0.0 112.041 177.202 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 24.9 p -79.67 -51.1 9.67 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.785 1.234 . . . . 0.0 113.188 -179.434 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 74.3 mtm 53.6 -166.25 0.08 Allowed 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 126.41 1.884 . . . . 0.0 113.877 -176.593 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 8.0 t -142.87 162.64 34.93 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 125.122 1.369 . . . . 0.0 112.358 179.378 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 21.1 m-90 . . . . . 0 C--O 1.252 1.216 0 C-N-CA 127.184 2.194 . . . . 0.0 112.167 -175.903 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.552 0 N-CA-C 111.803 -0.519 . . . . 0.0 111.803 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 20.0 m -89.33 -3.8 58.34 Favored 'General case' 0 N--CA 1.479 0.979 0 N-CA-C 115.077 1.51 . . . . 0.0 115.077 -171.551 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 39.6 t60 -75.5 107.91 7.95 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.175 0.99 . . . . 0.0 112.054 -175.784 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 26.8 ptt? -155.21 162.09 41.01 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 125.842 1.657 . . . . 0.0 111.771 176.923 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -136.61 138.85 41.62 Favored 'General case' 0 CA--C 1.539 0.546 0 N-CA-C 112.99 0.737 . . . . 0.0 112.99 172.956 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 45.1 m -150.81 147.69 27.58 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 126.905 2.082 . . . . 0.0 110.292 -176.483 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 52.0 tpp -142.2 59.01 1.47 Allowed 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 124.614 1.166 . . . . 0.0 111.073 -179.124 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -136.61 149.67 67.95 Favored Pre-proline 0 CA--C 1.547 0.861 0 C-N-CA 125.282 1.433 . . . . 0.0 112.023 -176.428 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_endo -81.84 -12.22 11.02 Favored 'Trans proline' 0 C--N 1.351 0.669 0 C-N-CA 123.297 2.665 . . . . 0.0 114.827 178.326 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 89.0 mt -101.01 47.01 0.92 Allowed 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.748 1.619 . . . . 0.0 113.285 -170.248 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 -105.51 -3.1 22.83 Favored 'General case' 0 N--CA 1.479 1.017 0 N-CA-C 114.795 1.406 . . . . 0.0 114.795 172.988 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -130.54 -57.32 1.06 Allowed 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 124.339 1.055 . . . . 0.0 113.356 -165.773 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.9 pp -109.1 12.16 8.82 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 C-N-CA 125.923 1.689 . . . . 0.0 112.837 -176.617 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 15.7 tt -46.96 130.09 3.33 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.777 0 C-N-CA 124.817 1.247 . . . . 0.0 112.314 176.113 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -148.79 49.33 1.0 Allowed 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.533 1.133 . . . . 0.0 111.756 -170.895 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 -106.06 11.12 31.84 Favored 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 114.005 1.113 . . . . 0.0 114.005 -175.303 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 7.2 tp -148.98 32.57 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.919 0 C-N-CA 125.589 1.556 . . . . 0.0 113.458 -172.96 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 3.1 tmtm? -132.35 -53.71 0.96 Allowed 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 123.854 0.861 . . . . 0.0 113.042 -179.449 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 5.0 mptp? 54.88 126.66 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.484 0 C-N-CA 128.225 2.61 . . . . 0.0 113.786 -161.734 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 -138.22 158.66 43.86 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 124.988 1.315 . . . . 0.0 112.857 -179.403 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -91.85 167.31 12.23 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 125.26 1.424 . . . . 0.0 113.146 174.546 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 65.9 m-20 -112.51 157.97 20.47 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.881 1.672 . . . . 0.0 112.436 -179.34 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 27.5 m-20 -80.45 151.2 29.42 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 124.599 1.159 . . . . 0.0 112.378 173.106 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 76.5 p -96.26 -0.08 50.24 Favored 'General case' 0 N--CA 1.477 0.912 0 N-CA-C 115.469 1.655 . . . . 0.0 115.469 -175.692 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -170.29 102.71 0.18 Allowed Glycine 0 CA--C 1.529 0.956 0 O-C-N 121.704 -0.622 . . . . 0.0 112.246 171.392 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 8.2 p -142.76 14.81 0.39 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.148 0 C-N-CA 124.587 1.155 . . . . 0.0 113.671 -172.664 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 2.2 m -133.65 150.52 51.56 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 124.273 1.029 . . . . 0.0 112.933 -166.117 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.448 HD23 ' H ' ' A' ' 22' ' ' LEU . 2.0 pt? -100.97 31.37 3.62 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 126.659 1.984 . . . . 0.0 115.314 -175.082 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -108.71 133.49 20.63 Favored Pre-proline 0 CA--C 1.548 0.874 0 C-N-CA 125.615 1.566 . . . . 0.0 111.468 -178.127 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -75.23 -39.24 1.19 Allowed 'Trans proline' 0 CA--C 1.542 0.898 0 C-N-CA 122.094 1.863 . . . . 0.0 113.449 -179.145 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 2.1 tt -154.2 72.82 0.9 Allowed 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 124.872 1.269 . . . . 0.0 110.541 179.471 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 33.1 m 53.69 37.3 25.84 Favored 'General case' 0 N--CA 1.48 1.069 0 N-CA-C 114.985 1.476 . . . . 0.0 114.985 174.946 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 9.4 p -153.36 145.28 16.82 Favored Pre-proline 0 N--CA 1.474 0.756 0 C-N-CA 125.72 1.608 . . . . 0.0 110.236 -172.847 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 93.7 Cg_endo -77.02 64.96 7.82 Favored 'Trans proline' 0 CA--C 1.548 1.187 0 C-N-CA 123.506 2.804 . . . . 0.0 112.242 177.073 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 39.0 tptt 59.45 113.18 0.02 OUTLIER Pre-proline 0 N--CA 1.483 1.204 0 C-N-CA 129.561 3.145 . . . . 0.0 114.175 -175.919 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 82.6 Cg_endo -76.45 145.42 26.64 Favored 'Trans proline' 0 C--N 1.352 0.713 0 C-N-CA 122.862 2.374 . . . . 0.0 111.568 -176.902 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 64.5 mttp -66.89 135.48 53.92 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 124.128 0.971 . . . . 0.0 111.485 -177.278 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 14.3 tp -137.33 136.67 38.18 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.887 1.675 . . . . 0.0 110.676 -173.214 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -130.78 67.72 1.49 Allowed 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 125.091 1.356 . . . . 0.0 110.837 178.627 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -122.72 86.27 2.55 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.134 1.374 . . . . 0.0 111.889 -173.908 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.2 mt -135.66 151.58 50.35 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 127.225 2.21 . . . . 0.0 109.726 176.465 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 22.8 t -71.48 164.71 25.29 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 123.006 0.523 . . . . 0.0 110.805 170.655 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -56.74 -44.53 81.78 Favored 'General case' 0 N--CA 1.477 0.906 0 O-C-N 120.388 -1.445 . . . . 0.0 113.155 -174.04 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 7.5 pt20 -76.64 -34.72 58.3 Favored 'General case' 0 N--CA 1.47 0.568 0 O-C-N 121.626 -0.671 . . . . 0.0 112.251 174.59 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 89.2 mt-30 -66.0 -39.44 90.3 Favored 'General case' 0 CA--C 1.53 0.207 0 O-C-N 121.693 -0.629 . . . . 0.0 111.535 -179.947 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 40.8 ttmt -59.6 -42.27 92.23 Favored 'General case' 0 N--CA 1.464 0.248 0 C-N-CA 124.749 1.22 . . . . 0.0 110.621 176.034 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 48.0 mt -68.56 -42.3 83.46 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.481 0 CA-C-O 118.256 -0.878 . . . . 0.0 111.06 177.286 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 40.2 mt -64.47 -44.36 96.97 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 CA-C-N 120.601 1.546 . . . . 0.0 110.335 178.668 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -60.61 -48.78 80.27 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 125.114 1.366 . . . . 0.0 111.128 177.366 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -64.27 -51.36 63.96 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 124.794 1.237 . . . . 0.0 112.49 177.27 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 17.0 mm-40 -61.17 -28.82 69.4 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-N 118.991 0.814 . . . . 0.0 112.545 179.246 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -65.3 -58.55 5.65 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-N 118.944 0.793 . . . . 0.0 110.47 174.434 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.3 mt -62.37 -35.58 70.28 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.363 0 C-N-CA 126.796 2.038 . . . . 0.0 111.796 179.394 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -72.08 -28.04 63.05 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.021 0.928 . . . . 0.0 112.389 178.551 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -86.71 -38.08 17.32 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.146 0.978 . . . . 0.0 112.555 175.429 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.5 m -108.5 -7.06 10.95 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.15 0 N-CA-C 114.664 1.357 . . . . 0.0 114.664 -173.197 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 86.21 27.77 29.84 Favored Glycine 0 CA--C 1.531 1.09 0 C-N-CA 124.732 1.158 . . . . 0.0 115.336 162.488 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 55.38 14.18 1.06 Allowed 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 127.224 2.21 . . . . 0.0 114.895 -176.165 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 5.1 pt20 -124.12 -6.94 7.73 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 125.147 1.379 . . . . 0.0 113.969 -170.449 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 57.2 m-80 -118.74 0.53 11.47 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 124.766 1.226 . . . . 0.0 113.264 174.414 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 23.0 pt -75.96 152.37 6.15 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 C-N-CA 123.271 0.628 . . . . 0.0 112.012 177.519 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -141.48 146.53 36.57 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 125.524 1.529 . . . . 0.0 109.354 176.442 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -62.94 -28.23 69.93 Favored 'General case' 0 C--O 1.222 -0.36 0 C-N-CA 123.743 0.817 . . . . 0.0 112.025 178.455 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -63.55 -43.38 98.25 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.471 0 C-N-CA 125.193 1.397 . . . . 0.0 109.864 174.15 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 81.9 m -83.53 -43.0 16.2 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 123.867 0.867 . . . . 0.0 110.296 -174.18 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 6.2 mt -59.13 -37.19 76.65 Favored 'General case' 0 CA--C 1.539 0.532 0 O-C-N 121.447 -0.783 . . . . 0.0 111.977 169.954 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.482 ' HA ' HG13 ' A' ' 66' ' ' ILE . 28.7 t -52.31 -33.82 44.09 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 124.055 0.942 . . . . 0.0 111.938 173.179 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -99.2 -29.53 12.78 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 124.729 1.212 . . . . 0.0 113.986 -174.774 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 18.7 mmmt -62.49 -29.13 70.32 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 125.108 1.363 . . . . 0.0 112.817 177.593 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.9 mp -127.34 14.62 7.18 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 124.865 1.266 . . . . 0.0 113.901 -177.51 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . 0.278 8.1 p30 47.12 51.18 13.36 Favored 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 126.211 1.805 . . . . 0.0 113.712 -176.257 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.482 HG13 ' HA ' ' A' ' 61' ' ' SER . 2.7 pt -110.46 -174.88 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 C-N-CA 126.905 2.082 . . . . 0.0 111.253 -177.168 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -84.96 158.55 20.49 Favored 'General case' 0 N--CA 1.477 0.912 0 O-C-N 121.227 -0.92 . . . . 0.0 110.999 170.881 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 95.5 t -63.67 -31.05 51.56 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 O-C-N 121.809 -0.557 . . . . 0.0 111.199 170.901 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -74.94 -35.31 62.16 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 119.783 1.174 . . . . 0.0 110.367 178.511 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 22.2 tttt -65.56 -48.9 70.83 Favored 'General case' 0 C--N 1.342 0.257 0 C-N-CA 123.279 0.631 . . . . 0.0 110.833 175.489 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -58.28 -41.46 84.42 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.917 1.687 . . . . 0.0 113.087 175.942 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 37.2 ttmt -74.13 -30.4 62.28 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 125.472 1.509 . . . . 0.0 111.6 -178.714 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -56.54 -42.92 79.31 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 122.85 0.46 . . . . 0.0 111.772 177.242 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 53.5 m-85 -64.53 -42.57 95.66 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 125.006 1.323 . . . . 0.0 111.004 178.495 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 74.0 mt -65.56 -38.98 83.69 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.477 0 C-N-CA 124.05 0.94 . . . . 0.0 110.672 178.817 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 71.3 mmtt -72.6 -40.72 66.32 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 124.761 1.224 . . . . 0.0 112.969 -177.403 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 4.7 p30 -87.53 -38.73 15.76 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 118.636 0.653 . . . . 0.0 111.208 -178.949 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -93.37 26.42 2.97 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 114.964 1.468 . . . . 0.0 114.964 -166.852 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -81.84 -36.85 27.84 Favored 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 114.139 1.162 . . . . 0.0 114.139 -169.106 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 2.5 mpt_? -73.58 -10.7 59.98 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 124.857 1.263 . . . . 0.0 113.323 -178.979 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 9.5 tt -68.6 -31.85 71.33 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 125.177 1.391 . . . . 0.0 111.86 169.269 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -91.05 -120.57 2.37 Favored Glycine 0 CA--C 1.535 1.317 0 C-N-CA 125.338 1.447 . . . . 0.0 112.817 175.52 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -117.45 -89.26 0.59 Allowed 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 125.639 1.576 . . . . 0.0 111.413 -177.739 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 4.5 t -159.86 98.23 1.33 Allowed 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 125.075 1.35 . . . . 0.0 110.49 176.756 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 64.8 m-80 -144.67 49.1 1.31 Allowed 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 125.591 1.557 . . . . 0.0 111.974 -171.978 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 35.2 t-20 -127.58 -178.18 4.37 Favored 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 125.727 1.611 . . . . 0.0 110.573 175.023 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 5.8 tp 60.86 25.73 15.63 Favored 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 126.663 1.985 . . . . 0.0 114.13 179.549 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 65.4 pttt -129.57 8.48 5.4 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 126.527 1.931 . . . . 0.0 114.496 -178.388 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 11.5 t -154.9 129.69 9.33 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 125.549 1.54 . . . . 0.0 109.703 173.566 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -137.67 2.02 0.75 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.688 0 C-N-CA 125.799 1.639 . . . . 0.0 113.722 179.628 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 68.82 10.22 60.81 Favored Glycine 0 CA--C 1.539 1.586 0 O-C-N 120.884 -1.135 . . . . 0.0 114.465 -171.811 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . 0.262 3.2 mp 50.4 40.7 0.35 Allowed 'Isoleucine or valine' 0 CA--C 1.549 0.917 0 C-N-CA 127.111 2.164 . . . . 0.0 111.995 176.44 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 11.4 tp 54.03 23.22 3.89 Favored 'General case' 0 CA--C 1.553 1.058 0 C-N-CA 126.55 1.94 . . . . 0.0 114.54 -177.997 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 36.2 mt-30 -134.91 46.49 2.44 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 127.193 2.197 . . . . 0.0 110.388 -170.298 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -140.92 107.34 5.28 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.17 1.788 . . . . 0.0 109.386 -176.098 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -146.23 31.47 1.01 Allowed 'General case' 0 N--CA 1.479 0.984 0 N-CA-C 115.503 1.668 . . . . 0.0 115.503 -166.593 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 52.6 t -135.65 117.9 21.43 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 C-N-CA 123.684 0.794 . . . . 0.0 111.937 -175.962 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 37.8 t -160.54 -72.69 0.07 Allowed 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 123.931 0.892 . . . . 0.0 112.618 176.605 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 25.5 m -73.0 -21.63 60.8 Favored 'General case' 0 N--CA 1.48 1.058 0 N-CA-C 113.806 1.039 . . . . 0.0 113.806 -176.422 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -132.61 136.62 46.64 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 125.957 1.703 . . . . 0.0 110.109 168.257 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -147.47 100.83 3.3 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.791 1.636 . . . . 0.0 108.463 175.814 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -137.59 149.91 47.03 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.757 1.223 . . . . 0.0 112.15 179.569 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -124.56 108.77 12.43 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 125.694 1.598 . . . . 0.0 109.732 175.52 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 10.8 t -151.62 158.25 43.23 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 125.641 1.576 . . . . 0.0 110.794 -178.887 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 74.6 mmm -113.25 163.67 14.5 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 125.169 1.388 . . . . 0.0 113.353 -176.645 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 9.5 t -146.09 153.5 40.77 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 125.998 1.719 . . . . 0.0 111.403 -173.495 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 7.4 t-105 . . . . . 0 C--O 1.254 1.29 0 C-N-CA 127.979 2.512 . . . . 0.0 114.19 179.639 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.498 0 N-CA-C 111.287 -0.725 . . . . 0.0 111.287 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 74.4 p -140.67 159.14 42.85 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 125.993 1.717 . . . . 0.0 111.686 178.477 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 24.9 m170 -92.5 -52.41 4.67 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 123.653 0.781 . . . . 0.0 112.526 -177.126 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 12.8 tpt -156.83 152.47 26.89 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 125.587 1.555 . . . . 0.0 111.464 177.717 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -138.75 159.6 41.72 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.709 1.204 . . . . 0.0 112.359 175.032 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 22.7 t -142.09 128.64 20.22 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 124.975 1.31 . . . . 0.0 110.708 176.584 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 10.4 tpt -155.79 88.81 1.13 Allowed 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 124.518 1.127 . . . . 0.0 110.852 -173.037 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 48.2 m-20 -95.84 148.87 35.24 Favored Pre-proline 0 CA--C 1.549 0.911 0 C-N-CA 124.329 1.051 . . . . 0.0 113.097 -179.745 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 65.4 Cg_endo -84.39 -5.97 10.1 Favored 'Trans proline' 0 C--N 1.351 0.703 0 C-N-CA 123.872 3.048 . . . . 0.0 114.516 174.58 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 97.8 mt -97.72 44.66 1.04 Allowed 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.153 1.381 . . . . 0.0 113.437 -172.414 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -111.33 -1.67 15.94 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 124.729 1.212 . . . . 0.0 114.235 171.298 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.67 -56.21 1.14 Allowed 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 124.489 1.116 . . . . 0.0 113.191 -165.211 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.7 pp -110.74 10.04 8.67 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.784 0 C-N-CA 125.848 1.659 . . . . 0.0 112.914 -178.134 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 13.3 tt -50.32 133.73 10.24 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 C-N-CA 124.189 0.996 . . . . 0.0 112.392 176.424 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 6.5 t30 -140.17 12.39 2.4 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 124.99 1.316 . . . . 0.0 113.195 -176.732 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -79.57 10.17 4.2 Favored 'General case' 0 CA--C 1.546 0.805 0 N-CA-C 115.029 1.492 . . . . 0.0 115.029 -169.468 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 13.9 tt -139.68 20.57 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 C-N-CA 127.247 2.219 . . . . 0.0 112.579 176.672 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 1.5 tmtp? -117.96 -42.23 2.84 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 124.367 1.067 . . . . 0.0 113.603 -176.112 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 41.7 tptt -135.88 114.18 11.56 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 125.104 1.362 . . . . 0.0 110.976 -179.438 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 14.6 pt-20 -159.7 169.78 22.97 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 125.974 1.71 . . . . 0.0 111.577 -173.958 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -73.42 161.19 30.71 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 123.589 0.755 . . . . 0.0 112.766 174.338 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 53.3 t-20 -143.39 120.98 11.77 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 124.47 1.108 . . . . 0.0 111.34 -177.71 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 20.3 m-20 -135.06 25.11 3.58 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 125.668 1.587 . . . . 0.0 112.17 176.172 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 35.6 m -79.1 -0.61 32.28 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 115.234 1.568 . . . . 0.0 115.234 -169.642 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -168.58 105.02 0.22 Allowed Glycine 0 CA--C 1.533 1.167 0 C-N-CA 124.119 0.866 . . . . 0.0 111.906 166.863 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 5.1 p -125.35 7.98 4.31 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.295 0 C-N-CA 125.196 1.398 . . . . 0.0 113.919 -174.903 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 3.9 m -112.73 139.02 48.69 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 124.164 0.986 . . . . 0.0 112.55 -163.378 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.532 HD23 ' H ' ' A' ' 22' ' ' LEU . 2.1 pt? -71.86 38.6 0.07 Allowed 'General case' 0 CA--C 1.551 1.007 0 C-N-CA 126.593 1.957 . . . . 0.0 115.196 178.766 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -137.28 151.35 71.38 Favored Pre-proline 0 CA--C 1.549 0.912 0 C-N-CA 125.768 1.627 . . . . 0.0 112.62 -171.626 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_endo -75.34 -24.57 12.18 Favored 'Trans proline' 0 CA--C 1.542 0.891 0 C-N-CA 123.29 2.66 . . . . 0.0 113.515 -179.348 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.406 ' HG ' ' H ' ' A' ' 26' ' ' SER . 8.3 tp -150.65 -165.67 2.33 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 127.137 2.175 . . . . 0.0 108.358 177.464 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.406 ' H ' ' HG ' ' A' ' 25' ' ' LEU . 3.7 t -78.12 45.87 0.56 Allowed 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.892 1.277 . . . . 0.0 113.192 177.851 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 7.4 p -157.64 138.92 9.67 Favored Pre-proline 0 N--CA 1.472 0.636 0 C-N-CA 126.694 1.997 . . . . 0.0 109.844 -177.11 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_endo -76.69 71.05 6.2 Favored 'Trans proline' 0 CA--C 1.545 1.071 0 C-N-CA 123.615 2.877 . . . . 0.0 112.183 -176.564 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 53.1 tptt 61.07 108.97 0.03 OUTLIER Pre-proline 0 N--CA 1.481 1.106 0 C-N-CA 129.267 3.027 . . . . 0.0 112.733 -172.753 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 98.7 Cg_endo -72.09 146.36 46.43 Favored 'Trans proline' 0 C--N 1.351 0.691 0 C-N-CA 122.567 2.178 . . . . 0.0 111.55 -177.364 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 9.6 ptmm? -67.11 142.68 57.01 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 112.734 0.642 . . . . 0.0 112.734 -175.231 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 39.2 tp -137.07 136.6 38.51 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 126.075 1.75 . . . . 0.0 109.638 -178.005 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -145.42 50.86 1.21 Allowed 'General case' 0 N--CA 1.471 0.609 0 CA-C-O 123.149 1.452 . . . . 0.0 111.681 -176.3 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -112.4 84.01 1.9 Allowed 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 126.517 1.927 . . . . 0.0 111.154 -173.198 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 2.1 mt -130.28 153.92 48.14 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 127.129 2.172 . . . . 0.0 110.085 176.54 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 15.5 m -72.18 166.66 21.93 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.397 0.679 . . . . 0.0 111.707 176.257 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -57.04 -36.44 70.49 Favored 'General case' 0 N--CA 1.477 0.887 0 N-CA-C 113.951 1.093 . . . . 0.0 113.951 -172.697 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 11.3 tt0 -87.23 -40.9 14.13 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 123.857 0.863 . . . . 0.0 112.253 173.7 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 24.7 mm-40 -53.75 -44.3 69.86 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 124.322 1.049 . . . . 0.0 111.475 176.943 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 13.7 ptmt -66.0 -32.67 74.29 Favored 'General case' 0 N--CA 1.469 0.507 0 O-C-N 121.561 -0.712 . . . . 0.0 111.926 -179.262 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 49.3 mt -72.82 -43.71 59.93 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 CA-C-N 119.124 0.874 . . . . 0.0 110.864 175.907 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 50.2 mt -60.47 -43.36 94.03 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.978 0 CA-C-N 119.706 1.139 . . . . 0.0 110.362 176.737 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -61.6 -48.54 80.47 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 124.966 1.306 . . . . 0.0 110.958 175.278 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -67.47 -48.84 65.99 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 124.081 0.952 . . . . 0.0 113.033 -178.218 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -61.79 -23.68 66.36 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.707 0.803 . . . . 0.0 113.061 -179.032 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -73.09 -58.72 3.11 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 123.971 0.909 . . . . 0.0 111.141 174.564 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 67.6 mt -57.96 -35.41 51.88 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 C-N-CA 126.869 2.068 . . . . 0.0 111.476 176.267 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -70.21 -22.56 62.91 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 124.256 1.022 . . . . 0.0 113.317 176.644 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -93.72 -31.86 14.26 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.689 1.196 . . . . 0.0 112.719 178.22 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 6.3 m -121.72 -20.65 4.01 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 N-CA-C 113.971 1.101 . . . . 0.0 113.971 -172.991 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 84.42 142.89 5.69 Favored Glycine 0 CA--C 1.531 1.059 0 C-N-CA 125.047 1.308 . . . . 0.0 112.24 -171.341 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -67.22 -5.89 15.81 Favored 'General case' 0 N--CA 1.479 0.999 0 CA-C-O 122.688 1.232 . . . . 0.0 114.24 -171.207 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 38.8 mt-30 -90.3 -16.25 29.63 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 126.476 1.91 . . . . 0.0 112.753 176.512 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 58.5 m-80 -111.06 -6.03 14.7 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.831 1.252 . . . . 0.0 114.119 -176.336 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 15.5 pt -73.3 161.26 4.97 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 C-N-CA 124.07 0.948 . . . . 0.0 111.42 166.189 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.1 p -131.75 145.49 51.64 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 125.162 1.385 . . . . 0.0 110.495 175.953 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -61.65 -29.88 70.35 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 123.976 0.91 . . . . 0.0 111.844 177.748 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -63.0 -49.07 85.02 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.499 0 C-N-CA 125.316 1.446 . . . . 0.0 109.977 175.261 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 58.5 m -78.48 -42.98 28.2 Favored 'General case' 0 C--O 1.222 -0.357 0 C-N-CA 123.711 0.804 . . . . 0.0 109.854 -175.275 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 20.2 tp -61.5 -36.43 80.5 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.435 1.094 . . . . 0.0 112.17 174.874 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.476 ' HA ' HG13 ' A' ' 66' ' ' ILE . 38.4 t -54.03 -30.72 48.85 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 124.765 1.226 . . . . 0.0 112.725 169.041 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -102.21 -23.98 13.96 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.435 1.494 . . . . 0.0 114.373 -174.724 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 69.9 mmtt -61.5 -39.4 90.84 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 124.582 1.153 . . . . 0.0 110.993 170.429 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 9.2 mt -115.03 4.34 14.68 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 126.666 1.986 . . . . 0.0 113.209 -166.665 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . 0.292 7.4 p30 46.29 57.95 4.92 Favored 'General case' 0 CA--C 1.55 0.943 0 C-N-CA 126.803 2.041 . . . . 0.0 114.085 -175.266 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.476 HG13 ' HA ' ' A' ' 61' ' ' SER . 0.9 OUTLIER -120.83 -168.23 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 C-N-CA 127.386 2.274 . . . . 0.0 111.359 -175.756 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -88.68 156.88 18.75 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.131 0.972 . . . . 0.0 110.867 169.5 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 87.6 t -62.6 -31.58 52.53 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 123.209 0.604 . . . . 0.0 111.345 173.27 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 10.7 mp0 -79.53 -34.41 41.12 Favored 'General case' 0 CA--C 1.532 0.27 0 O-C-N 120.744 -1.222 . . . . 0.0 110.037 -178.317 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 12.2 tmtt? -68.67 -41.82 78.74 Favored 'General case' 0 C--N 1.343 0.304 0 C-N-CA 123.375 0.67 . . . . 0.0 111.306 177.239 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -58.71 -43.53 90.12 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.39 1.476 . . . . 0.0 112.661 169.188 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 37.6 ttpt -69.26 -27.52 65.51 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 125.004 1.322 . . . . 0.0 111.951 -179.346 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -61.47 -34.36 75.32 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 123.321 0.648 . . . . 0.0 112.462 177.661 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 55.9 m-85 -67.18 -45.71 76.13 Favored 'General case' 0 N--CA 1.466 0.348 0 C-N-CA 124.369 1.067 . . . . 0.0 110.528 171.057 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 73.9 mt -65.17 -24.84 36.04 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.834 0 O-C-N 121.135 -0.978 . . . . 0.0 111.675 -179.859 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.42 ' HA ' ' HE3' ' A' ' 76' ' ' LYS . 0.0 OUTLIER -81.78 -37.51 27.04 Favored 'General case' 0 N--CA 1.472 0.655 0 O-C-N 120.248 -1.533 . . . . 0.0 113.291 175.983 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 3.7 p30 -94.77 -39.56 10.22 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 119.807 1.185 . . . . 0.0 112.509 -176.776 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 9.2 m -89.36 -9.31 50.88 Favored 'General case' 0 CA--C 1.538 0.516 0 N-CA-C 114.236 1.198 . . . . 0.0 114.236 -164.376 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 12.7 p30 -65.5 144.47 57.0 Favored 'General case' 0 CA--C 1.546 0.801 0 O-C-N 121.258 -0.901 . . . . 0.0 113.216 -169.228 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 3.7 mpt_? 53.76 23.43 3.74 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 126.379 1.872 . . . . 0.0 115.125 -172.565 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 62.1 tp -143.72 -41.91 0.28 Allowed 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 125.0 1.32 . . . . 0.0 113.739 178.304 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 78.19 -80.89 1.35 Allowed Glycine 0 CA--C 1.532 1.117 0 O-C-N 121.72 -0.613 . . . . 0.0 112.562 -172.568 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 82.0 mtm-85 -136.87 -71.28 0.45 Allowed 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 125.497 1.519 . . . . 0.0 112.702 -175.648 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 4.9 t -164.74 83.85 0.4 Allowed 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 124.733 1.213 . . . . 0.0 109.768 179.499 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 69.1 m-80 -139.8 139.94 36.51 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.633 1.173 . . . . 0.0 111.302 -174.944 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 45.5 t30 -146.48 148.82 32.63 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 125.458 1.503 . . . . 0.0 111.103 179.496 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 9.3 tp 58.21 21.26 7.91 Favored 'General case' 0 CA--C 1.554 1.113 0 C-N-CA 126.205 1.802 . . . . 0.0 114.625 -179.077 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 18.6 ptmt -144.58 10.03 1.4 Allowed 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 126.102 1.761 . . . . 0.0 114.357 -173.5 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 12.3 t -156.68 129.68 7.87 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 125.932 1.693 . . . . 0.0 109.434 -179.361 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -137.81 0.89 0.74 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.75 0 C-N-CA 125.46 1.504 . . . . 0.0 114.176 -176.997 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 82.73 -8.13 63.48 Favored Glycine 0 N--CA 1.477 1.367 0 O-C-N 120.867 -1.146 . . . . 0.0 114.903 -167.764 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 4.5 mp 54.75 80.23 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 C-N-CA 126.953 2.101 . . . . 0.0 110.319 -174.47 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 8.7 mp -53.07 101.39 0.04 OUTLIER 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 126.555 1.942 . . . . 0.0 111.619 -169.39 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 6.5 pt20 -127.6 -8.64 5.66 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 125.856 1.663 . . . . 0.0 114.08 -177.861 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -68.85 146.9 52.45 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 125.364 1.466 . . . . 0.0 112.726 -177.895 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -99.4 105.56 17.53 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 124.595 1.158 . . . . 0.0 110.493 177.397 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 57.3 t -133.9 100.62 3.42 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.574 0 C-N-CA 125.199 1.4 . . . . 0.0 109.526 174.134 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 43.1 t -166.54 -73.1 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.428 1.091 . . . . 0.0 111.834 171.779 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 18.1 t -84.94 -32.69 22.94 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 124.095 0.958 . . . . 0.0 112.838 -176.502 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -126.06 125.46 42.65 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 125.836 1.654 . . . . 0.0 110.274 175.807 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -152.64 105.91 3.03 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 125.653 1.581 . . . . 0.0 108.254 173.47 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -144.78 -41.49 0.25 Allowed 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 116.009 1.855 . . . . 0.0 116.009 179.388 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 46.8 mmtm -140.58 35.42 1.83 Allowed 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 126.611 1.964 . . . . 0.0 113.204 -173.443 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 58.3 p -92.69 -0.73 57.25 Favored 'General case' 0 N--CA 1.478 0.956 0 N-CA-C 115.002 1.482 . . . . 0.0 115.002 -177.963 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 64.5 mtt -70.83 157.27 38.39 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.802 1.241 . . . . 0.0 113.501 179.944 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 10.9 t -108.4 166.8 10.5 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 125.547 1.539 . . . . 0.0 111.711 169.677 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 33.8 t-105 . . . . . 0 C--O 1.254 1.307 0 C-N-CA 125.676 1.59 . . . . 0.0 112.902 -171.523 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.587 0 N-CA-C 112.062 -0.415 . . . . 0.0 112.062 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 51.1 p -135.55 -73.95 0.45 Allowed 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 124.705 1.202 . . . . 0.0 112.727 -178.154 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 13.7 t-80 -149.02 59.92 1.05 Allowed 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 125.138 1.375 . . . . 0.0 111.832 -176.854 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 62.7 ttp -144.2 139.06 28.5 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 125.127 1.371 . . . . 0.0 111.563 178.911 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -145.89 153.69 41.13 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.454 1.102 . . . . 0.0 112.978 175.723 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 58.5 m -146.8 151.57 37.35 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 126.627 1.971 . . . . 0.0 110.919 -175.571 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -142.79 114.94 8.34 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 124.211 1.005 . . . . 0.0 110.635 177.467 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 58.7 m-20 38.11 55.61 4.47 Favored Pre-proline 0 CA--C 1.555 1.154 0 C-N-CA 127.721 2.409 . . . . 0.0 115.183 -177.711 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_endo -80.42 -7.5 13.82 Favored 'Trans proline' 0 C--N 1.351 0.683 0 C-N-CA 123.034 2.489 . . . . 0.0 114.907 -170.53 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -133.65 23.62 3.99 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 125.307 1.443 . . . . 0.0 114.594 -173.633 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -111.27 0.3 16.67 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 114.59 1.33 . . . . 0.0 114.59 -168.92 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -136.69 -30.13 0.91 Allowed 'General case' 0 N--CA 1.477 0.886 0 N-CA-C 116.442 2.016 . . . . 0.0 116.442 -164.726 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.2 pp -136.93 11.78 0.83 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.29 0 C-N-CA 125.427 1.491 . . . . 0.0 113.848 -177.833 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 19.0 tt -45.89 107.39 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.926 0 C-N-CA 126.246 1.818 . . . . 0.0 114.654 -163.596 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 21.7 t-20 -161.58 104.48 1.23 Allowed 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 125.683 1.593 . . . . 0.0 110.537 175.793 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -149.4 9.56 0.74 Allowed 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 114.477 1.288 . . . . 0.0 114.477 175.786 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 12.7 tt -151.06 27.65 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.164 0 C-N-CA 124.548 1.139 . . . . 0.0 113.83 -169.827 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 58.1 tttp -141.09 -40.37 0.4 Allowed 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 124.353 1.061 . . . . 0.0 113.362 -177.467 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 52.9 mttp -137.31 157.51 46.46 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 127.29 2.236 . . . . 0.0 112.151 174.779 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -148.39 149.16 31.27 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 126.503 1.921 . . . . 0.0 110.058 175.98 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -138.53 173.53 11.5 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.875 1.27 . . . . 0.0 112.554 177.32 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 68.5 m-80 -129.86 159.28 37.05 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 126.091 1.757 . . . . 0.0 111.755 -176.447 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -140.95 162.23 35.97 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 124.947 1.299 . . . . 0.0 112.106 171.388 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 61.5 p -128.98 33.1 4.65 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 125.627 1.571 . . . . 0.0 112.999 -178.451 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 77.56 46.06 10.28 Favored Glycine 0 CA--C 1.531 1.091 0 C-N-CA 123.81 0.719 . . . . 0.0 113.497 -179.763 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 2.6 p -108.64 106.31 20.45 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 C-N-CA 126.474 1.91 . . . . 0.0 110.651 -174.761 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -155.93 167.86 29.07 Favored 'General case' 0 N--CA 1.476 0.863 0 CA-C-O 122.141 0.972 . . . . 0.0 113.454 -178.881 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 5.2 mt -98.65 33.89 2.17 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 126.741 2.017 . . . . 0.0 111.918 -167.037 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -160.95 161.69 23.76 Favored Pre-proline 0 CA--C 1.551 0.987 0 C-N-CA 125.588 1.555 . . . . 0.0 111.727 -162.352 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -68.16 48.25 0.4 Allowed 'Trans proline' 0 CA--C 1.553 1.437 1 C-N-CA 125.771 4.314 . . . . 0.0 115.047 173.988 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 28.5 tp -86.49 104.26 15.79 Favored 'General case' 0 CA--C 1.538 0.488 0 O-C-N 120.375 -1.453 . . . . 0.0 109.787 174.698 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 1.4 t 55.39 34.16 22.36 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 125.251 1.421 . . . . 0.0 114.255 -175.077 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 8.0 p -155.93 143.67 14.1 Favored Pre-proline 0 N--CA 1.471 0.597 0 C-N-CA 125.943 1.697 . . . . 0.0 109.619 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 94.3 Cg_endo -76.43 60.99 6.64 Favored 'Trans proline' 0 CA--C 1.545 1.064 0 C-N-CA 123.701 2.934 . . . . 0.0 112.047 177.661 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 63.06 129.25 0.02 OUTLIER Pre-proline 0 N--CA 1.481 1.108 0 C-N-CA 128.954 2.902 . . . . 0.0 113.924 -175.602 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -77.93 163.37 28.56 Favored 'Trans proline' 0 CA--C 1.54 0.806 0 C-N-CA 123.051 2.501 . . . . 0.0 112.46 172.94 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -114.55 109.89 18.96 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 125.503 1.521 . . . . 0.0 110.278 174.449 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -146.83 143.54 28.67 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.691 1.196 . . . . 0.0 113.943 -178.72 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 17.0 mm-40 -137.14 57.95 1.73 Allowed 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 126.766 2.027 . . . . 0.0 109.573 179.218 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -130.03 98.09 4.66 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 124.948 1.299 . . . . 0.0 111.595 -174.545 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.2 mp -120.09 162.05 19.94 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 127.246 2.218 . . . . 0.0 110.909 173.429 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 19.3 t -70.04 165.4 21.95 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 122.781 0.432 . . . . 0.0 110.472 170.547 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -56.45 -46.09 80.5 Favored 'General case' 0 N--CA 1.476 0.84 0 O-C-N 120.388 -1.445 . . . . 0.0 112.933 -173.188 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 9.2 tt0 -72.93 -43.0 62.9 Favored 'General case' 0 CA--C 1.539 0.523 0 O-C-N 121.41 -0.806 . . . . 0.0 111.418 177.686 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 36.7 mm-40 -55.1 -44.44 74.94 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.659 1.184 . . . . 0.0 111.233 175.664 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 42.0 ttmt -62.95 -44.0 97.26 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 125.171 1.388 . . . . 0.0 111.58 177.53 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 54.0 mt -65.95 -41.97 90.9 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 CA-C-N 119.12 0.873 . . . . 0.0 111.134 178.031 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 37.9 mt -66.67 -42.26 89.38 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.885 0 CA-C-N 120.291 1.405 . . . . 0.0 110.512 179.001 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -60.11 -47.26 86.64 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.033 0.933 . . . . 0.0 110.898 175.614 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -68.01 -49.85 59.08 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 124.819 1.248 . . . . 0.0 112.217 -179.931 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -64.27 -23.49 67.32 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 119.209 0.913 . . . . 0.0 112.976 -176.953 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -71.31 -59.68 2.64 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.388 1.075 . . . . 0.0 110.792 173.226 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 62.9 mt -62.5 -34.68 66.09 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.256 0 C-N-CA 127.417 2.287 . . . . 0.0 111.953 -179.625 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -68.58 -33.46 74.1 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 123.784 0.834 . . . . 0.0 111.989 176.933 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -85.36 -38.18 19.04 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.696 0.799 . . . . 0.0 112.3 179.068 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.0 m -108.39 -5.45 10.68 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.126 0 N-CA-C 114.013 1.116 . . . . 0.0 114.013 -173.909 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 87.79 24.63 34.83 Favored Glycine 0 N--CA 1.472 1.09 0 C-N-CA 125.047 1.308 . . . . 0.0 115.73 159.639 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 56.23 10.67 0.66 Allowed 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 127.146 2.178 . . . . 0.0 114.848 -174.014 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 5.2 pt20 -124.87 -5.91 7.41 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 125.564 1.546 . . . . 0.0 113.573 -169.873 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 59.4 m-80 -121.38 2.33 10.24 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.34 1.456 . . . . 0.0 112.577 173.294 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 23.2 pt -74.97 154.19 6.44 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.583 0 C-N-CA 123.048 0.539 . . . . 0.0 111.147 173.958 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -136.77 142.58 42.99 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 124.972 1.309 . . . . 0.0 109.177 177.465 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -61.57 -26.88 68.24 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 118.958 0.799 . . . . 0.0 112.494 -179.766 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -65.36 -47.69 86.06 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.559 0 C-N-CA 125.313 1.445 . . . . 0.0 109.989 174.3 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 72.5 m -77.75 -43.11 31.84 Favored 'General case' 0 C--O 1.221 -0.402 0 N-CA-C 109.411 -0.589 . . . . 0.0 109.411 -176.814 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 16.5 tp -60.71 -37.55 82.07 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 125.105 1.362 . . . . 0.0 112.155 175.143 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.458 ' HA ' HG13 ' A' ' 66' ' ' ILE . 24.3 p -63.11 -20.39 65.32 Favored 'General case' 0 N--CA 1.475 0.797 0 N-CA-C 113.567 0.951 . . . . 0.0 113.567 172.095 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 24.0 mtpp -106.89 -23.36 12.39 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 126.108 1.763 . . . . 0.0 114.474 -176.127 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 65.7 mmtt -66.48 -35.27 79.86 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 125.33 1.452 . . . . 0.0 111.125 170.381 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 14.3 mt -117.65 1.47 12.22 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 126.917 2.087 . . . . 0.0 113.099 -168.621 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 18.6 t30 55.08 61.99 2.7 Favored 'General case' 0 CA--C 1.553 1.066 0 C-N-CA 124.701 1.2 . . . . 0.0 112.296 176.655 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.458 HG13 ' HA ' ' A' ' 61' ' ' SER . 0.6 OUTLIER -137.91 178.08 4.81 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.782 0 C-N-CA 127.304 2.241 . . . . 0.0 111.302 -171.378 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 2.6 p -78.09 157.55 29.47 Favored 'General case' 0 N--CA 1.48 1.045 0 O-C-N 120.98 -1.075 . . . . 0.0 111.447 171.806 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 99.3 t -63.38 -29.67 47.84 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 C-N-CA 123.264 0.626 . . . . 0.0 111.365 173.54 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -78.89 -38.72 36.86 Favored 'General case' 0 N--CA 1.468 0.452 0 O-C-N 120.988 -1.07 . . . . 0.0 110.078 -177.794 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 4.1 tmtm? -66.27 -44.91 82.29 Favored 'General case' 0 C--N 1.339 0.137 0 C-N-CA 124.808 1.243 . . . . 0.0 110.856 176.399 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -59.21 -48.8 80.28 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 124.863 1.265 . . . . 0.0 112.738 171.195 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 36.6 ttmt -69.32 -27.42 65.36 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 124.403 1.081 . . . . 0.0 111.4 -175.225 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -53.01 -43.83 66.82 Favored 'General case' 0 CA--C 1.543 0.705 0 CA-C-N 118.154 0.434 . . . . 0.0 111.459 174.227 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 24.8 m-85 -63.05 -42.0 99.61 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 123.432 0.693 . . . . 0.0 111.458 177.944 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 13.7 mt -66.59 -26.26 37.0 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.651 0 C-N-CA 124.477 1.111 . . . . 0.0 110.996 177.859 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 68.9 mmtt -83.33 -25.63 31.3 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 125.774 1.629 . . . . 0.0 114.711 178.249 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 25.7 p30 -113.5 -41.89 3.56 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-N 120.131 1.332 . . . . 0.0 113.513 -178.521 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 2.3 t -80.41 -7.66 59.21 Favored 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 114.676 1.362 . . . . 0.0 114.676 -173.575 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 17.3 p30 -62.57 -10.01 10.69 Favored 'General case' 0 CA--C 1.549 0.919 0 N-CA-C 115.837 1.791 . . . . 0.0 115.837 -176.683 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 8.1 mpt_? -75.04 -23.87 58.21 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 124.931 1.292 . . . . 0.0 113.68 172.611 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 4.1 mt -84.76 -53.46 5.34 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 113.774 1.027 . . . . 0.0 113.774 -171.672 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -79.97 133.1 11.94 Favored Glycine 0 CA--C 1.535 1.295 0 O-C-N 122.092 -0.38 . . . . 0.0 112.877 -175.996 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 31.9 mmm180 -133.96 -97.11 0.27 Allowed 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 125.386 1.474 . . . . 0.0 112.462 -177.403 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 13.1 t -154.19 55.69 0.71 Allowed 'General case' 0 N--CA 1.481 1.084 0 CA-C-O 123.015 1.388 . . . . 0.0 111.839 -169.658 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 70.6 m-80 -113.86 12.4 18.16 Favored 'General case' 0 CA--C 1.549 0.928 0 N-CA-C 114.453 1.279 . . . . 0.0 114.453 -170.325 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 5.1 t30 -107.31 92.97 4.3 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 125.207 1.403 . . . . 0.0 110.692 178.795 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -139.44 165.49 27.07 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 127.096 2.158 . . . . 0.0 110.109 -175.502 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 58.5 pttt -131.83 13.29 4.84 Favored 'General case' 0 N--CA 1.481 1.116 0 N-CA-C 115.102 1.519 . . . . 0.0 115.102 -166.978 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 7.0 t -129.11 42.5 3.3 Favored 'General case' 0 N--CA 1.481 1.075 0 CA-C-O 123.47 1.605 . . . . 0.0 112.743 -172.759 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.523 HD13 ' H ' ' A' ' 90' ' ' ILE . 0.2 OUTLIER -90.61 2.67 7.27 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 N-CA-C 114.351 1.241 . . . . 0.0 114.351 -167.446 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 68.08 4.78 37.27 Favored Glycine 0 CA--C 1.535 1.307 0 C-N-CA 124.068 0.842 . . . . 0.0 114.188 -171.107 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . 0.275 20.1 mm 53.96 32.18 0.18 Allowed 'Isoleucine or valine' 0 CA--C 1.552 1.024 0 C-N-CA 126.736 2.014 . . . . 0.0 111.63 175.655 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 12.2 tp 51.15 29.84 5.13 Favored 'General case' 0 CA--C 1.554 1.116 0 C-N-CA 126.674 1.989 . . . . 0.0 114.657 -177.113 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -130.76 21.22 5.03 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.914 1.286 . . . . 0.0 114.317 -175.172 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -74.14 151.33 40.09 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 124.136 0.974 . . . . 0.0 112.976 177.851 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -134.01 110.29 9.56 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 125.115 1.366 . . . . 0.0 110.354 174.275 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 48.6 t -141.69 127.24 18.32 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 C-N-CA 125.038 1.335 . . . . 0.0 110.229 178.291 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 9.7 t -98.94 83.38 2.9 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 124.792 1.237 . . . . 0.0 111.355 175.997 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 49.2 m 48.87 73.65 0.22 Allowed 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 126.456 1.902 . . . . 0.0 114.569 173.918 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 20.4 mmt 56.35 56.19 5.96 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 125.244 1.417 . . . . 0.0 112.296 -173.066 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 75.0 tt0 -72.42 96.3 1.88 Allowed 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 125.558 1.543 . . . . 0.0 110.284 174.106 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -139.49 159.47 42.1 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 125.309 1.444 . . . . 0.0 112.382 -174.838 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 14.0 mmmm -124.82 104.18 8.48 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 125.65 1.58 . . . . 0.0 110.826 -177.446 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 25.3 t -151.99 123.95 8.06 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 125.563 1.545 . . . . 0.0 110.129 172.698 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 13.1 ttt -158.75 147.03 18.27 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 125.095 1.358 . . . . 0.0 111.288 -176.528 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 11.1 m -71.32 142.95 50.42 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 123.481 0.712 . . . . 0.0 110.58 168.27 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 25.1 t-105 . . . . . 0 C--O 1.253 1.27 0 C-N-CA 125.284 1.434 . . . . 0.0 113.046 -172.049 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.48 0 N-CA-C 110.842 -0.903 . . . . 0.0 110.842 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 45.8 m -140.79 158.82 43.42 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 125.401 1.48 . . . . 0.0 111.774 -175.287 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 38.3 m80 -127.83 144.32 51.09 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 124.997 1.319 . . . . 0.0 111.531 -179.826 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 78.3 mtp 52.75 36.56 21.51 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 125.447 1.499 . . . . 0.0 114.145 179.464 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -151.62 171.79 17.07 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 113.847 1.054 . . . . 0.0 113.847 -170.341 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 88.6 p -138.1 163.83 30.64 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 126.321 1.848 . . . . 0.0 112.383 -176.241 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 76.6 mtm -130.45 133.43 46.31 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 125.651 1.58 . . . . 0.0 110.535 175.473 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -147.12 136.47 11.64 Favored Pre-proline 0 CA--C 1.552 1.032 0 C-N-CA 124.897 1.279 . . . . 0.0 111.838 -176.596 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -81.49 -7.91 12.66 Favored 'Trans proline' 0 C--N 1.352 0.714 0 C-N-CA 123.388 2.725 . . . . 0.0 115.688 -177.98 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 83.3 mt -102.2 39.21 1.52 Allowed 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.303 1.441 . . . . 0.0 113.276 -173.994 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 12.6 m-20 -101.93 -3.16 28.29 Favored 'General case' 0 N--CA 1.478 0.962 0 N-CA-C 114.705 1.372 . . . . 0.0 114.705 168.335 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.74 -58.61 1.23 Allowed 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 124.297 1.039 . . . . 0.0 113.445 -164.82 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.8 pp -107.33 9.1 9.42 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 C-N-CA 125.495 1.518 . . . . 0.0 112.906 -177.748 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 10.5 tt -52.42 126.44 8.15 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.727 0 C-N-CA 123.825 0.85 . . . . 0.0 112.13 177.151 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -146.93 -1.25 0.68 Allowed 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 124.386 1.075 . . . . 0.0 113.497 -178.279 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -88.63 12.41 14.78 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 114.818 1.414 . . . . 0.0 114.818 -162.297 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 7.1 tp -143.89 21.95 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 125.62 1.568 . . . . 0.0 113.891 -171.337 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 29.4 mtpp -122.97 -38.51 2.6 Favored 'General case' 0 N--CA 1.479 1.005 0 N-CA-C 115.396 1.628 . . . . 0.0 115.396 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 50.6 tptt 47.96 48.68 17.81 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 125.566 1.546 . . . . 0.0 112.479 -175.342 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 27.1 tt0 -114.64 63.59 0.67 Allowed 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 125.311 1.444 . . . . 0.0 111.271 -169.294 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -142.12 165.19 28.12 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.392 1.477 . . . . 0.0 112.732 -178.893 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -122.92 55.82 1.18 Allowed 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 125.796 1.639 . . . . 0.0 110.923 -175.53 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -134.98 143.92 47.1 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 125.493 1.517 . . . . 0.0 111.452 -178.31 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 2.5 t -134.54 32.56 3.32 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.85 1.26 . . . . 0.0 113.051 -179.762 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 74.98 57.87 4.25 Favored Glycine 0 CA--C 1.531 1.032 0 C-N-CA 124.789 1.185 . . . . 0.0 113.985 174.634 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 7.7 p -97.23 2.62 10.26 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.104 0 C-N-CA 126.188 1.795 . . . . 0.0 113.951 -175.023 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -86.61 160.49 18.9 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 125.746 1.618 . . . . 0.0 113.633 -168.863 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 1.3 pt? -114.37 33.64 5.18 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 126.708 2.003 . . . . 0.0 114.509 -174.991 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -128.56 133.31 25.03 Favored Pre-proline 0 CA--C 1.547 0.852 0 C-N-CA 125.702 1.601 . . . . 0.0 111.422 -175.517 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -77.19 -36.92 1.19 Allowed 'Trans proline' 0 CA--C 1.541 0.842 0 C-N-CA 122.254 1.97 . . . . 0.0 113.549 -178.113 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 22.5 tp -154.88 69.19 0.72 Allowed 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.931 1.292 . . . . 0.0 111.123 -179.94 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 50.3 m 55.52 37.59 29.08 Favored 'General case' 0 N--CA 1.48 1.043 0 N-CA-C 114.64 1.348 . . . . 0.0 114.64 175.521 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 7.7 p -153.18 145.28 16.93 Favored Pre-proline 0 N--CA 1.473 0.696 0 C-N-CA 125.931 1.693 . . . . 0.0 110.105 -171.685 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 97.8 Cg_endo -77.37 62.26 7.58 Favored 'Trans proline' 0 CA--C 1.549 1.23 0 C-N-CA 123.511 2.808 . . . . 0.0 112.389 178.095 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 26.2 tptt 59.42 111.19 0.02 OUTLIER Pre-proline 0 N--CA 1.484 1.263 0 C-N-CA 129.397 3.079 . . . . 0.0 113.817 -176.267 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 94.0 Cg_endo -74.54 143.36 30.61 Favored 'Trans proline' 0 CA--C 1.537 0.648 0 C-N-CA 122.61 2.206 . . . . 0.0 111.636 -173.597 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 25.4 pttm -67.55 128.78 37.73 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 123.258 0.623 . . . . 0.0 111.971 -179.408 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 2.6 pp -143.77 152.11 40.83 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 113.868 1.062 . . . . 0.0 113.868 -173.098 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 22.6 mm-40 -141.11 102.04 4.16 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 126.71 2.004 . . . . 0.0 108.815 173.719 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -139.1 78.62 1.68 Allowed 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 124.598 1.159 . . . . 0.0 110.243 -178.256 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 5.2 mt -129.91 155.15 46.51 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 126.989 2.116 . . . . 0.0 110.397 -177.332 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 19.8 t -71.77 166.96 20.93 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 122.759 0.424 . . . . 0.0 110.388 167.271 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -57.0 -45.88 82.71 Favored 'General case' 0 N--CA 1.475 0.796 0 O-C-N 120.571 -1.331 . . . . 0.0 112.589 -175.213 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 10.2 tt0 -72.51 -42.42 64.83 Favored 'General case' 0 N--CA 1.469 0.517 0 O-C-N 121.528 -0.732 . . . . 0.0 111.341 177.416 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 34.7 mm-40 -57.03 -43.11 81.57 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 124.082 0.953 . . . . 0.0 111.109 176.782 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 21.8 ttmm -61.65 -43.0 99.68 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.626 1.17 . . . . 0.0 111.288 177.12 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 49.7 mt -67.37 -40.4 84.65 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 CA-C-O 118.197 -0.906 . . . . 0.0 111.097 177.601 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 35.0 mt -65.46 -44.19 94.33 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.956 0 CA-C-N 120.652 1.569 . . . . 0.0 110.721 177.976 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -56.56 -48.35 77.54 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.27 1.028 . . . . 0.0 110.544 174.589 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -66.97 -51.9 49.42 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.454 1.101 . . . . 0.0 112.926 -179.7 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -59.12 -27.26 65.44 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 119.25 0.932 . . . . 0.0 113.118 179.849 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -70.95 -58.74 3.28 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 123.415 0.686 . . . . 0.0 111.26 176.469 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 55.5 mt -59.24 -34.54 54.12 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.61 0 C-N-CA 126.26 1.824 . . . . 0.0 111.314 176.481 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -70.19 -22.44 62.94 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 124.209 1.003 . . . . 0.0 113.256 176.146 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -96.14 -29.91 13.81 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.591 1.157 . . . . 0.0 113.097 178.907 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 7.8 m -121.96 -19.13 4.57 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.002 0 N-CA-C 114.121 1.156 . . . . 0.0 114.121 -175.487 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 82.36 142.06 4.04 Favored Glycine 0 CA--C 1.532 1.146 0 C-N-CA 124.77 1.176 . . . . 0.0 112.199 -171.171 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -65.76 -12.1 51.19 Favored 'General case' 0 N--CA 1.479 0.99 0 O-C-N 121.059 -1.259 . . . . 0.0 113.898 -171.709 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 35.9 mt-30 -77.68 -16.85 58.22 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 126.257 1.823 . . . . 0.0 112.969 174.94 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 67.0 m-80 -114.37 -6.5 12.92 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 114.642 1.349 . . . . 0.0 114.642 -173.058 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 13.8 pt -74.93 159.63 5.45 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.656 0 C-N-CA 124.09 0.956 . . . . 0.0 111.869 170.097 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.4 p -135.16 145.07 47.43 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 125.248 1.419 . . . . 0.0 110.142 175.284 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -60.47 -30.2 69.53 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 124.044 0.938 . . . . 0.0 112.176 179.041 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -61.95 -42.32 94.31 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.513 0 C-N-CA 125.352 1.461 . . . . 0.0 110.264 175.105 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 86.8 m -88.1 -40.84 13.47 Favored 'General case' 0 C--O 1.223 -0.336 0 C-N-CA 125.152 1.381 . . . . 0.0 109.699 -172.351 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 24.7 tp -60.57 -36.97 79.79 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.915 1.286 . . . . 0.0 111.543 170.994 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.501 ' HA ' HG13 ' A' ' 66' ' ' ILE . 40.8 t -53.99 -34.09 58.85 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 124.865 1.266 . . . . 0.0 113.154 168.927 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -97.52 -27.05 14.6 Favored 'General case' 0 C--N 1.329 -0.326 0 C-N-CA 124.578 1.151 . . . . 0.0 113.743 -174.205 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 19.8 mttp -69.36 -33.4 73.02 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 124.219 1.007 . . . . 0.0 112.448 174.374 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 4.5 mp -108.02 -0.85 21.0 Favored 'General case' 0 CA--C 1.541 0.596 0 N-CA-C 114.385 1.254 . . . . 0.0 114.385 -178.641 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 33.8 m-80 54.92 43.91 29.16 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 125.336 1.455 . . . . 0.0 112.587 -173.58 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.501 HG13 ' HA ' ' A' ' 61' ' ' SER . 9.9 pt -103.16 -171.89 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.674 0 C-N-CA 126.218 1.807 . . . . 0.0 111.246 -178.644 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 43.9 p -85.62 159.44 19.85 Favored 'General case' 0 N--CA 1.471 0.625 0 O-C-N 121.473 -0.767 . . . . 0.0 111.057 165.711 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 58.0 t -60.6 -27.31 40.18 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.978 0 O-C-N 121.407 -0.808 . . . . 0.0 111.398 169.943 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 4.9 tm-20 -80.57 -40.78 25.23 Favored 'General case' 0 CA--C 1.531 0.249 0 O-C-N 120.609 -1.307 . . . . 0.0 110.168 -173.86 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . 0.367 0.0 OUTLIER -86.94 7.79 25.94 Favored 'General case' 0 C--N 1.348 0.502 0 N-CA-C 113.175 0.806 . . . . 0.0 113.175 173.589 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -94.61 -45.12 7.52 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.827 1.251 . . . . 0.0 111.557 158.071 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt -74.47 -27.86 60.77 Favored 'General case' 0 CA--C 1.519 -0.234 0 C-N-CA 124.86 1.264 . . . . 0.0 111.84 -172.927 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 31.2 p-10 -56.21 -37.85 70.21 Favored 'General case' 0 CA--C 1.545 0.765 0 N-CA-C 112.906 0.706 . . . . 0.0 112.906 175.813 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 28.7 m-85 -65.86 -48.97 69.79 Favored 'General case' 0 C--O 1.222 -0.372 0 C-N-CA 126.791 2.036 . . . . 0.0 109.889 176.449 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 76.7 mt -64.2 -38.72 83.23 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 C-N-CA 123.859 0.864 . . . . 0.0 110.374 -179.619 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 28.4 mmtm -63.41 -31.41 72.55 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 125.668 1.587 . . . . 0.0 113.448 177.509 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 8.9 p30 -95.53 -35.76 11.55 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 119.817 1.19 . . . . 0.0 112.463 174.98 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 69.6 m -87.04 -13.04 45.52 Favored 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 116.007 1.854 . . . . 0.0 116.007 -170.57 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 10.5 p30 -57.41 145.46 32.63 Favored 'General case' 0 CA--C 1.549 0.926 0 CA-C-N 119.686 1.13 . . . . 0.0 113.868 -175.282 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 1.9 mpt_? 59.71 -31.69 0.05 Allowed 'General case' 0 N--CA 1.493 1.679 0 C-N-CA 129.091 2.956 . . . . 0.0 115.999 -169.975 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -84.53 -45.8 12.24 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 126.793 2.037 . . . . 0.0 112.236 -172.89 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -80.79 127.26 7.81 Favored Glycine 0 CA--C 1.534 1.259 0 C-N-CA 123.218 0.437 . . . . 0.0 112.787 -178.241 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 91.8 mtt180 -140.23 177.76 7.76 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 125.559 1.544 . . . . 0.0 112.767 -171.586 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 7.3 t -118.77 21.76 12.32 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 126.028 1.731 . . . . 0.0 114.24 -162.345 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 66.4 m-80 -89.72 125.53 35.31 Favored 'General case' 0 CA--C 1.544 0.737 0 O-C-N 120.542 -1.349 . . . . 0.0 112.031 -179.717 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -153.88 65.07 0.72 Allowed 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 125.136 1.374 . . . . 0.0 110.848 -178.267 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 3.6 mp -127.68 162.81 25.67 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.18 1.392 . . . . 0.0 112.19 -173.593 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 8.7 ptmm? -131.19 14.1 5.13 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 126.456 1.902 . . . . 0.0 114.697 -168.81 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 10.7 t -131.42 41.43 3.31 Favored 'General case' 0 N--CA 1.482 1.137 0 CA-C-O 123.461 1.6 . . . . 0.0 112.727 -170.535 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.495 HD13 ' H ' ' A' ' 90' ' ' ILE . 0.2 OUTLIER -90.84 1.6 8.11 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 N-CA-C 114.792 1.404 . . . . 0.0 114.792 -167.735 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 67.2 5.98 37.21 Favored Glycine 0 CA--C 1.538 1.506 0 O-C-N 121.162 -0.961 . . . . 0.0 114.104 -170.891 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . 0.29 3.3 mp 48.92 39.18 0.32 Allowed 'Isoleucine or valine' 0 CA--C 1.548 0.896 0 C-N-CA 127.188 2.195 . . . . 0.0 111.498 179.79 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 10.2 tp 55.22 20.65 3.54 Favored 'General case' 0 CA--C 1.552 1.033 0 C-N-CA 127.569 2.348 . . . . 0.0 115.711 179.606 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 35.2 mt-30 -137.95 51.63 1.88 Allowed 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 125.497 1.519 . . . . 0.0 112.295 -165.868 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -93.23 7.01 46.07 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 125.203 1.401 . . . . 0.0 113.722 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -103.51 53.05 0.76 Allowed 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 125.648 1.579 . . . . 0.0 113.084 -169.19 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 59.5 t -139.1 140.72 37.72 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 C-N-CA 125.502 1.521 . . . . 0.0 110.491 -179.825 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 21.9 t -130.41 -62.8 0.91 Allowed 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 124.461 1.104 . . . . 0.0 113.157 178.185 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 75.0 m -138.7 102.28 4.54 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 124.5 1.12 . . . . 0.0 111.429 -176.764 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 69.4 mtm 51.37 31.06 6.7 Favored 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 125.869 1.668 . . . . 0.0 113.933 -177.457 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -96.69 -2.29 44.84 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.242 1.417 . . . . 0.0 113.244 -168.093 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -75.27 160.12 30.72 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.246 1.419 . . . . 0.0 112.893 178.758 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 44.7 mmtm -104.01 122.39 45.15 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 125.171 1.388 . . . . 0.0 110.431 173.314 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 78.9 p -154.33 164.78 38.06 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 125.699 1.599 . . . . 0.0 111.84 -177.378 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 66.2 mtt -136.39 171.22 14.8 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 125.537 1.535 . . . . 0.0 112.198 -177.202 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 12.8 t -131.16 164.12 26.21 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 125.714 1.606 . . . . 0.0 111.804 175.765 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 25.1 m-90 . . . . . 0 C--O 1.253 1.264 0 C-N-CA 126.222 1.809 . . . . 0.0 112.564 -172.329 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.617 0 N-CA-C 111.451 -0.66 . . . . 0.0 111.451 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 1.9 t -127.36 15.41 7.17 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 124.979 1.312 . . . . 0.0 113.41 -177.282 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 76.3 m80 -95.78 154.06 17.42 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 125.62 1.568 . . . . 0.0 112.48 -177.958 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 28.0 ttt -143.14 118.52 10.27 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 125.276 1.43 . . . . 0.0 110.537 179.072 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -153.76 160.38 42.25 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 124.87 1.268 . . . . 0.0 112.497 178.958 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 58.7 m -141.72 125.78 17.29 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 125.35 1.46 . . . . 0.0 111.415 -174.359 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 62.7 mtt -144.01 138.01 28.08 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 125.912 1.685 . . . . 0.0 110.111 172.825 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -132.91 57.4 27.92 Favored Pre-proline 0 CA--C 1.555 1.169 0 C-N-CA 124.54 1.136 . . . . 0.0 113.432 -174.909 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_endo -78.12 -4.92 14.78 Favored 'Trans proline' 0 C--N 1.353 0.803 0 C-N-CA 123.391 2.727 . . . . 0.0 115.285 -176.105 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -132.77 35.68 3.56 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.839 1.656 . . . . 0.0 114.018 -175.022 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -104.6 -1.21 26.76 Favored 'General case' 0 N--CA 1.478 0.945 0 N-CA-C 114.547 1.314 . . . . 0.0 114.547 176.302 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -130.07 -58.56 1.07 Allowed 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 124.369 1.068 . . . . 0.0 113.515 -164.124 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.8 pp -107.77 10.2 9.17 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.786 0 C-N-CA 125.631 1.572 . . . . 0.0 113.033 -178.07 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 17.7 tt -47.97 125.5 2.32 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 C-N-CA 124.775 1.23 . . . . 0.0 113.18 179.507 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 21.3 t30 -147.43 0.34 0.68 Allowed 'General case' 0 CA--C 1.543 0.693 0 N-CA-C 114.511 1.3 . . . . 0.0 114.511 -179.788 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -85.31 10.85 11.43 Favored 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 115.02 1.489 . . . . 0.0 115.02 -167.792 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 16.0 tt -144.19 34.59 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 C-N-CA 126.543 1.937 . . . . 0.0 112.049 -177.612 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 33.3 ttmt -123.83 -50.08 1.84 Allowed 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 114.522 1.304 . . . . 0.0 114.522 -173.817 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 68.5 tttt 44.21 52.85 6.94 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 126.328 1.851 . . . . 0.0 113.392 -173.589 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 26.4 tt0 -141.98 155.51 45.45 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 124.511 1.125 . . . . 0.0 112.176 -176.828 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -79.48 -174.68 4.36 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 125.069 1.348 . . . . 0.0 113.876 -179.305 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 50.8 p-10 -126.99 169.59 13.17 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 126.331 1.852 . . . . 0.0 113.2 -176.994 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 20.4 m-20 -131.44 39.74 3.49 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 125.587 1.555 . . . . 0.0 112.748 -173.589 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 71.2 p -81.34 29.45 0.36 Allowed 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 115.645 1.72 . . . . 0.0 115.645 -176.692 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -95.17 -97.67 1.71 Allowed Glycine 0 CA--C 1.534 1.251 0 C-N-CA 125.167 1.365 . . . . 0.0 113.259 175.629 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 84.0 t 59.02 117.97 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.943 0 C-N-CA 129.154 2.982 . . . . 0.0 114.369 -173.981 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.468 HG22 ' H ' ' A' ' 22' ' ' LEU . 0.8 OUTLIER 57.12 -157.59 0.28 Allowed 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 125.158 1.383 . . . . 0.0 111.788 178.176 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.468 ' H ' HG22 ' A' ' 21' ' ' THR . 1.0 OUTLIER -123.36 33.11 5.45 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 125.633 1.573 . . . . 0.0 112.655 174.557 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -106.56 139.56 20.47 Favored Pre-proline 0 CA--C 1.548 0.885 0 C-N-CA 126.041 1.737 . . . . 0.0 111.218 -179.645 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -73.74 -34.3 5.59 Favored 'Trans proline' 0 CA--C 1.539 0.752 0 C-N-CA 122.493 2.129 . . . . 0.0 113.272 -178.717 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 15.6 tp -151.03 56.29 0.89 Allowed 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 124.145 0.978 . . . . 0.0 112.418 178.954 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.3 t 56.31 37.48 28.87 Favored 'General case' 0 N--CA 1.479 1.008 0 N-CA-C 114.302 1.223 . . . . 0.0 114.302 178.388 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 8.8 p -154.24 144.24 15.54 Favored Pre-proline 0 N--CA 1.472 0.67 0 C-N-CA 126.281 1.832 . . . . 0.0 109.745 -172.807 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 79.5 Cg_endo -74.25 74.02 3.71 Favored 'Trans proline' 0 CA--C 1.545 1.026 0 C-N-CA 123.306 2.671 . . . . 0.0 112.658 -177.98 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 51.3 tptt 54.65 91.7 0.07 OUTLIER Pre-proline 0 N--CA 1.483 1.224 0 C-N-CA 129.127 2.971 . . . . 0.0 113.542 173.192 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -81.02 154.05 19.35 Favored 'Trans proline' 0 CA--C 1.537 0.67 0 C-N-CA 123.344 2.696 . . . . 0.0 112.694 -167.21 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 36.6 pttt -51.14 132.12 27.9 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 126.365 1.866 . . . . 0.0 112.841 179.463 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 49.5 tp -142.84 141.61 31.63 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 124.908 1.283 . . . . 0.0 112.004 -164.353 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -139.21 113.47 8.86 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 125.152 1.381 . . . . 0.0 109.585 173.938 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -150.64 52.35 0.88 Allowed 'General case' 0 N--CA 1.474 0.773 0 CA-C-O 123.078 1.418 . . . . 0.0 113.606 -176.148 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 5.9 mt -110.68 151.83 27.25 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 126.003 1.721 . . . . 0.0 111.607 -174.444 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 22.7 t -72.16 166.28 22.67 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 123.31 0.644 . . . . 0.0 110.545 167.074 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -55.57 -43.71 76.19 Favored 'General case' 0 N--CA 1.476 0.831 0 O-C-N 120.83 -1.169 . . . . 0.0 112.495 -177.809 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 13.1 tt0 -73.49 -41.76 62.71 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 123.561 0.744 . . . . 0.0 111.315 176.22 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 84.4 mt-30 -63.07 -38.35 90.84 Favored 'General case' 0 N--CA 1.466 0.335 0 O-C-N 121.698 -0.626 . . . . 0.0 111.94 179.58 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 20.9 ttmm -59.3 -42.19 90.74 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 123.975 0.91 . . . . 0.0 110.748 174.171 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 46.2 mt -69.61 -42.12 80.45 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 CA-C-O 118.036 -0.983 . . . . 0.0 111.361 178.129 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 40.4 mt -64.47 -43.84 96.95 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 CA-C-N 120.644 1.565 . . . . 0.0 110.174 177.997 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -57.98 -47.51 82.76 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.886 1.275 . . . . 0.0 110.336 177.281 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -67.22 -52.19 44.14 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.645 1.178 . . . . 0.0 113.429 177.574 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.7 mm-40 -61.18 -26.42 67.7 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-N 119.1 0.864 . . . . 0.0 113.101 -177.947 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.476 ' CE2' HG22 ' A' ' 55' ' ' ILE . 1.6 t80 -71.93 -55.71 6.99 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 123.981 0.912 . . . . 0.0 111.21 175.492 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 55.8 mt -58.5 -35.82 56.31 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.589 0 C-N-CA 125.387 1.475 . . . . 0.0 111.168 174.436 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -68.02 -20.78 65.03 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 124.104 0.962 . . . . 0.0 113.326 177.078 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -96.33 -28.15 14.62 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.812 1.245 . . . . 0.0 113.231 178.437 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 9.2 m -126.36 -21.61 2.16 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 N-CA-C 114.376 1.25 . . . . 0.0 114.376 -174.038 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 88.84 141.69 8.17 Favored Glycine 0 CA--C 1.534 1.242 0 C-N-CA 125.633 1.587 . . . . 0.0 112.788 -172.205 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 62.5 tp -60.74 -16.58 41.45 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 125.497 1.519 . . . . 0.0 114.561 -175.395 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -82.83 -18.68 39.56 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.763 1.625 . . . . 0.0 113.079 177.095 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 63.6 m-20 -114.58 -7.69 12.77 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 114.651 1.352 . . . . 0.0 114.651 -170.066 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.476 HG22 ' CE2' ' A' ' 46' ' ' TYR . 26.6 pt -67.32 158.52 5.41 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.42 0 C-N-CA 123.675 0.79 . . . . 0.0 111.265 167.099 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -126.01 146.22 49.98 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 125.086 1.354 . . . . 0.0 111.444 174.916 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -61.68 -27.46 68.7 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.025 0.93 . . . . 0.0 111.975 172.927 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 29.9 mm -63.85 -52.58 55.09 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.444 0 C-N-CA 124.797 1.239 . . . . 0.0 110.567 174.556 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 54.1 m -75.18 -39.33 60.32 Favored 'General case' 0 C--O 1.223 -0.334 0 C-N-CA 123.264 0.625 . . . . 0.0 110.088 -177.749 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 18.1 tp -63.18 -37.04 85.66 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.437 1.095 . . . . 0.0 111.854 175.402 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.444 ' HA ' HG13 ' A' ' 66' ' ' ILE . 44.1 t -53.87 -32.57 53.64 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.951 1.3 . . . . 0.0 112.25 169.411 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -96.98 -31.89 12.3 Favored 'General case' 0 CA--C 1.534 0.351 0 N-CA-C 113.881 1.067 . . . . 0.0 113.881 -176.015 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 47.6 mmtt -60.17 -39.54 86.79 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 125.703 1.601 . . . . 0.0 111.839 178.407 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.3 mp -114.07 15.7 18.3 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 124.753 1.221 . . . . 0.0 113.631 -177.374 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . 0.278 7.5 p30 46.56 55.5 7.52 Favored 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 126.536 1.934 . . . . 0.0 114.037 -177.706 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.444 HG13 ' HA ' ' A' ' 61' ' ' SER . 1.8 pt -119.4 -165.5 0.37 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.761 0 C-N-CA 127.156 2.182 . . . . 0.0 110.958 -174.249 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 5.7 p -98.64 160.38 14.31 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 124.661 1.184 . . . . 0.0 110.901 171.583 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 71.4 t -62.72 -29.66 47.53 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 C-N-CA 123.085 0.554 . . . . 0.0 110.952 173.68 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 58.4 mp0 -77.28 -39.91 46.41 Favored 'General case' 0 CA--C 1.53 0.195 0 O-C-N 121.017 -1.052 . . . . 0.0 109.928 -178.685 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 10.8 tmtt? -66.92 -44.38 80.83 Favored 'General case' 0 C--N 1.341 0.236 0 C-N-CA 124.952 1.301 . . . . 0.0 110.941 178.866 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -58.98 -50.24 74.84 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 126.064 1.746 . . . . 0.0 113.357 170.204 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 21.2 ttmm -69.01 -25.33 64.44 Favored 'General case' 0 N--CA 1.468 0.46 0 O-C-N 120.839 -1.163 . . . . 0.0 111.327 -177.333 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -59.04 -31.7 69.08 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 123.529 0.731 . . . . 0.0 112.608 174.065 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 58.6 m-85 -69.78 -50.21 45.42 Favored 'General case' 0 C--O 1.221 -0.438 0 C-N-CA 124.527 1.131 . . . . 0.0 110.538 170.199 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 84.5 mt -64.15 -25.24 37.61 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.839 0 C-N-CA 124.201 1.0 . . . . 0.0 111.73 -175.589 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 69.0 mmtt -81.54 -25.36 35.94 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 125.461 1.504 . . . . 0.0 114.408 177.741 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 8.6 p30 -97.63 -47.51 5.6 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 119.994 1.27 . . . . 0.0 111.958 170.136 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 65.6 m -93.66 99.65 12.03 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 124.178 0.991 . . . . 0.0 109.339 -178.763 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 4.9 t-20 -143.4 -61.83 0.41 Allowed 'General case' 0 CA--C 1.537 0.477 0 N-CA-C 113.19 0.811 . . . . 0.0 113.19 -172.799 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 37.3 mmt-85 -95.03 -16.07 22.99 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 125.026 1.33 . . . . 0.0 113.246 176.7 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 7.1 tt -82.69 -35.61 26.62 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 124.883 1.273 . . . . 0.0 112.828 -173.095 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 79.1 -174.2 55.3 Favored Glycine 0 CA--C 1.537 1.412 0 CA-C-N 118.373 0.533 . . . . 0.0 112.751 -168.496 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 11.1 mmm-85 -137.32 126.87 25.15 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 125.136 1.374 . . . . 0.0 109.965 175.71 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . 0.301 7.1 t 45.62 39.25 4.75 Favored 'General case' 0 N--CA 1.485 1.291 0 C-N-CA 126.619 1.968 . . . . 0.0 115.025 175.906 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 20.6 m-80 -139.67 152.25 46.57 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.874 1.669 . . . . 0.0 111.818 -177.954 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 3.2 t30 -139.67 102.4 4.43 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.166 1.387 . . . . 0.0 110.269 172.57 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 9.6 tp -144.2 18.46 1.74 Allowed 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 124.762 1.225 . . . . 0.0 112.898 179.766 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 16.6 ptpt -107.55 -12.54 15.26 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 126.399 1.88 . . . . 0.0 113.39 -176.242 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 15.0 t -152.91 120.84 6.12 Favored 'General case' 0 C--O 1.235 0.325 0 C-N-CA 126.072 1.749 . . . . 0.0 109.257 -176.61 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -140.33 9.04 0.54 Allowed 'Isoleucine or valine' 0 CA--C 1.548 0.888 0 C-N-CA 125.318 1.447 . . . . 0.0 112.774 -177.875 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 75.82 -13.85 6.52 Favored Glycine 0 CA--C 1.535 1.298 0 C-N-CA 124.967 1.27 . . . . 0.0 114.838 -167.423 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 4.9 mp 53.48 95.48 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.595 0 C-N-CA 127.376 2.271 . . . . 0.0 109.855 -161.858 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 24.4 tp -70.17 67.46 0.3 Allowed 'General case' 0 CA--C 1.551 1.001 0 C-N-CA 126.239 1.816 . . . . 0.0 113.531 -170.354 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 36.2 mt-30 -139.62 48.62 1.82 Allowed 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 126.107 1.763 . . . . 0.0 112.029 -176.647 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -119.96 72.9 0.95 Allowed 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 125.056 1.342 . . . . 0.0 111.852 -176.459 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -145.91 115.96 7.39 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.463 1.105 . . . . 0.0 110.888 179.449 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 59.9 t -141.12 132.02 27.47 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 C-N-CA 125.199 1.4 . . . . 0.0 110.55 179.027 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 55.1 m -96.77 -50.39 4.69 Favored 'General case' 0 N--CA 1.48 1.06 0 N-CA-C 113.463 0.912 . . . . 0.0 113.463 179.732 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 35.8 t -159.73 -50.38 0.05 Allowed 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 124.708 1.203 . . . . 0.0 112.332 179.982 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 6.0 tpt -121.09 15.74 11.55 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 125.165 1.386 . . . . 0.0 113.068 -174.3 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -83.31 48.75 1.44 Allowed 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 124.867 1.267 . . . . 0.0 112.4 -174.254 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -142.41 155.02 45.08 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.737 1.615 . . . . 0.0 112.268 -175.813 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 4.7 mmpt? -83.48 133.6 34.89 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 124.542 1.137 . . . . 0.0 111.934 178.911 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 77.7 p -152.26 152.59 32.36 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 126.282 1.833 . . . . 0.0 110.287 169.338 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 11.0 ttt -155.72 -62.94 0.11 Allowed 'General case' 0 N--CA 1.474 0.77 0 CA-C-O 121.491 0.662 . . . . 0.0 112.456 -178.569 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 12.4 t -165.35 -177.62 4.59 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 127.787 2.435 . . . . 0.0 109.195 -174.205 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 7.0 t-105 . . . . . 0 C--O 1.252 1.225 0 C-N-CA 125.823 1.649 . . . . 0.0 112.634 -173.81 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.565 0 N-CA-C 111.153 -0.779 . . . . 0.0 111.153 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 2.2 t -139.45 26.4 2.36 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 124.821 1.248 . . . . 0.0 112.528 -179.046 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 71.3 m80 -138.16 144.3 40.68 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 125.441 1.496 . . . . 0.0 111.947 -170.798 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 58.8 ttp -149.7 136.68 19.58 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 125.1 1.36 . . . . 0.0 110.766 172.6 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -146.68 169.4 19.1 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 124.865 1.266 . . . . 0.0 112.06 179.903 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 23.3 t -136.79 143.7 43.33 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 125.123 1.369 . . . . 0.0 111.152 176.008 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.7 mpt? -132.68 108.69 9.2 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 125.217 1.407 . . . . 0.0 110.068 -175.439 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 44.1 m-20 43.9 63.27 8.42 Favored Pre-proline 0 CA--C 1.555 1.162 0 C-N-CA 126.5 1.92 . . . . 0.0 114.778 176.798 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_endo -72.6 -1.78 10.82 Favored 'Trans proline' 0 C--N 1.351 0.664 0 C-N-CA 123.762 2.975 . . . . 0.0 115.266 -175.714 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 88.7 mt -106.82 38.94 1.96 Allowed 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.902 1.681 . . . . 0.0 112.671 -178.983 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -110.53 1.48 18.19 Favored 'General case' 0 N--CA 1.478 0.959 0 N-CA-C 114.574 1.324 . . . . 0.0 114.574 178.589 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.23 -56.74 1.89 Allowed 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 124.632 1.173 . . . . 0.0 113.269 -165.851 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.0 pp -129.13 13.86 2.66 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.862 0 C-N-CA 126.163 1.785 . . . . 0.0 112.9 -173.523 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 10.7 tt -41.77 126.44 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.02 0 C-N-CA 125.423 1.489 . . . . 0.0 113.402 179.322 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -145.0 16.84 1.57 Allowed 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.816 1.247 . . . . 0.0 112.942 179.981 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -82.95 11.21 6.42 Favored 'General case' 0 CA--C 1.545 0.771 0 N-CA-C 114.534 1.309 . . . . 0.0 114.534 -171.737 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 14.0 tt -141.46 24.38 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 126.473 1.909 . . . . 0.0 113.145 -176.503 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 88.9 tttt -132.1 -44.12 0.95 Allowed 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.285 1.034 . . . . 0.0 113.567 179.043 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 9.1 mtmp? 48.37 -151.29 0.13 Allowed 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 126.039 1.735 . . . . 0.0 112.495 -173.499 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -132.68 166.01 23.17 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 126.296 1.838 . . . . 0.0 111.19 172.66 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -134.53 167.83 20.07 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 125.247 1.419 . . . . 0.0 112.955 -177.956 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 20.2 t30 -143.98 146.88 33.21 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 125.699 1.6 . . . . 0.0 111.636 -178.401 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -145.9 144.34 30.13 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.24 1.416 . . . . 0.0 111.052 174.467 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 25.6 m -112.74 9.18 19.12 Favored 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 115.057 1.503 . . . . 0.0 115.057 -173.287 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 166.8 87.94 0.07 OUTLIER Glycine 0 CA--C 1.531 1.083 0 O-C-N 121.348 -0.845 . . . . 0.0 112.878 173.717 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 7.3 p -82.5 119.15 31.49 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.757 0 C-N-CA 124.064 0.946 . . . . 0.0 111.88 -179.76 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -157.09 171.24 20.81 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 124.307 1.043 . . . . 0.0 112.527 172.722 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 16.9 mt -82.03 31.73 0.38 Allowed 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 127.293 2.237 . . . . 0.0 113.492 -170.229 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -151.53 108.63 2.94 Favored Pre-proline 0 CA--C 1.548 0.888 0 C-N-CA 124.624 1.17 . . . . 0.0 112.145 -161.979 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -83.99 -30.04 0.82 Allowed 'Trans proline' 0 CA--C 1.541 0.865 0 C-N-CA 122.71 2.273 . . . . 0.0 114.03 -176.631 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 22.9 tp -151.9 66.63 0.86 Allowed 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 124.884 1.274 . . . . 0.0 111.35 -174.824 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 49.2 m 56.08 34.93 24.72 Favored 'General case' 0 N--CA 1.478 0.94 0 N-CA-C 114.639 1.348 . . . . 0.0 114.639 176.006 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 9.3 p -155.04 141.98 13.53 Favored Pre-proline 0 N--CA 1.472 0.665 0 C-N-CA 126.278 1.831 . . . . 0.0 109.424 -173.821 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 95.3 Cg_endo -77.58 65.54 8.08 Favored 'Trans proline' 0 CA--C 1.548 1.197 0 C-N-CA 123.568 2.846 . . . . 0.0 112.384 -177.843 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 38.5 tptt 61.27 113.57 0.02 OUTLIER Pre-proline 0 CA--C 1.555 1.136 0 C-N-CA 129.616 3.167 . . . . 0.0 113.523 -172.652 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -77.85 159.24 31.22 Favored 'Trans proline' 0 C--N 1.352 0.717 0 C-N-CA 123.485 2.79 . . . . 0.0 112.542 -174.726 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 5.7 mptt -73.74 141.24 46.34 Favored 'General case' 0 N--CA 1.478 0.932 0 O-C-N 121.63 -0.669 . . . . 0.0 111.991 178.7 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 54.1 tp -148.29 141.24 24.81 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 125.779 1.632 . . . . 0.0 110.709 -175.464 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -137.14 118.41 14.59 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 125.482 1.513 . . . . 0.0 108.854 165.488 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -144.02 74.39 1.42 Allowed 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 124.587 1.155 . . . . 0.0 109.89 -176.157 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.5 mt -134.74 153.94 51.79 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 126.677 1.991 . . . . 0.0 110.497 -171.393 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 19.0 t -72.1 168.33 18.37 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.088 0.555 . . . . 0.0 110.406 167.298 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -58.65 -45.62 88.92 Favored 'General case' 0 N--CA 1.473 0.695 0 O-C-N 120.25 -1.531 . . . . 0.0 112.607 -174.577 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 9.9 tt0 -71.78 -41.87 67.82 Favored 'General case' 0 N--CA 1.47 0.558 0 O-C-N 121.195 -0.941 . . . . 0.0 111.367 177.344 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 30.6 mm-40 -57.04 -45.32 83.27 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 123.959 0.903 . . . . 0.0 110.72 175.873 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt -60.75 -41.56 95.65 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 124.726 1.21 . . . . 0.0 111.3 178.277 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 51.5 mt -67.54 -41.85 86.26 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 CA-C-O 117.937 -1.03 . . . . 0.0 111.447 177.177 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 36.5 mt -63.8 -44.42 98.21 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 CA-C-N 120.832 1.651 . . . . 0.0 110.072 177.969 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -59.42 -49.21 78.69 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.711 1.204 . . . . 0.0 111.024 177.745 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -64.36 -52.18 59.64 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 124.982 1.313 . . . . 0.0 112.456 177.674 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -60.75 -27.44 67.95 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-N 119.362 0.983 . . . . 0.0 113.027 -179.572 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -69.05 -58.34 4.23 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 123.433 0.693 . . . . 0.0 110.784 174.962 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 90.8 mt -63.71 -32.68 57.85 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.471 0 C-N-CA 127.016 2.126 . . . . 0.0 111.641 179.572 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -71.48 -25.54 62.31 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.111 0.965 . . . . 0.0 112.713 175.93 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -90.64 -37.75 13.56 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.188 0.995 . . . . 0.0 112.622 176.233 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.5 m -109.98 -3.41 10.5 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.215 0 N-CA-C 114.371 1.249 . . . . 0.0 114.371 -175.039 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 88.03 10.14 69.6 Favored Glycine 0 N--CA 1.472 1.081 0 C-N-CA 126.096 1.808 . . . . 0.0 116.133 160.974 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 64.36 4.06 2.05 Favored 'General case' 0 CA--C 1.554 1.116 0 C-N-CA 127.756 2.422 . . . . 0.0 114.677 -164.53 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -85.98 -26.12 25.64 Favored 'General case' 0 N--CA 1.48 1.028 0 O-C-N 120.626 -1.296 . . . . 0.0 113.304 179.631 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 45.6 m-80 -122.63 2.95 9.58 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 113.976 1.102 . . . . 0.0 113.976 -164.85 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 20.5 pt -75.05 155.65 6.26 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.551 0 C-N-CA 123.024 0.53 . . . . 0.0 111.352 174.685 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -139.03 142.18 38.26 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 124.765 1.226 . . . . 0.0 109.304 177.486 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -61.11 -26.51 67.72 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 119.088 0.858 . . . . 0.0 112.439 -179.166 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.9 mp -64.76 -50.88 73.33 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.472 0 C-N-CA 125.555 1.542 . . . . 0.0 109.831 173.778 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 81.1 m -76.3 -41.02 50.0 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 123.849 0.86 . . . . 0.0 110.764 -176.566 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 16.3 tp -61.85 -38.46 88.29 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 125.619 1.568 . . . . 0.0 111.766 174.189 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.466 ' HA ' HG13 ' A' ' 66' ' ' ILE . 39.8 t -56.95 -28.72 62.47 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 124.921 1.288 . . . . 0.0 112.794 170.298 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -100.56 -29.07 12.55 Favored 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 124.789 1.236 . . . . 0.0 114.25 -176.196 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 9.1 mmtm -63.28 -33.61 75.89 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 125.197 1.399 . . . . 0.0 111.715 175.102 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.4 mp -114.43 4.12 15.2 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 125.472 1.509 . . . . 0.0 114.039 -176.584 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 49.2 m-80 53.51 56.66 7.02 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 126.01 1.724 . . . . 0.0 113.366 -179.232 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.466 HG13 ' HA ' ' A' ' 61' ' ' SER . 1.2 pt -125.2 -166.67 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.764 0 C-N-CA 126.885 2.074 . . . . 0.0 110.974 -171.829 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 62.2 p -94.15 155.66 16.96 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 124.514 1.126 . . . . 0.0 111.251 169.915 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 60.6 t -63.93 -24.77 36.58 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 O-C-N 121.628 -0.67 . . . . 0.0 111.086 171.865 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 15.6 mp0 -79.72 -30.33 40.93 Favored 'General case' 0 C--O 1.233 0.209 0 C-N-CA 125.148 1.379 . . . . 0.0 111.124 -174.695 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.16 -32.81 16.48 Favored 'General case' 0 C--N 1.344 0.368 0 CA-C-N 118.156 0.435 . . . . 0.0 111.738 173.978 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -62.14 -46.77 87.5 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 124.239 1.015 . . . . 0.0 111.9 173.149 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 19.9 ptmt -69.0 -24.77 64.26 Favored 'General case' 0 N--CA 1.468 0.449 0 O-C-N 121.296 -0.877 . . . . 0.0 112.121 -176.766 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -60.93 -39.76 90.67 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 120.342 -0.543 . . . . 0.0 110.445 179.247 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 26.4 m-85 -61.48 -38.88 88.88 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 124.609 1.164 . . . . 0.0 112.301 179.752 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 7.3 mt -73.4 -18.11 17.83 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.847 0 C-N-CA 125.852 1.661 . . . . 0.0 111.941 -178.951 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 61.8 tttt -103.52 -33.93 8.86 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 125.678 1.591 . . . . 0.0 110.776 -177.599 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 81.6 m-20 -75.41 -42.98 52.33 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 126.72 2.008 . . . . 0.0 109.838 175.799 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 12.4 t -122.15 129.08 51.99 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 112.789 0.662 . . . . 0.0 112.789 171.476 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 13.0 p30 -149.81 -58.43 0.2 Allowed 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 114.303 1.223 . . . . 0.0 114.303 179.111 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 1.1 mpp_? -85.12 -17.91 35.84 Favored 'General case' 0 N--CA 1.481 1.076 0 N-CA-C 113.615 0.968 . . . . 0.0 113.615 177.731 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 60.0 tp -75.93 -44.43 40.23 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 124.523 1.129 . . . . 0.0 112.738 178.111 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -83.95 113.33 3.71 Favored Glycine 0 CA--C 1.531 1.044 0 N-CA-C 111.124 -0.79 . . . . 0.0 111.124 177.991 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 21.8 mmm-85 -140.47 175.18 9.81 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 125.07 1.348 . . . . 0.0 112.486 -172.492 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 12.6 t -121.34 -5.39 9.37 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 126.427 1.891 . . . . 0.0 114.411 -171.66 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 79.3 m-20 -87.5 159.26 18.71 Favored 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 114.364 1.246 . . . . 0.0 114.364 -167.297 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 42.1 t-20 -132.34 -179.69 5.59 Favored 'General case' 0 CA--C 1.551 1.0 0 C-N-CA 126.853 2.061 . . . . 0.0 110.54 178.441 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 72.8 mt 58.47 32.41 22.08 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 125.995 1.718 . . . . 0.0 113.543 -177.845 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 17.5 ptmt -120.53 5.55 10.61 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 126.424 1.89 . . . . 0.0 114.003 -179.109 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 12.4 t -146.02 120.03 9.4 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 124.722 1.209 . . . . 0.0 110.036 171.868 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -141.5 4.63 0.46 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.784 0 C-N-CA 125.778 1.631 . . . . 0.0 113.19 -177.521 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 69.23 6.69 54.81 Favored Glycine 0 CA--C 1.539 1.566 0 O-C-N 120.693 -1.254 . . . . 0.0 114.762 -169.728 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . 0.281 4.1 mp 54.61 29.16 0.14 Allowed 'Isoleucine or valine' 0 CA--C 1.552 1.046 0 C-N-CA 126.883 2.073 . . . . 0.0 112.033 177.323 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 11.2 tp 54.72 24.0 5.24 Favored 'General case' 0 CA--C 1.553 1.071 0 C-N-CA 126.088 1.755 . . . . 0.0 114.391 -174.691 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 42.0 mt-30 -107.2 53.02 0.7 Allowed 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 126.41 1.884 . . . . 0.0 111.786 -176.605 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -79.69 147.17 32.06 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 124.604 1.162 . . . . 0.0 111.872 173.644 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -145.87 139.86 26.61 Favored 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 125.323 1.449 . . . . 0.0 111.355 175.068 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 95.9 t -138.15 135.13 44.85 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 C-N-CA 126.133 1.773 . . . . 0.0 110.306 179.453 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 19.2 t -154.73 -42.96 0.09 Allowed 'General case' 0 N--CA 1.47 0.529 0 N-CA-C 113.841 1.052 . . . . 0.0 113.841 177.513 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 23.1 p -151.3 117.29 5.54 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-O 122.181 0.991 . . . . 0.0 113.418 -176.187 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 57.9 mtt 54.74 40.97 32.22 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 126.061 1.745 . . . . 0.0 112.983 173.713 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -84.0 3.42 34.45 Favored 'General case' 0 CA--C 1.547 0.828 0 N-CA-C 115.298 1.592 . . . . 0.0 115.298 -163.162 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -133.47 155.37 49.66 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 125.587 1.555 . . . . 0.0 113.167 -174.562 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 33.5 mmtp -127.56 23.36 6.31 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 126.451 1.9 . . . . 0.0 113.515 -176.898 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 21.4 t -125.71 134.96 51.62 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 124.876 1.27 . . . . 0.0 112.282 -177.403 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 87.4 mtp -145.57 169.39 18.5 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 126.872 2.069 . . . . 0.0 111.115 177.448 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 12.1 t -134.05 162.17 32.82 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 125.162 1.385 . . . . 0.0 112.512 177.871 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 13.5 m-90 . . . . . 0 C--O 1.253 1.242 0 C-N-CA 126.808 2.043 . . . . 0.0 112.021 -177.0 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.578 0 N-CA-C 111.163 -0.775 . . . . 0.0 111.163 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 78.9 p -140.86 158.05 44.5 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 125.311 1.444 . . . . 0.0 112.384 179.355 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 34.4 t-80 -150.4 157.25 42.83 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 125.259 1.424 . . . . 0.0 111.027 -179.461 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 63.1 ttp -145.15 134.77 23.34 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 124.821 1.248 . . . . 0.0 111.413 179.585 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . 51.61 -156.93 0.13 Allowed 'General case' 0 CA--C 1.552 1.049 0 C-N-CA 125.907 1.683 . . . . 0.0 113.567 -177.03 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 5.3 t -152.27 151.05 30.44 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 124.398 1.079 . . . . 0.0 111.545 173.491 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 58.5 ttm -152.24 128.88 10.78 Favored 'General case' 0 CA--C 1.537 0.481 0 C-N-CA 124.668 1.187 . . . . 0.0 110.66 174.089 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 25.4 m-20 -127.16 97.62 31.57 Favored Pre-proline 0 CA--C 1.547 0.839 0 C-N-CA 124.922 1.289 . . . . 0.0 111.008 176.217 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 64.8 Cg_endo -83.03 6.87 5.54 Favored 'Trans proline' 0 CA--C 1.539 0.756 0 C-N-CA 123.79 2.993 . . . . 0.0 114.219 179.325 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 92.2 mt -115.55 29.72 7.82 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 125.368 1.467 . . . . 0.0 113.716 -172.734 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -98.02 -1.1 43.36 Favored 'General case' 0 N--CA 1.479 1.024 0 N-CA-C 114.087 1.144 . . . . 0.0 114.087 170.897 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 13.7 ptmt -103.86 -35.38 8.19 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 125.78 1.632 . . . . 0.0 114.78 -171.004 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.3 pp -144.44 -42.12 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.008 0 C-N-CA 125.845 1.658 . . . . 0.0 113.643 -174.324 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . 0.31 10.6 tt 38.27 35.29 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.437 0 N-CA-C 116.283 1.957 . . . . 0.0 116.283 -177.52 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 3.2 t30 55.91 29.07 13.52 Favored 'General case' 0 CA--C 1.552 1.023 0 C-N-CA 125.688 1.595 . . . . 0.0 114.279 -177.744 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 3.2 p-10 -81.2 9.61 6.65 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 116.781 2.141 . . . . 0.0 116.781 -166.11 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 7.1 tp -141.76 18.86 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.835 0 C-N-CA 125.779 1.632 . . . . 0.0 113.733 -175.704 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 13.9 tmtt? -129.34 -30.85 2.11 Favored 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 115.15 1.537 . . . . 0.0 115.15 -175.753 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 22.8 ttmm -133.81 102.73 5.56 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 126.01 1.724 . . . . 0.0 111.017 175.825 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 22.9 tt0 -148.07 25.8 1.01 Allowed 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 124.634 1.173 . . . . 0.0 112.885 179.273 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -88.19 93.71 9.59 Favored 'General case' 0 C--O 1.237 0.41 0 O-C-N 120.161 -1.587 . . . . 0.0 111.903 -177.372 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 53.0 t30 -154.37 130.0 9.96 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 123.356 0.662 . . . . 0.0 111.203 178.357 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 8.8 t0 -137.48 131.75 32.31 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.075 1.35 . . . . 0.0 111.326 177.463 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 40.5 m -121.46 27.83 8.07 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 125.535 1.534 . . . . 0.0 113.165 -179.177 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 88.11 57.86 1.85 Allowed Glycine 0 CA--C 1.528 0.872 0 C-N-CA 124.866 1.222 . . . . 0.0 113.028 178.094 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 14.5 p -116.33 8.89 7.3 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.955 0 C-N-CA 126.429 1.892 . . . . 0.0 112.996 -175.79 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -86.55 167.62 14.43 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 125.782 1.633 . . . . 0.0 113.969 -175.269 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 9.8 mt -87.19 39.51 0.87 Allowed 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 127.53 2.332 . . . . 0.0 111.962 -174.024 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -151.48 155.12 34.19 Favored Pre-proline 0 CA--C 1.549 0.923 0 C-N-CA 124.514 1.126 . . . . 0.0 112.882 -159.881 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -73.83 -26.89 12.93 Favored 'Trans proline' 0 CA--C 1.542 0.904 0 C-N-CA 122.991 2.461 . . . . 0.0 113.588 -178.304 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.483 ' HG ' ' H ' ' A' ' 26' ' ' SER . 6.0 tp -149.8 -163.21 1.72 Allowed 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 125.76 1.624 . . . . 0.0 109.818 174.479 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.483 ' H ' ' HG ' ' A' ' 25' ' ' LEU . 36.2 p -73.8 43.16 0.15 Allowed 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 127.933 2.493 . . . . 0.0 113.896 177.096 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 10.6 p -150.81 142.2 15.27 Favored Pre-proline 0 N--CA 1.47 0.557 0 C-N-CA 126.166 1.786 . . . . 0.0 110.605 -168.612 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_endo -76.82 73.81 5.18 Favored 'Trans proline' 0 CA--C 1.54 0.79 0 C-N-CA 122.796 2.33 . . . . 0.0 111.504 174.386 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 35.83 87.86 0.1 Allowed Pre-proline 0 CA--C 1.549 0.935 0 C-N-CA 128.617 2.767 . . . . 0.0 115.642 171.039 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 64.4 Cg_endo -61.23 156.99 42.28 Favored 'Trans proline' 0 CA--C 1.538 0.682 0 C-N-CA 121.958 1.772 . . . . 0.0 111.717 173.3 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 62.1 mttp -62.56 120.25 10.78 Favored 'General case' 0 N--CA 1.475 0.794 0 O-C-N 121.851 -0.531 . . . . 0.0 111.877 -173.681 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.5 pp -145.71 139.42 26.52 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 126.041 1.736 . . . . 0.0 111.886 -174.149 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 37.3 mm-40 -146.0 64.13 1.23 Allowed 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 125.759 1.624 . . . . 0.0 110.953 -177.317 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -96.22 93.97 7.22 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.322 1.049 . . . . 0.0 111.824 -176.012 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 34.5 mt -132.14 156.8 45.73 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 126.454 1.902 . . . . 0.0 111.147 -178.806 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 29.7 t -69.68 163.28 25.97 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 123.138 0.575 . . . . 0.0 110.735 168.459 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 7.1 tm-20 -53.86 -42.78 68.92 Favored 'General case' 0 N--CA 1.474 0.741 0 O-C-N 120.874 -1.141 . . . . 0.0 112.82 -179.268 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 7.9 pt20 -78.23 -34.62 49.11 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 112.359 0.503 . . . . 0.0 112.359 175.958 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 91.0 mt-30 -68.12 -37.17 80.83 Favored 'General case' 0 CA--C 1.535 0.37 0 O-C-N 121.501 -0.75 . . . . 0.0 111.578 179.517 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 40.1 ttmt -59.3 -39.52 83.28 Favored 'General case' 0 N--CA 1.47 0.568 0 O-C-N 121.272 -0.893 . . . . 0.0 111.209 172.961 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 45.2 mt -72.77 -40.64 61.33 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 CA-C-O 118.262 -0.875 . . . . 0.0 111.296 176.841 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 39.2 mt -64.4 -42.06 94.18 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 CA-C-N 120.644 1.565 . . . . 0.0 110.526 177.8 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -56.38 -52.74 63.5 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 124.336 1.054 . . . . 0.0 109.952 173.903 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -64.64 -50.68 66.13 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 123.687 0.795 . . . . 0.0 113.003 -178.816 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 18.7 mm-40 -62.35 -22.07 65.81 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 113.525 0.935 . . . . 0.0 113.525 -178.423 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.415 ' CE1' HG22 ' A' ' 55' ' ' ILE . 1.7 t80 -71.55 -60.68 2.1 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 119.038 0.836 . . . . 0.0 110.742 173.376 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 16.2 mt -63.42 -32.45 56.63 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.496 0 C-N-CA 125.939 1.695 . . . . 0.0 111.688 179.847 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -70.26 -21.56 62.96 Favored 'General case' 0 CA--C 1.545 0.754 0 O-C-N 121.255 -0.903 . . . . 0.0 113.066 175.655 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -94.19 -34.77 12.78 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.358 1.063 . . . . 0.0 112.654 177.751 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 11.7 m -116.7 -18.77 6.79 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.066 0 N-CA-C 114.121 1.156 . . . . 0.0 114.121 -174.411 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 80.62 141.05 2.74 Favored Glycine 0 CA--C 1.53 1.001 0 C-N-CA 124.58 1.086 . . . . 0.0 111.649 -171.501 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.0 tt -64.05 -19.02 64.92 Favored 'General case' 0 N--CA 1.473 0.725 0 O-C-N 121.154 -1.203 . . . . 0.0 114.015 -169.029 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 36.8 mt-30 -66.18 -17.1 64.52 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 126.1 1.76 . . . . 0.0 113.324 174.9 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 69.3 m-80 -112.86 -5.93 13.83 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 114.703 1.372 . . . . 0.0 114.703 -174.145 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.415 HG22 ' CE1' ' A' ' 46' ' ' TYR . 3.7 pt -79.72 162.8 3.72 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 C-N-CA 123.55 0.74 . . . . 0.0 112.48 173.117 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -130.83 147.06 52.44 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 124.931 1.292 . . . . 0.0 109.974 171.895 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -63.76 -25.04 68.01 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 121.429 -0.794 . . . . 0.0 112.029 174.387 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -66.42 -46.98 85.36 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.481 0 C-N-CA 125.455 1.502 . . . . 0.0 109.667 173.423 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 89.7 m -74.22 -43.53 56.75 Favored 'General case' 0 C--O 1.224 -0.27 0 C-N-CA 123.344 0.658 . . . . 0.0 110.151 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 18.7 tp -61.96 -36.04 80.24 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 124.491 1.117 . . . . 0.0 111.864 176.046 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.49 ' HA ' HG13 ' A' ' 66' ' ' ILE . 44.9 t -53.01 -33.25 50.84 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.621 1.168 . . . . 0.0 113.146 168.292 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -100.47 -22.65 14.95 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 125.087 1.355 . . . . 0.0 114.518 -175.584 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 63.9 mmtt -65.19 -38.25 89.91 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 124.709 1.204 . . . . 0.0 111.153 173.967 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.4 mp -111.62 -0.16 16.19 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 125.073 1.349 . . . . 0.0 114.335 -173.028 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 16.0 m-80 56.89 45.41 21.47 Favored 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 125.743 1.617 . . . . 0.0 112.615 -172.875 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.49 HG13 ' HA ' ' A' ' 61' ' ' SER . 10.5 pt -104.46 -166.83 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 C-N-CA 125.821 1.648 . . . . 0.0 111.227 -179.47 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 44.5 p -94.74 161.19 14.28 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 123.998 0.919 . . . . 0.0 110.889 166.767 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 82.5 t -61.85 -28.28 43.95 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 O-C-N 121.341 -0.849 . . . . 0.0 111.054 170.995 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -77.31 -40.21 45.11 Favored 'General case' 0 C--O 1.233 0.214 0 O-C-N 120.68 -1.262 . . . . 0.0 110.453 -175.913 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . 0.366 0.0 OUTLIER -91.59 8.37 37.0 Favored 'General case' 0 C--N 1.348 0.508 0 N-CA-C 113.722 1.008 . . . . 0.0 113.722 175.917 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -95.52 -44.37 7.55 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.467 1.507 . . . . 0.0 111.635 159.799 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 23.9 ttmm -74.15 -29.62 61.88 Favored 'General case' 0 CA--C 1.517 -0.29 0 C-N-CA 124.896 1.278 . . . . 0.0 111.465 -174.475 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 51.9 p-10 -55.53 -42.67 74.88 Favored 'General case' 0 CA--C 1.544 0.735 0 CA-C-O 118.631 -0.7 . . . . 0.0 111.905 176.649 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 20.9 m-85 -59.08 -44.01 91.86 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 125.718 1.607 . . . . 0.0 112.376 175.811 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 69.2 mt -68.44 -25.11 30.42 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.795 0 C-N-CA 124.984 1.314 . . . . 0.0 110.041 179.647 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 73.4 mmtt -93.56 -25.32 17.61 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 115.888 1.81 . . . . 0.0 115.888 -179.846 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 8.4 p30 -103.14 -38.69 7.18 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 120.682 1.583 . . . . 0.0 113.103 175.949 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 22.4 t -104.6 -62.08 1.38 Allowed 'General case' 0 CA--C 1.519 -0.247 0 CA-C-O 119.361 -0.352 . . . . 0.0 111.585 -167.426 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . 0.274 8.6 p30 43.72 31.31 0.45 Allowed 'General case' 0 CA--C 1.551 1.003 0 N-CA-C 116.318 1.97 . . . . 0.0 116.318 -178.18 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 53.68 14.63 0.64 Allowed 'General case' 0 N--CA 1.49 1.562 0 C-N-CA 125.171 1.389 . . . . 0.0 112.874 -170.905 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . 0.279 0.5 OUTLIER 44.22 33.83 0.9 Allowed 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 129.638 3.175 . . . . 0.0 113.601 -166.096 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -73.89 114.61 4.64 Favored Glycine 0 CA--C 1.535 1.282 0 O-C-N 120.799 -1.188 . . . . 0.0 111.759 176.943 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 94.3 mtt-85 -135.21 162.56 32.18 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 125.736 1.614 . . . . 0.0 112.419 -175.013 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 7.6 t -80.72 -17.17 51.91 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 125.334 1.454 . . . . 0.0 114.824 -174.165 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 68.5 m-80 -73.3 129.06 37.21 Favored 'General case' 0 CA--C 1.543 0.691 0 O-C-N 121.032 -1.042 . . . . 0.0 113.139 -172.369 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 8.9 t30 -151.26 120.53 6.8 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.125 1.77 . . . . 0.0 109.509 174.022 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 7.0 tp -156.26 172.3 18.7 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.462 1.505 . . . . 0.0 110.421 -178.049 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 19.1 ptpt -121.6 14.16 10.97 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 126.377 1.871 . . . . 0.0 113.338 -173.6 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 13.3 t -153.12 130.41 11.27 Favored 'General case' 0 C--O 1.233 0.191 0 C-N-CA 125.531 1.532 . . . . 0.0 109.769 173.744 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -146.94 11.57 0.15 Allowed 'Isoleucine or valine' 0 CA--C 1.549 0.92 0 C-N-CA 125.481 1.513 . . . . 0.0 113.683 -171.98 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 80.74 -6.75 60.81 Favored Glycine 0 N--CA 1.476 1.329 0 O-C-N 120.584 -1.322 . . . . 0.0 114.854 -170.221 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 4.8 mp 55.88 85.75 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 C-N-CA 126.756 2.023 . . . . 0.0 109.751 -168.759 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 88.7 mt -63.6 92.38 0.07 Allowed 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 126.186 1.794 . . . . 0.0 112.196 -168.151 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 8.4 pt20 -108.11 2.67 23.15 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 125.496 1.519 . . . . 0.0 114.558 -174.121 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 26.1 tt0 -86.49 144.9 27.03 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 124.724 1.21 . . . . 0.0 113.027 -171.645 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -106.54 98.06 7.78 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 125.071 1.349 . . . . 0.0 111.751 -174.275 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 8.7 m -135.0 31.81 0.79 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.649 0 C-N-CA 125.939 1.696 . . . . 0.0 113.365 -170.995 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 72.2 m -131.4 -62.19 0.89 Allowed 'General case' 0 N--CA 1.475 0.824 0 N-CA-C 113.524 0.935 . . . . 0.0 113.524 -163.07 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 55.7 p -78.87 -23.74 44.7 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 124.043 0.937 . . . . 0.0 112.963 175.27 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 77.1 mtm -134.69 140.49 46.02 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 126.817 2.047 . . . . 0.0 109.162 169.28 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 6.1 tt0 -145.46 24.31 1.41 Allowed 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 123.865 0.866 . . . . 0.0 112.642 -179.387 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -65.22 127.29 31.11 Favored 'General case' 0 CA--C 1.542 0.65 0 O-C-N 120.701 -1.25 . . . . 0.0 112.55 -173.941 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 47.5 mtmt -138.63 146.2 41.41 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 126.491 1.916 . . . . 0.0 110.778 -177.701 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 78.0 p -138.12 161.96 35.45 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 125.784 1.634 . . . . 0.0 112.985 -178.043 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 98.6 mtp -103.22 160.28 14.81 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 125.382 1.473 . . . . 0.0 112.556 178.234 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 14.5 t -147.47 155.73 42.18 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 125.018 1.327 . . . . 0.0 112.217 178.787 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 22.8 m-90 . . . . . 0 C--O 1.254 1.29 0 C-N-CA 126.561 1.945 . . . . 0.0 111.92 -176.907 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.513 0 N-CA-C 111.711 -0.555 . . . . 0.0 111.711 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 51.0 m -118.51 157.18 27.77 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 125.455 1.502 . . . . 0.0 112.158 -178.58 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 38.0 t-80 -142.09 153.85 44.48 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 125.129 1.372 . . . . 0.0 111.707 179.205 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 28.1 ttt -143.31 99.77 3.5 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.803 1.241 . . . . 0.0 110.993 -177.536 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -156.08 163.2 39.95 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 125.29 1.436 . . . . 0.0 112.042 172.818 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 80.4 p -145.13 120.67 10.39 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.78 1.232 . . . . 0.0 111.486 -176.466 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.4 ttp -152.34 13.4 0.57 Allowed 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 124.196 0.999 . . . . 0.0 113.646 -172.394 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 20.6 m-20 -133.45 79.03 61.36 Favored Pre-proline 0 CA--C 1.549 0.916 0 C-N-CA 124.744 1.217 . . . . 0.0 112.227 -169.472 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo -80.95 -3.08 12.14 Favored 'Trans proline' 0 C--N 1.351 0.682 0 C-N-CA 123.88 3.053 . . . . 0.0 115.081 -177.74 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 97.7 mt -112.84 44.46 1.49 Allowed 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 125.938 1.695 . . . . 0.0 112.256 -175.312 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -116.28 1.75 13.14 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 125.08 1.352 . . . . 0.0 114.506 177.831 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.74 -56.0 2.23 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 124.627 1.171 . . . . 0.0 112.899 -167.458 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.0 pp -130.93 14.09 1.99 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 126.236 1.815 . . . . 0.0 112.82 -174.657 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 8.6 tt -43.82 123.46 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 C-N-CA 124.921 1.288 . . . . 0.0 112.537 178.693 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -146.69 10.15 1.05 Allowed 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 124.399 1.08 . . . . 0.0 113.401 179.82 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -81.41 6.39 14.66 Favored 'General case' 0 CA--C 1.546 0.794 0 N-CA-C 114.939 1.459 . . . . 0.0 114.939 -167.626 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 7.0 tp -146.1 23.05 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 C-N-CA 125.916 1.686 . . . . 0.0 113.609 -173.825 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 40.7 ttmt -124.24 -44.94 1.99 Allowed 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 114.081 1.141 . . . . 0.0 114.081 178.802 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 77.2 tttt -159.26 139.21 11.86 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 125.042 1.337 . . . . 0.0 111.618 -176.056 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -154.39 150.38 27.85 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 125.219 1.408 . . . . 0.0 111.292 -179.382 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -141.88 157.69 44.69 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.039 1.336 . . . . 0.0 112.051 171.94 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -104.45 62.26 0.72 Allowed 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 125.411 1.484 . . . . 0.0 111.725 -172.913 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 24.0 m-20 -109.86 108.47 18.79 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 124.773 1.229 . . . . 0.0 111.064 177.874 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 67.0 m -138.16 104.04 5.1 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 125.368 1.467 . . . . 0.0 110.575 -179.308 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 138.79 -25.75 2.8 Favored Glycine 0 N--CA 1.474 1.217 0 C-N-CA 125.273 1.416 . . . . 0.0 114.416 174.464 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 8.6 p -141.77 121.02 10.36 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 C-N-CA 125.494 1.518 . . . . 0.0 110.394 171.995 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -159.68 161.62 34.94 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 123.793 0.837 . . . . 0.0 113.146 -179.602 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -86.29 29.47 0.76 Allowed 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.962 1.705 . . . . 0.0 115.249 -175.902 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -144.34 125.41 7.82 Favored Pre-proline 0 CA--C 1.548 0.869 0 C-N-CA 125.653 1.581 . . . . 0.0 110.811 -175.878 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 91.6 Cg_endo -80.82 -33.78 0.78 Allowed 'Trans proline' 0 CA--C 1.54 0.821 0 C-N-CA 122.239 1.959 . . . . 0.0 113.93 -173.767 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 30.6 tp -152.91 61.28 0.79 Allowed 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 125.228 1.411 . . . . 0.0 109.8 -179.406 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 5.3 t 59.0 -177.18 0.09 Allowed 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.57 1.148 . . . . 0.0 113.09 -163.588 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 55.5 t 63.93 149.33 0.11 Allowed Pre-proline 0 N--CA 1.482 1.142 0 C-N-CA 127.907 2.483 . . . . 0.0 113.416 -178.317 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -69.88 67.61 1.8 Allowed 'Trans proline' 0 CA--C 1.55 1.286 0 C-N-CA 123.872 3.048 . . . . 0.0 111.935 170.151 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 20.7 tptp 50.17 103.31 0.03 OUTLIER Pre-proline 0 CA--C 1.549 0.941 0 C-N-CA 130.193 3.397 . . . . 0.0 114.259 -169.838 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -70.11 156.63 61.96 Favored 'Trans proline' 0 C--N 1.351 0.679 0 C-N-CA 122.333 2.022 . . . . 0.0 112.053 173.973 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.53 144.81 55.45 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.207 1.003 . . . . 0.0 112.238 176.684 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 48.4 tp -151.2 131.68 13.81 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.026 1.33 . . . . 0.0 110.332 -175.27 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -138.55 83.86 1.99 Allowed 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.317 1.447 . . . . 0.0 110.17 178.583 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -133.0 92.1 2.98 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.777 1.231 . . . . 0.0 110.729 -177.992 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.8 mt -133.52 154.44 50.83 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 127.159 2.184 . . . . 0.0 110.055 178.798 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 30.1 t -68.81 163.55 23.93 Favored 'General case' 0 N--CA 1.477 0.911 0 O-C-N 121.81 -0.557 . . . . 0.0 110.636 166.882 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -57.93 -42.0 83.91 Favored 'General case' 0 N--CA 1.477 0.884 0 O-C-N 120.335 -1.478 . . . . 0.0 112.875 -176.595 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 6.9 pt20 -74.96 -35.79 62.09 Favored 'General case' 0 N--CA 1.47 0.544 0 O-C-N 121.71 -0.619 . . . . 0.0 112.323 173.9 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 93.4 mt-30 -66.07 -38.22 87.77 Favored 'General case' 0 CA--C 1.532 0.276 0 O-C-N 121.563 -0.711 . . . . 0.0 111.261 178.823 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 40.7 ttmt -58.83 -41.13 86.15 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 124.228 1.011 . . . . 0.0 111.066 174.941 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 39.4 mt -71.65 -42.44 71.32 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 CA-C-O 118.441 -0.79 . . . . 0.0 110.993 178.106 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 40.1 mt -63.65 -43.04 97.99 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.988 0 CA-C-N 120.282 1.401 . . . . 0.0 110.19 177.851 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -57.4 -51.39 69.6 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 125.043 1.337 . . . . 0.0 110.129 176.097 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -65.14 -46.66 80.03 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.367 1.067 . . . . 0.0 113.508 179.685 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 17.7 mm-40 -67.35 -25.22 65.88 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 123.931 0.892 . . . . 0.0 112.96 179.8 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.435 ' CE1' HG22 ' A' ' 55' ' ' ILE . 1.9 t80 -72.35 -51.51 20.28 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 118.811 0.732 . . . . 0.0 110.589 175.642 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 42.6 mt -61.51 -32.51 53.67 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.596 0 C-N-CA 124.789 1.236 . . . . 0.0 111.229 173.591 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -66.3 -24.08 66.49 Favored 'General case' 0 CA--C 1.546 0.802 0 O-C-N 121.091 -1.005 . . . . 0.0 113.288 173.953 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -92.43 -31.48 15.28 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.543 1.137 . . . . 0.0 112.828 179.4 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 6.4 m -127.57 -22.39 1.73 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.94 0 N-CA-C 114.209 1.189 . . . . 0.0 114.209 -172.137 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 88.67 148.16 16.39 Favored Glycine 0 CA--C 1.533 1.206 0 C-N-CA 125.422 1.486 . . . . 0.0 113.458 -172.455 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -57.23 -25.63 59.44 Favored 'General case' 0 N--CA 1.481 1.08 0 CA-C-O 123.569 1.652 . . . . 0.0 112.544 -176.833 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 7.2 pt20 -81.16 -13.32 58.75 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 126.738 2.015 . . . . 0.0 114.622 -179.7 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 76.0 m-20 -118.07 -11.93 10.12 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 114.759 1.392 . . . . 0.0 114.759 -177.894 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.435 HG22 ' CE1' ' A' ' 46' ' ' TYR . 46.0 pt -64.21 152.61 8.21 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 CA-C-O 120.899 0.38 . . . . 0.0 110.678 163.418 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -130.15 143.53 50.84 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 124.452 1.101 . . . . 0.0 109.991 178.363 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -62.17 -24.77 67.38 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 118.931 0.787 . . . . 0.0 112.49 -179.65 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.9 mp -70.29 -42.11 78.73 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 C-N-CA 125.868 1.667 . . . . 0.0 110.747 174.629 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 88.8 m -79.09 -42.87 25.31 Favored 'General case' 0 C--N 1.33 -0.276 0 O-C-N 121.675 -0.64 . . . . 0.0 109.62 -179.411 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 17.3 tp -64.86 -35.97 82.83 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 125.701 1.6 . . . . 0.0 112.329 177.022 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.466 ' HA ' HG13 ' A' ' 66' ' ' ILE . 60.5 p -58.29 -26.47 63.05 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 118.995 0.816 . . . . 0.0 112.397 170.982 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -99.49 -30.1 12.35 Favored 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 124.794 1.238 . . . . 0.0 114.22 -178.913 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 11.1 mmtm -63.19 -34.44 77.63 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 125.077 1.351 . . . . 0.0 112.196 177.586 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.1 mp -118.06 8.78 12.53 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 124.981 1.312 . . . . 0.0 113.998 -177.585 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 14.2 t30 55.38 61.82 2.72 Favored 'General case' 0 CA--C 1.552 1.044 0 C-N-CA 125.091 1.357 . . . . 0.0 111.854 177.165 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.466 HG13 ' HA ' ' A' ' 61' ' ' SER . 1.6 pt -136.5 175.87 9.31 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 C-N-CA 126.428 1.891 . . . . 0.0 111.476 -171.148 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 32.4 p -74.99 160.27 30.76 Favored 'General case' 0 N--CA 1.472 0.639 0 O-C-N 120.964 -1.085 . . . . 0.0 111.073 171.987 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 90.6 t -66.61 -26.39 37.27 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.02 0 O-C-N 121.364 -0.835 . . . . 0.0 110.987 169.938 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -77.53 -30.79 52.98 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 124.822 1.249 . . . . 0.0 111.204 -176.916 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . 0.352 0.0 OUTLIER -102.49 18.01 22.23 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 125.254 1.422 . . . . 0.0 113.395 171.254 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -104.05 -43.82 5.17 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.134 1.374 . . . . 0.0 111.616 158.029 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 9.2 ptmm? -73.61 -24.66 60.08 Favored 'General case' 0 N--CA 1.472 0.629 0 O-C-N 120.877 -1.14 . . . . 0.0 112.478 -176.202 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 28.3 p-10 -54.15 -39.63 66.69 Favored 'General case' 0 CA--C 1.545 0.755 0 N-CA-C 113.246 0.832 . . . . 0.0 113.246 173.444 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 28.2 m-85 -69.68 -47.23 63.97 Favored 'General case' 0 C--O 1.226 -0.164 0 C-N-CA 126.902 2.081 . . . . 0.0 110.167 179.314 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 67.7 mt -65.25 -42.76 94.74 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.497 0 C-N-CA 123.974 0.91 . . . . 0.0 109.821 -179.355 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 2.7 tppp? -70.03 -31.54 69.24 Favored 'General case' 0 N--CA 1.467 0.419 0 O-C-N 120.809 -1.182 . . . . 0.0 112.533 -176.17 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 3.6 p30 -88.42 -39.49 14.23 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 119.202 0.91 . . . . 0.0 112.032 175.443 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 7.1 t -88.08 -16.64 32.99 Favored 'General case' 0 CA--C 1.542 0.672 0 N-CA-C 115.287 1.588 . . . . 0.0 115.287 -165.001 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 9.8 p30 -63.98 -17.1 62.97 Favored 'General case' 0 N--CA 1.477 0.911 0 N-CA-C 116.537 2.051 . . . . 0.0 116.537 -167.726 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 6.3 mpt_? -96.76 1.09 50.45 Favored 'General case' 0 N--CA 1.482 1.175 0 N-CA-C 114.623 1.342 . . . . 0.0 114.623 172.735 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 54.2 tp -114.63 -55.25 2.51 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 125.286 1.434 . . . . 0.0 112.218 175.154 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 72.13 -78.27 0.67 Allowed Glycine 0 CA--C 1.536 1.351 0 C-N-CA 123.335 0.493 . . . . 0.0 112.52 -169.029 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 87.9 mtt-85 -139.9 167.81 21.25 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 125.983 1.713 . . . . 0.0 112.366 177.828 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 13.2 t -106.57 60.78 0.64 Allowed 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 126.314 1.846 . . . . 0.0 113.082 -164.97 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 68.7 m-80 -128.28 28.83 5.43 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 124.81 1.244 . . . . 0.0 114.064 -175.783 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 52.3 t30 -137.53 155.41 49.28 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 124.936 1.294 . . . . 0.0 111.418 176.404 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 78.5 mt 51.17 40.75 26.66 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 126.141 1.776 . . . . 0.0 113.792 178.327 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 65.8 pttt -107.56 -5.66 17.42 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 125.819 1.648 . . . . 0.0 114.107 -177.631 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 15.0 t -152.68 125.12 8.2 Favored 'General case' 0 N--CA 1.465 0.281 0 C-N-CA 124.867 1.267 . . . . 0.0 110.35 168.179 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -140.61 4.11 0.52 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.833 0 C-N-CA 125.848 1.659 . . . . 0.0 113.457 -179.003 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 67.57 10.22 57.29 Favored Glycine 0 CA--C 1.54 1.61 0 O-C-N 120.669 -1.27 . . . . 0.0 114.523 -169.878 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . 0.288 4.2 mp 55.29 29.35 0.14 Allowed 'Isoleucine or valine' 0 CA--C 1.552 1.053 0 C-N-CA 126.56 1.944 . . . . 0.0 111.973 177.768 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 53.55 26.26 5.5 Favored 'General case' 0 CA--C 1.553 1.085 0 C-N-CA 125.964 1.706 . . . . 0.0 114.125 -175.277 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 83.5 mt-30 -111.41 93.8 4.65 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 125.695 1.598 . . . . 0.0 110.313 179.932 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -121.43 162.51 20.3 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 125.991 1.716 . . . . 0.0 111.393 176.759 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -135.52 122.87 21.82 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 124.94 1.296 . . . . 0.0 110.848 -179.004 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 67.9 t -133.94 127.82 52.45 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 C-N-CA 125.513 1.525 . . . . 0.0 109.933 176.835 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 44.2 t -161.29 -56.61 0.05 OUTLIER 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 123.978 0.911 . . . . 0.0 112.635 174.447 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 13.2 t -80.09 -29.6 39.08 Favored 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 113.553 0.945 . . . . 0.0 113.553 -174.517 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 13.3 ttt -135.34 115.08 12.84 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 125.283 1.433 . . . . 0.0 109.991 -178.875 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -117.76 -10.07 10.58 Favored 'General case' 0 N--CA 1.479 0.988 0 N-CA-C 113.89 1.071 . . . . 0.0 113.89 -169.291 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -87.42 124.65 33.64 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 124.866 1.266 . . . . 0.0 112.005 -178.043 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 59.4 mtmt -140.91 135.2 31.02 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 126.098 1.759 . . . . 0.0 110.489 174.957 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 39.9 m -142.89 -47.79 0.32 Allowed 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 124.352 1.061 . . . . 0.0 113.011 -178.51 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -131.27 156.84 44.73 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 125.614 1.565 . . . . 0.0 111.771 -177.364 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 10.1 t -102.13 165.43 11.16 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 125.273 1.429 . . . . 0.0 111.962 171.794 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 13.0 t-105 . . . . . 0 C--O 1.253 1.265 0 C-N-CA 125.82 1.648 . . . . 0.0 112.894 -170.247 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.589 0 N-CA-C 111.74 -0.544 . . . . 0.0 111.74 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 50.9 m -78.23 87.27 4.31 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.54 1.136 . . . . 0.0 112.557 -175.421 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 49.7 t-80 -144.75 138.45 27.19 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 125.322 1.449 . . . . 0.0 110.72 175.372 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 11.0 tpt -149.9 78.35 1.35 Allowed 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 123.852 0.861 . . . . 0.0 111.744 -171.52 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -149.21 164.52 34.54 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 124.853 1.261 . . . . 0.0 112.533 176.361 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 4.4 t -148.9 162.22 40.3 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 125.178 1.391 . . . . 0.0 112.057 175.338 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.1 mtt -140.4 136.51 33.17 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 125.562 1.545 . . . . 0.0 110.765 174.077 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 -135.88 148.44 65.1 Favored Pre-proline 0 CA--C 1.548 0.872 0 C-N-CA 125.11 1.364 . . . . 0.0 112.09 176.67 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -81.43 -7.85 12.72 Favored 'Trans proline' 0 CA--C 1.538 0.678 0 C-N-CA 123.643 2.895 . . . . 0.0 115.097 -177.0 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -130.94 31.4 4.48 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 125.787 1.635 . . . . 0.0 114.206 -174.194 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -101.29 -4.11 27.68 Favored 'General case' 0 N--CA 1.478 0.971 0 N-CA-C 114.67 1.359 . . . . 0.0 114.67 179.589 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -129.79 -57.63 1.11 Allowed 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 124.647 1.179 . . . . 0.0 113.424 -160.62 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.8 pp -107.05 9.5 9.39 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.761 0 C-N-CA 125.925 1.69 . . . . 0.0 112.869 -177.157 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 18.0 tt -48.61 114.4 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.841 0 C-N-CA 125.045 1.338 . . . . 0.0 113.791 -175.219 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 7.7 t30 -161.14 130.15 4.64 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 126.942 2.097 . . . . 0.0 108.586 171.652 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 29.2 t0 -150.42 47.87 0.89 Allowed 'General case' 0 N--CA 1.476 0.835 0 CA-C-O 122.556 1.17 . . . . 0.0 111.106 178.409 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 58.5 mt 48.69 96.7 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 C-N-CA 128.83 2.852 . . . . 0.0 112.539 -168.362 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.441 ' HA ' ' HE2' ' A' ' 12' ' ' LYS . 11.3 mmpt? 56.02 39.47 30.47 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 125.136 1.374 . . . . 0.0 113.321 172.463 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 22.5 mmtm -100.55 10.07 41.69 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 127.766 2.426 . . . . 0.0 113.364 176.937 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 6.9 mp0 -90.95 152.11 20.83 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 125.517 1.527 . . . . 0.0 111.839 -171.843 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -81.66 48.25 1.17 Allowed 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 125.234 1.414 . . . . 0.0 114.171 -169.959 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 51.5 t-20 -136.63 107.51 6.66 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 124.904 1.282 . . . . 0.0 111.172 -175.925 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -110.56 145.27 38.1 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.484 1.514 . . . . 0.0 111.998 174.827 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 3.8 t -135.58 43.42 2.61 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 124.888 1.275 . . . . 0.0 112.707 -179.771 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -142.91 40.28 1.26 Allowed Glycine 0 N--CA 1.471 0.969 0 C-N-CA 124.201 0.905 . . . . 0.0 115.235 179.962 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 91.3 t -97.5 143.38 12.72 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 C-N-CA 125.346 1.459 . . . . 0.0 110.941 178.265 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 5.2 t -133.59 -168.04 2.04 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 126.035 1.734 . . . . 0.0 111.497 177.077 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -76.54 29.32 0.12 Allowed 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 126.27 1.828 . . . . 0.0 114.449 -171.891 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -155.82 130.51 5.05 Favored Pre-proline 0 CA--C 1.547 0.835 0 C-N-CA 126.038 1.735 . . . . 0.0 110.066 -161.983 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -77.73 -39.05 0.55 Allowed 'Trans proline' 0 CA--C 1.538 0.698 0 C-N-CA 122.077 1.851 . . . . 0.0 113.847 -169.378 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 18.4 tp -154.61 62.51 0.67 Allowed 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 124.13 0.972 . . . . 0.0 111.967 -175.761 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.9 t 56.12 43.46 26.85 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 124.735 1.214 . . . . 0.0 113.936 179.041 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 12.7 p -154.55 144.81 15.78 Favored Pre-proline 0 N--CA 1.473 0.709 0 C-N-CA 125.764 1.626 . . . . 0.0 109.915 -172.22 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 91.3 Cg_endo -77.53 60.27 7.04 Favored 'Trans proline' 0 CA--C 1.548 1.2 0 C-N-CA 123.56 2.84 . . . . 0.0 112.349 178.0 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 27.9 tptt 58.4 110.74 0.02 OUTLIER Pre-proline 0 N--CA 1.483 1.176 0 C-N-CA 129.654 3.182 . . . . 0.0 114.263 -176.902 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_endo -79.83 149.52 20.57 Favored 'Trans proline' 0 CA--C 1.538 0.692 0 C-N-CA 123.015 2.477 . . . . 0.0 112.07 -174.226 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 48.9 pttt -60.8 129.72 42.91 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 124.447 1.099 . . . . 0.0 112.588 -178.455 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 14.8 tp -147.62 139.22 23.9 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.316 1.446 . . . . 0.0 111.102 -170.753 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -150.65 60.07 0.94 Allowed 'General case' 0 N--CA 1.476 0.869 0 CA-C-O 122.643 1.211 . . . . 0.0 113.221 -176.286 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -95.07 87.7 4.99 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 125.232 1.413 . . . . 0.0 112.875 -173.986 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 63.7 mt -138.38 163.19 32.51 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 126.436 1.895 . . . . 0.0 112.988 -176.692 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 67.4 m -76.33 165.0 25.48 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.73 0.812 . . . . 0.0 110.299 171.144 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -55.22 -45.91 75.95 Favored 'General case' 0 N--CA 1.48 1.027 0 O-C-N 120.746 -1.222 . . . . 0.0 113.185 -174.348 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 10.5 tt0 -67.69 -43.43 80.13 Favored 'General case' 0 N--CA 1.469 0.522 0 O-C-N 121.496 -0.752 . . . . 0.0 111.063 176.758 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 88.7 mt-30 -62.95 -41.48 99.52 Favored 'General case' 0 CA--C 1.536 0.412 0 O-C-N 121.916 -0.49 . . . . 0.0 111.819 178.935 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 22.6 ttmm -59.74 -40.98 89.89 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 124.27 1.028 . . . . 0.0 110.982 174.742 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 50.6 mt -67.38 -41.53 86.4 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 CA-C-O 118.077 -0.963 . . . . 0.0 111.474 175.583 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 45.6 mt -64.5 -44.91 96.95 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.904 0 CA-C-N 120.773 1.624 . . . . 0.0 110.29 178.074 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -58.29 -48.38 80.66 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.774 1.23 . . . . 0.0 110.587 177.434 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -63.56 -53.11 56.92 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.625 1.17 . . . . 0.0 112.599 176.529 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.3 mm-40 -60.01 -29.99 68.85 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-N 118.998 0.817 . . . . 0.0 112.822 -179.696 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.417 ' CE2' HG22 ' A' ' 55' ' ' ILE . 1.3 t80 -68.04 -56.95 7.02 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 118.806 0.73 . . . . 0.0 110.93 176.311 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 80.1 mt -64.98 -33.65 65.14 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.333 0 C-N-CA 126.526 1.931 . . . . 0.0 111.195 -179.323 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -72.25 -27.96 62.84 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.892 0.877 . . . . 0.0 112.568 176.309 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -85.53 -39.67 17.16 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 123.861 0.865 . . . . 0.0 112.503 176.337 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.9 m -105.21 -6.95 9.83 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.047 0 N-CA-C 113.654 0.983 . . . . 0.0 113.654 -175.497 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 81.48 33.23 28.72 Favored Glycine 0 N--CA 1.471 0.985 0 C-N-CA 124.263 0.935 . . . . 0.0 114.176 164.207 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 20.0 tp 60.86 -26.77 0.04 OUTLIER 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 129.945 3.298 . . . . 0.0 117.708 -174.148 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 29.5 mt-30 -77.27 -13.0 60.02 Favored 'General case' 0 C--N 1.32 -0.684 0 C-N-CA 126.922 2.089 . . . . 0.0 113.752 -169.277 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 60.5 m-80 -123.31 1.16 9.03 Favored 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 114.336 1.236 . . . . 0.0 114.336 -169.736 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.417 HG22 ' CE2' ' A' ' 46' ' ' TYR . 18.3 pt -75.91 155.46 5.95 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 CA-C-O 121.072 0.463 . . . . 0.0 111.705 175.006 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -137.85 143.94 41.19 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 124.658 1.183 . . . . 0.0 110.018 178.794 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -61.33 -26.62 67.93 Favored 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 123.634 0.773 . . . . 0.0 112.316 -179.758 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -67.47 -51.21 54.37 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.327 0 C-N-CA 125.343 1.457 . . . . 0.0 109.631 174.538 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 83.6 m -73.81 -43.82 57.66 Favored 'General case' 0 C--N 1.33 -0.239 0 O-C-N 121.749 -0.594 . . . . 0.0 109.918 -176.719 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 17.2 tp -60.61 -35.09 75.29 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 125.53 1.532 . . . . 0.0 112.343 174.384 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.485 ' HA ' HG13 ' A' ' 66' ' ' ILE . 12.0 t -54.99 -30.43 59.3 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 124.975 1.31 . . . . 0.0 112.581 169.485 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 1.5 mptp? -105.19 -22.78 13.01 Favored 'General case' 0 N--CA 1.468 0.474 0 N-CA-C 114.491 1.293 . . . . 0.0 114.491 -176.464 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 68.4 mmtt -62.9 -34.57 77.69 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 119.797 1.18 . . . . 0.0 111.636 174.074 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.2 mp -120.92 13.65 11.44 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.923 1.289 . . . . 0.0 114.05 -176.401 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . 0.273 0.9 OUTLIER 48.2 53.68 11.4 Favored 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 126.614 1.965 . . . . 0.0 114.218 -177.14 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.485 HG13 ' HA ' ' A' ' 61' ' ' SER . 2.7 pt -117.42 -176.05 0.92 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 C-N-CA 126.781 2.032 . . . . 0.0 111.483 -174.626 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 36.8 p -83.94 156.76 22.19 Favored 'General case' 0 N--CA 1.474 0.734 0 O-C-N 121.214 -0.929 . . . . 0.0 111.084 170.791 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 66.7 t -62.27 -28.94 45.54 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 O-C-N 121.672 -0.643 . . . . 0.0 111.132 170.914 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -74.91 -42.71 57.24 Favored 'General case' 0 C--O 1.234 0.263 0 O-C-N 120.988 -1.07 . . . . 0.0 109.879 -176.597 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . 0.262 0.0 OUTLIER -77.69 -30.17 51.79 Favored 'General case' 0 C--N 1.344 0.348 0 CA-C-N 118.137 0.426 . . . . 0.0 111.88 -178.993 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -65.04 -47.32 77.81 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 124.678 1.191 . . . . 0.0 112.324 169.322 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 38.1 ttmt -68.1 -28.91 67.75 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 124.32 1.048 . . . . 0.0 111.492 -178.258 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -55.17 -36.54 65.96 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 123.494 0.718 . . . . 0.0 112.361 175.729 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 31.5 m-85 -69.54 -42.7 74.28 Favored 'General case' 0 C--O 1.223 -0.324 0 C-N-CA 125.569 1.548 . . . . 0.0 111.02 177.136 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 75.2 mt -68.45 -37.27 77.56 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.468 0 C-N-CA 124.173 0.989 . . . . 0.0 110.264 -178.626 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 88.5 mttt -65.19 -34.91 79.49 Favored 'General case' 0 N--CA 1.471 0.594 0 O-C-N 120.853 -1.154 . . . . 0.0 113.448 178.538 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 9.6 p30 -87.57 -40.26 14.39 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 119.315 0.961 . . . . 0.0 111.105 174.202 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 8.5 t -114.45 91.15 3.53 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-O 121.696 0.76 . . . . 0.0 111.458 -174.746 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 9.4 p30 -144.64 138.93 27.7 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.497 1.119 . . . . 0.0 109.885 167.493 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 2.6 mpt_? 57.8 -23.17 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.624 0 C-N-CA 128.044 2.537 . . . . 0.0 116.71 -172.421 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 56.0 tp -96.37 -34.56 11.51 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 126.63 1.972 . . . . 0.0 113.452 -174.206 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -75.23 146.64 34.94 Favored Glycine 0 CA--C 1.535 1.295 0 CA-C-N 118.008 0.367 . . . . 0.0 112.833 178.647 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 84.9 mtt-85 -135.61 -82.87 0.4 Allowed 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 124.839 1.256 . . . . 0.0 111.637 -178.099 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 3.9 t -159.75 119.58 2.95 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 125.361 1.465 . . . . 0.0 109.486 177.508 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 7.1 m120 -138.84 135.69 34.82 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 123.928 0.891 . . . . 0.0 110.393 -171.588 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 11.9 p-10 -153.31 166.7 31.79 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 124.835 1.254 . . . . 0.0 112.12 -175.524 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER 56.62 29.04 14.95 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 125.76 1.624 . . . . 0.0 114.42 176.901 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 17.9 ptpt -129.26 5.46 5.27 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 125.643 1.577 . . . . 0.0 114.848 -178.221 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 13.6 t -148.22 122.66 9.71 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 124.421 1.088 . . . . 0.0 110.299 173.919 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -140.52 4.94 0.53 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.812 0 C-N-CA 126.241 1.816 . . . . 0.0 113.025 -179.133 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 69.17 6.66 54.46 Favored Glycine 0 CA--C 1.538 1.475 0 O-C-N 120.751 -1.218 . . . . 0.0 114.753 -170.145 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . 0.287 4.6 mp 56.87 24.19 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.061 0 C-N-CA 126.532 1.933 . . . . 0.0 112.403 177.219 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 10.7 tp 53.68 23.39 3.63 Favored 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 126.28 1.832 . . . . 0.0 114.238 -172.085 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -95.39 93.21 7.1 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.655 1.582 . . . . 0.0 110.215 -179.407 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -121.21 144.64 48.49 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 125.303 1.441 . . . . 0.0 111.72 179.377 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -121.43 74.25 1.1 Allowed 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 125.166 1.386 . . . . 0.0 110.692 -175.394 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 18.6 m -135.12 21.92 1.05 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.615 0 C-N-CA 125.588 1.555 . . . . 0.0 114.229 -170.76 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 22.9 t -146.45 -56.59 0.28 Allowed 'General case' 0 N--CA 1.476 0.831 0 N-CA-C 113.517 0.932 . . . . 0.0 113.517 -176.625 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 45.6 m -88.15 -40.27 13.87 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 123.261 0.624 . . . . 0.0 112.441 -175.509 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 1.8 mpt? -125.05 141.66 51.98 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 126.473 1.909 . . . . 0.0 108.827 169.75 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -148.04 94.49 2.34 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.752 1.221 . . . . 0.0 109.259 178.31 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -138.2 156.18 47.95 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.195 1.398 . . . . 0.0 112.304 -178.863 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 2.0 mmmp? -128.16 139.97 52.18 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 125.996 1.718 . . . . 0.0 110.831 179.894 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 55.0 m -143.61 154.8 43.93 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 125.401 1.48 . . . . 0.0 111.886 -177.5 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 27.2 mmt -78.51 158.41 28.59 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 124.03 0.932 . . . . 0.0 112.681 171.011 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 7.1 t -78.12 171.32 15.2 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 124.738 1.215 . . . . 0.0 112.377 170.534 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 21.7 m-90 . . . . . 0 C--O 1.253 1.269 0 C-N-CA 126.453 1.901 . . . . 0.0 112.883 -173.557 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.512 0 N-CA-C 111.345 -0.702 . . . . 0.0 111.345 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 13.3 t -150.11 156.39 41.55 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 125.368 1.467 . . . . 0.0 111.176 177.121 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 1.5 t-160 -149.07 163.93 36.11 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 124.896 1.279 . . . . 0.0 111.726 -179.686 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 20.7 ttt -103.78 140.52 37.52 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 124.719 1.207 . . . . 0.0 112.393 -174.179 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -80.52 156.93 26.29 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 124.301 1.04 . . . . 0.0 113.382 -178.131 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 22.9 t -151.19 157.22 42.39 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 125.295 1.438 . . . . 0.0 111.651 174.973 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 36.9 ttm -135.34 9.89 3.47 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 125.532 1.533 . . . . 0.0 112.926 -178.732 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 -84.76 147.81 49.76 Favored Pre-proline 0 CA--C 1.547 0.847 0 C-N-CA 124.628 1.171 . . . . 0.0 112.481 -179.141 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_endo -71.03 -19.18 30.44 Favored 'Trans proline' 0 C--N 1.35 0.655 0 C-N-CA 122.935 2.424 . . . . 0.0 114.963 -173.634 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.478 HD23 ' H ' ' A' ' 4' ' ' LEU . 2.6 pt? -112.63 25.68 11.24 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 126.828 2.051 . . . . 0.0 114.402 -172.353 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -103.01 0.52 32.22 Favored 'General case' 0 N--CA 1.477 0.876 0 N-CA-C 114.815 1.413 . . . . 0.0 114.815 -178.167 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -122.46 -55.36 1.84 Allowed 'General case' 0 N--CA 1.484 1.234 0 N-CA-C 113.894 1.072 . . . . 0.0 113.894 -165.168 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.0 pp -129.84 15.15 2.39 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 C-N-CA 125.652 1.581 . . . . 0.0 112.81 -171.784 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 14.2 tt -39.79 133.33 0.49 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.847 0 C-N-CA 126.407 1.883 . . . . 0.0 114.407 178.724 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 25.8 t30 -148.54 148.85 30.66 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 126.242 1.817 . . . . 0.0 110.732 170.63 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 20.2 m-20 -132.63 71.47 1.47 Allowed 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 125.389 1.475 . . . . 0.0 111.004 170.41 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . 0.34 6.7 tp 52.21 26.26 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.069 0 C-N-CA 128.262 2.625 . . . . 0.0 115.571 175.098 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -130.98 -33.6 1.54 Allowed 'General case' 0 N--CA 1.476 0.867 0 N-CA-C 114.818 1.414 . . . . 0.0 114.818 177.612 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 45.7 tttm 50.73 38.45 19.42 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 125.982 1.713 . . . . 0.0 113.252 -174.381 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -77.17 122.73 25.42 Favored 'General case' 0 CA--C 1.541 0.617 0 O-C-N 121.321 -0.862 . . . . 0.0 111.368 -177.251 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -153.32 166.39 32.75 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 125.747 1.619 . . . . 0.0 111.433 178.925 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -111.4 126.69 55.21 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 124.798 1.239 . . . . 0.0 111.791 179.153 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 20.7 m-20 -144.56 145.69 31.95 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 126.144 1.777 . . . . 0.0 110.54 175.341 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 83.6 p -139.07 10.8 2.6 Favored 'General case' 0 N--CA 1.479 0.998 0 N-CA-C 115.444 1.646 . . . . 0.0 115.444 -173.917 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -168.56 109.06 0.32 Allowed Glycine 0 CA--C 1.529 0.929 0 O-C-N 121.561 -0.712 . . . . 0.0 112.043 172.33 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 4.4 t -132.65 40.15 0.69 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.125 0 C-N-CA 125.432 1.493 . . . . 0.0 110.736 -175.717 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -150.22 159.87 44.11 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 114.949 1.463 . . . . 0.0 114.949 -175.623 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.448 HD23 ' H ' ' A' ' 22' ' ' LEU . 1.4 pt? -93.17 29.17 1.95 Allowed 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 126.747 2.019 . . . . 0.0 114.937 -171.071 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -135.54 143.14 43.83 Favored Pre-proline 0 CA--C 1.55 0.95 0 C-N-CA 125.443 1.497 . . . . 0.0 112.258 -170.736 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_endo -79.61 -29.38 2.93 Favored 'Trans proline' 0 CA--C 1.541 0.866 0 C-N-CA 123.201 2.601 . . . . 0.0 112.851 -177.949 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 8.1 tp -150.08 -158.16 0.89 Allowed 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 126.971 2.108 . . . . 0.0 108.305 174.641 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 5.2 t -78.06 54.37 1.32 Allowed 'General case' 0 N--CA 1.479 0.992 0 O-C-N 120.751 -1.218 . . . . 0.0 112.604 176.626 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 13.1 p -159.14 140.45 9.51 Favored Pre-proline 0 N--CA 1.474 0.771 0 C-N-CA 126.23 1.812 . . . . 0.0 110.859 -171.631 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -79.44 64.06 8.8 Favored 'Trans proline' 0 CA--C 1.546 1.124 0 C-N-CA 123.789 2.993 . . . . 0.0 112.341 178.26 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 17.8 tptt 59.47 107.11 0.03 OUTLIER Pre-proline 0 N--CA 1.483 1.202 0 C-N-CA 129.038 2.935 . . . . 0.0 114.043 -177.51 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 86.3 Cg_endo -77.36 137.23 16.59 Favored 'Trans proline' 0 CA--C 1.539 0.731 0 C-N-CA 122.843 2.362 . . . . 0.0 112.153 -173.232 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 13.4 ptmm? -72.85 130.71 41.04 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 124.712 1.205 . . . . 0.0 113.092 -175.556 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.1 pp -147.94 151.74 36.33 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 124.945 1.298 . . . . 0.0 113.319 -179.979 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -138.31 50.53 1.89 Allowed 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 125.139 1.375 . . . . 0.0 111.922 -175.827 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -82.73 78.51 9.33 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 124.967 1.307 . . . . 0.0 111.638 -174.543 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 11.2 mt -134.0 148.64 51.14 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 126.953 2.101 . . . . 0.0 110.398 -173.195 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 68.3 m -69.06 167.19 16.52 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.006 0.522 . . . . 0.0 110.47 171.158 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -56.26 -45.48 80.07 Favored 'General case' 0 N--CA 1.478 0.927 0 O-C-N 120.463 -1.398 . . . . 0.0 112.651 -176.327 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 10.3 tt0 -70.16 -44.25 69.18 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 123.527 0.731 . . . . 0.0 111.347 176.338 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 82.9 mt-30 -59.71 -41.66 91.3 Favored 'General case' 0 N--CA 1.468 0.453 0 O-C-N 121.805 -0.559 . . . . 0.0 111.693 178.16 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 3.4 ttmp? -62.34 -40.05 95.11 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 124.206 1.002 . . . . 0.0 111.215 177.542 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 52.4 mt -70.53 -39.46 76.18 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.558 0 CA-C-O 117.958 -1.02 . . . . 0.0 111.585 175.655 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 50.7 mt -62.87 -45.64 98.36 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.99 0 CA-C-N 120.942 1.701 . . . . 0.0 109.733 176.676 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -58.58 -49.44 77.45 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.829 1.251 . . . . 0.0 110.924 178.56 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -63.94 -52.21 60.8 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 124.784 1.234 . . . . 0.0 112.766 177.086 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -60.22 -30.36 69.34 Favored 'General case' 0 N--CA 1.472 0.625 0 CA-C-N 118.99 0.814 . . . . 0.0 112.724 179.867 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -67.02 -56.84 8.38 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 118.631 0.65 . . . . 0.0 110.605 176.659 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 87.1 mt -62.81 -34.14 64.14 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 C-N-CA 126.383 1.873 . . . . 0.0 111.287 178.126 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -70.91 -28.08 64.26 Favored 'General case' 0 CA--C 1.542 0.663 0 O-C-N 121.267 -0.896 . . . . 0.0 112.654 177.169 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -85.67 -40.26 16.37 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.127 0.971 . . . . 0.0 112.208 175.689 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.5 m -108.75 -5.04 10.73 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.159 0 N-CA-C 114.32 1.23 . . . . 0.0 114.32 -172.275 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 84.96 25.25 41.66 Favored Glycine 0 CA--C 1.529 0.96 0 C-N-CA 125.111 1.339 . . . . 0.0 115.263 161.318 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 58.01 6.64 0.51 Allowed 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 127.267 2.227 . . . . 0.0 115.155 -172.923 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 29.2 mt-30 -105.71 -18.01 14.21 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 125.856 1.663 . . . . 0.0 113.098 -172.139 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 47.0 m-80 -124.06 3.79 8.64 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 124.257 1.023 . . . . 0.0 113.542 -172.631 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 24.6 pt -74.36 154.31 6.68 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 CA-C-O 121.085 0.469 . . . . 0.0 111.116 172.666 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -138.85 142.65 38.63 Favored 'General case' 0 N--CA 1.466 0.375 0 C-N-CA 124.824 1.25 . . . . 0.0 109.525 178.68 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -61.01 -27.87 68.63 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 118.838 0.745 . . . . 0.0 112.274 -179.772 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -63.84 -49.29 82.58 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.466 0 C-N-CA 125.576 1.55 . . . . 0.0 109.922 174.626 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 83.9 m -78.98 -43.0 25.35 Favored 'General case' 0 C--O 1.223 -0.32 0 C-N-CA 123.806 0.842 . . . . 0.0 110.302 -175.904 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 14.0 tp -60.01 -36.75 77.89 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 125.078 1.351 . . . . 0.0 111.745 174.098 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.443 ' HA ' HG13 ' A' ' 66' ' ' ILE . 30.4 t -56.44 -31.41 63.93 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 124.839 1.255 . . . . 0.0 112.632 170.601 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -101.24 -26.36 13.67 Favored 'General case' 0 N--CA 1.467 0.39 0 N-CA-C 114.643 1.349 . . . . 0.0 114.643 -175.81 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 58.7 mmtt -64.41 -33.01 74.87 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 125.135 1.374 . . . . 0.0 111.577 175.387 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.7 mp -117.84 3.92 12.22 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.213 1.405 . . . . 0.0 114.353 -175.086 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 24.7 m-80 57.0 57.52 4.57 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 126.388 1.875 . . . . 0.0 113.415 -178.659 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.443 HG13 ' HA ' ' A' ' 61' ' ' SER . 1.2 pt -124.74 -163.99 0.38 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.849 0 C-N-CA 127.243 2.217 . . . . 0.0 110.554 -174.641 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 2.4 p -100.8 162.24 13.04 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 124.296 1.039 . . . . 0.0 111.126 170.284 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 69.2 t -61.65 -28.9 45.05 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 C-N-CA 123.545 0.738 . . . . 0.0 111.391 173.242 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -80.87 -38.17 28.59 Favored 'General case' 0 N--CA 1.471 0.613 0 O-C-N 120.893 -1.129 . . . . 0.0 110.394 -178.971 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 9.5 tmtt? -64.67 -45.5 86.45 Favored 'General case' 0 C--O 1.224 -0.237 0 C-N-CA 125.632 1.573 . . . . 0.0 110.518 176.961 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -60.34 -48.62 80.97 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 126.275 1.83 . . . . 0.0 113.444 170.71 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 36.5 ttmt -71.62 -23.03 61.64 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 124.227 1.011 . . . . 0.0 111.758 -174.417 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -52.02 -47.73 64.86 Favored 'General case' 0 CA--C 1.545 0.76 0 CA-C-N 118.137 0.426 . . . . 0.0 110.527 171.421 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 33.9 m-85 -64.6 -43.28 94.29 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 123.845 0.858 . . . . 0.0 111.982 179.776 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 55.8 mt -63.91 -25.38 38.04 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.629 0 C-N-CA 123.978 0.911 . . . . 0.0 111.099 179.15 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -91.06 -31.85 16.11 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 125.176 1.39 . . . . 0.0 114.686 179.724 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 23.5 p30 -105.17 -28.56 10.9 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 120.247 1.385 . . . . 0.0 114.224 -179.258 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 4.3 t -91.78 -14.63 29.54 Favored 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 113.865 1.061 . . . . 0.0 113.865 -171.392 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 20.7 p30 -59.18 -18.33 35.33 Favored 'General case' 0 CA--C 1.546 0.817 0 N-CA-C 115.394 1.627 . . . . 0.0 115.394 -175.329 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 2.7 mpt_? -71.77 -22.28 61.62 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 124.758 1.223 . . . . 0.0 112.649 -179.82 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 12.9 tp -78.75 -48.75 14.28 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 124.839 1.255 . . . . 0.0 112.815 -169.347 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -86.82 50.63 4.21 Favored Glycine 0 CA--C 1.534 1.234 0 C-N-CA 125.093 1.33 . . . . 0.0 113.867 -176.326 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 28.2 mtt85 -129.88 -60.83 1.02 Allowed 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 124.899 1.28 . . . . 0.0 112.61 -174.269 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 2.7 t -161.17 132.4 5.46 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 124.371 1.068 . . . . 0.0 109.736 -178.5 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 7.5 m120 -133.97 149.76 51.25 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 124.85 1.26 . . . . 0.0 110.91 -173.053 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 58.3 t30 -113.13 143.56 44.15 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.671 1.188 . . . . 0.0 111.687 178.191 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 5.3 tp 56.33 -178.85 0.04 OUTLIER 'General case' 0 CA--C 1.553 1.096 0 C-N-CA 126.557 1.943 . . . . 0.0 112.799 -170.009 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -133.3 7.25 3.9 Favored 'General case' 0 N--CA 1.482 1.159 0 N-CA-C 115.791 1.774 . . . . 0.0 115.791 -171.174 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 1.5 t -135.64 8.46 3.33 Favored 'General case' 0 N--CA 1.484 1.253 0 N-CA-C 116.381 1.993 . . . . 0.0 116.381 -165.652 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.543 HG23 ' CA ' ' A' ' 92' ' ' ILE . 1.6 tp -114.1 7.64 7.72 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.671 0 N-CA-C 115.1 1.518 . . . . 0.0 115.1 -141.955 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 61.75 7.2 10.82 Favored Glycine 0 CA--C 1.532 1.129 0 CA-C-N 114.338 -1.301 . . . . 0.0 113.855 -152.227 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.543 ' CA ' HG23 ' A' ' 90' ' ' ILE 0.29 3.7 mp 59.66 35.68 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.377 0 CA-C-O 122.449 1.119 . . . . 0.0 109.223 -166.86 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 10.9 tp 50.49 25.47 1.97 Allowed 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 127.978 2.511 . . . . 0.0 114.963 -174.303 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 37.2 mt-30 -136.64 85.54 2.15 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 125.718 1.607 . . . . 0.0 110.8 -172.035 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -125.42 145.21 50.16 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 124.883 1.273 . . . . 0.0 111.276 172.28 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -144.64 96.8 2.93 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 124.833 1.253 . . . . 0.0 110.345 -175.535 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 71.7 t -136.59 137.99 46.99 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 C-N-CA 125.577 1.551 . . . . 0.0 110.683 -177.33 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 67.5 p -161.92 -66.26 0.05 Allowed 'General case' 0 N--CA 1.476 0.837 0 N-CA-C 113.609 0.966 . . . . 0.0 113.609 172.632 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 77.9 p -82.43 -23.54 34.77 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 124.977 1.311 . . . . 0.0 114.291 -173.157 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 93.1 mtp -133.5 130.93 39.21 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 126.023 1.729 . . . . 0.0 109.495 174.551 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -138.69 65.63 1.45 Allowed 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 125.074 1.35 . . . . 0.0 109.93 -174.683 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 53.4 -155.62 0.2 Allowed 'General case' 0 CA--C 1.555 1.147 0 C-N-CA 125.855 1.662 . . . . 0.0 113.886 -174.94 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 71.2 mmtt -131.56 155.82 46.82 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 126.287 1.835 . . . . 0.0 111.947 177.851 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 66.7 p -116.01 15.29 16.17 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 126.455 1.902 . . . . 0.0 114.148 -172.985 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 67.9 mtt -67.73 160.71 27.55 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 124.732 1.213 . . . . 0.0 113.407 -178.136 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 14.8 t -137.53 156.23 48.35 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 125.377 1.471 . . . . 0.0 112.314 179.004 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 25.0 m-90 . . . . . 0 C--O 1.252 1.222 0 C-N-CA 126.59 1.956 . . . . 0.0 112.094 -175.114 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.574 0 N-CA-C 111.795 -0.522 . . . . 0.0 111.795 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 78.9 p -146.52 160.43 42.13 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 125.177 1.391 . . . . 0.0 112.669 -179.605 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 73.1 m80 -137.82 161.8 35.63 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 125.855 1.662 . . . . 0.0 111.803 -178.164 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 64.9 ttp -138.38 137.56 37.42 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 125.299 1.439 . . . . 0.0 110.992 177.827 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . 42.93 76.34 0.08 Allowed 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 127.341 2.256 . . . . 0.0 115.249 172.855 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 23.7 t -126.23 117.52 23.25 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 125.293 1.437 . . . . 0.0 111.514 -171.32 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 21.0 ttt -147.66 18.14 1.15 Allowed 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 125.283 1.433 . . . . 0.0 112.298 -174.808 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -120.82 98.39 47.81 Favored Pre-proline 0 CA--C 1.546 0.809 0 O-C-N 120.639 -1.288 . . . . 0.0 111.981 -168.796 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 95.5 Cg_endo -83.66 -8.59 10.31 Favored 'Trans proline' 0 C--N 1.351 0.665 0 C-N-CA 123.205 2.603 . . . . 0.0 114.699 178.145 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 94.3 mt -102.69 44.22 1.03 Allowed 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.626 1.57 . . . . 0.0 113.683 -170.582 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -106.91 -1.77 21.98 Favored 'General case' 0 N--CA 1.479 1.004 0 N-CA-C 114.907 1.447 . . . . 0.0 114.907 172.073 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -128.49 -56.46 1.23 Allowed 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 124.174 0.99 . . . . 0.0 113.363 -166.833 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.7 pp -109.54 9.07 8.96 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 C-N-CA 126.029 1.732 . . . . 0.0 112.888 -175.912 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 13.3 tt -49.85 120.31 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 124.223 1.009 . . . . 0.0 112.559 -179.252 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 53.85 21.48 2.79 Favored 'General case' 0 CA--C 1.55 0.965 0 C-N-CA 126.536 1.935 . . . . 0.0 115.244 179.937 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -86.32 13.83 7.5 Favored 'General case' 0 CA--C 1.547 0.832 0 N-CA-C 114.794 1.405 . . . . 0.0 114.794 -168.636 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 12.7 tt -143.69 21.35 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.879 0 C-N-CA 125.325 1.45 . . . . 0.0 114.201 -174.076 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 54.3 mtpt -126.86 -36.82 2.17 Favored 'General case' 0 N--CA 1.479 0.979 0 N-CA-C 115.572 1.693 . . . . 0.0 115.572 178.895 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 45.8 tttm -157.61 149.48 22.16 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 124.462 1.105 . . . . 0.0 112.788 -174.53 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -83.37 144.82 29.39 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.336 1.054 . . . . 0.0 111.86 167.553 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -140.54 27.11 2.09 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 125.019 1.327 . . . . 0.0 113.892 -163.601 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -110.49 -26.45 9.5 Favored 'General case' 0 CA--C 1.549 0.911 0 N-CA-C 114.834 1.42 . . . . 0.0 114.834 -169.387 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 -139.75 138.7 36.12 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 124.914 1.286 . . . . 0.0 111.751 -175.901 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 42.9 m -140.91 44.45 1.8 Allowed 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 125.035 1.334 . . . . 0.0 112.803 -170.759 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -148.56 36.7 1.07 Allowed Glycine 0 CA--C 1.53 1.001 0 N-CA-C 115.202 0.841 . . . . 0.0 115.202 -175.202 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 39.7 t -129.67 39.34 0.84 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 C-N-CA 125.751 1.62 . . . . 0.0 110.199 -170.363 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -147.61 164.05 34.69 Favored 'General case' 0 N--CA 1.476 0.85 0 O-C-N 120.333 -1.479 . . . . 0.0 114.384 -178.127 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 6.0 mt -91.04 38.89 0.97 Allowed 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 127.17 2.188 . . . . 0.0 112.229 -163.695 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -141.78 103.65 5.82 Favored Pre-proline 0 CA--C 1.549 0.924 0 C-N-CA 124.106 0.962 . . . . 0.0 112.238 -157.52 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo -79.63 -26.28 4.85 Favored 'Trans proline' 0 CA--C 1.541 0.848 0 C-N-CA 122.843 2.362 . . . . 0.0 113.921 -175.532 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 6.2 mt -138.37 47.49 1.98 Allowed 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 125.476 1.511 . . . . 0.0 112.267 -176.296 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 1.3 t 57.87 31.21 20.23 Favored 'General case' 0 N--CA 1.477 0.892 0 CA-C-O 123.084 1.421 . . . . 0.0 114.655 -179.972 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 16.8 t -149.32 138.54 12.61 Favored Pre-proline 0 N--CA 1.469 0.475 0 C-N-CA 128.887 2.875 . . . . 0.0 106.905 -172.567 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_endo -73.77 71.82 3.97 Favored 'Trans proline' 0 CA--C 1.544 0.976 0 C-N-CA 123.986 3.124 . . . . 0.0 111.847 -179.316 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 60.34 101.63 0.04 OUTLIER Pre-proline 0 N--CA 1.476 0.87 0 C-N-CA 128.137 2.575 . . . . 0.0 112.819 -175.469 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 77.2 Cg_endo -71.01 164.41 35.84 Favored 'Trans proline' 0 CA--C 1.54 0.781 0 C-N-CA 122.478 2.119 . . . . 0.0 112.045 170.395 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 22.2 pttp -112.75 124.17 51.96 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 125.256 1.422 . . . . 0.0 111.829 173.149 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -154.04 157.88 39.69 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.558 1.543 . . . . 0.0 113.741 -171.009 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 65.0 mm-40 -139.02 55.28 1.71 Allowed 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 126.045 1.738 . . . . 0.0 111.605 179.414 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -105.47 95.17 5.63 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 125.48 1.512 . . . . 0.0 112.036 -173.894 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 8.1 mt -133.87 155.87 49.09 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 127.272 2.229 . . . . 0.0 110.224 177.973 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 22.8 t -70.93 164.46 25.39 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 122.93 0.492 . . . . 0.0 110.747 169.83 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -57.24 -44.17 83.58 Favored 'General case' 0 N--CA 1.476 0.836 0 O-C-N 120.531 -1.355 . . . . 0.0 112.965 -175.3 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 8.1 pt20 -75.9 -33.88 59.93 Favored 'General case' 0 N--CA 1.471 0.6 0 O-C-N 121.693 -0.63 . . . . 0.0 112.155 174.769 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 93.2 mt-30 -67.52 -39.5 85.11 Favored 'General case' 0 CA--C 1.532 0.264 0 O-C-N 121.662 -0.649 . . . . 0.0 111.52 -179.691 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 23.7 ttmm -59.36 -41.0 88.24 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 124.213 1.005 . . . . 0.0 110.81 174.682 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 46.2 mt -69.65 -42.2 80.38 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.656 0 CA-C-O 118.136 -0.935 . . . . 0.0 111.283 177.026 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 42.4 mt -63.86 -44.5 98.11 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.069 0 CA-C-N 120.702 1.592 . . . . 0.0 110.361 178.357 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -59.69 -47.52 85.33 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 125.033 1.333 . . . . 0.0 110.865 176.74 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -63.92 -51.83 62.67 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 124.634 1.173 . . . . 0.0 112.67 176.703 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -58.95 -31.62 68.87 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-N 119.261 0.937 . . . . 0.0 112.689 179.124 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -66.07 -57.41 7.78 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 118.621 0.646 . . . . 0.0 110.587 176.869 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 71.0 mt -62.7 -35.13 69.17 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.352 0 C-N-CA 127.199 2.2 . . . . 0.0 111.896 178.631 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -71.97 -29.03 63.83 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.023 0.929 . . . . 0.0 112.408 178.138 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -86.27 -38.76 17.22 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 123.988 0.915 . . . . 0.0 112.312 176.236 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.3 m -106.55 -5.91 10.19 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.191 0 N-CA-C 114.285 1.217 . . . . 0.0 114.285 -174.372 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 86.32 25.85 35.27 Favored Glycine 0 N--CA 1.472 1.085 0 C-N-CA 124.967 1.27 . . . . 0.0 115.306 161.594 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 54.3 14.24 0.74 Allowed 'General case' 0 CA--C 1.554 1.116 0 C-N-CA 127.381 2.272 . . . . 0.0 115.129 -173.538 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 5.2 pt20 -124.6 -3.17 7.84 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 124.854 1.262 . . . . 0.0 113.662 -171.589 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 50.4 m-80 -124.55 3.52 8.31 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 124.935 1.294 . . . . 0.0 113.411 174.419 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 33.0 pt -74.51 152.95 6.76 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.648 0 O-C-N 121.68 -0.638 . . . . 0.0 112.192 177.007 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -135.49 146.13 47.83 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 125.237 1.415 . . . . 0.0 109.864 174.522 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -65.0 -24.99 67.67 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.884 0.874 . . . . 0.0 112.125 177.397 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -68.02 -38.5 79.99 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.488 0 C-N-CA 125.905 1.682 . . . . 0.0 110.419 173.464 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 90.7 m -83.06 -43.67 16.04 Favored 'General case' 0 C--N 1.33 -0.25 0 O-C-N 121.661 -0.649 . . . . 0.0 109.668 -178.643 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 8.0 mt -60.44 -36.86 79.18 Favored 'General case' 0 N--CA 1.468 0.439 0 O-C-N 121.442 -0.786 . . . . 0.0 112.571 171.297 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.452 ' HA ' HG13 ' A' ' 66' ' ' ILE . 62.1 p -59.98 -24.69 64.64 Favored 'General case' 0 N--CA 1.477 0.921 0 CA-C-N 119.509 1.049 . . . . 0.0 112.669 175.938 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -103.13 -28.23 12.07 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 125.277 1.431 . . . . 0.0 114.246 -177.625 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 19.7 mmmt -64.31 -31.0 72.03 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.841 1.257 . . . . 0.0 112.775 176.889 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.3 mp -126.71 9.5 7.03 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 114.158 1.17 . . . . 0.0 114.158 -175.378 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 16.4 m-80 56.04 59.8 3.55 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 125.932 1.693 . . . . 0.0 113.222 -178.541 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.452 HG13 ' HA ' ' A' ' 61' ' ' SER . 1.1 pt -128.41 173.83 12.81 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 C-N-CA 126.747 2.019 . . . . 0.0 111.679 -173.986 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.2 p -77.17 158.16 30.53 Favored 'General case' 0 N--CA 1.477 0.905 0 O-C-N 120.998 -1.064 . . . . 0.0 111.054 173.931 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 87.6 t -63.69 -28.88 45.89 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.909 0 O-C-N 121.632 -0.667 . . . . 0.0 111.25 172.752 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -77.63 -37.83 49.27 Favored 'General case' 0 N--CA 1.47 0.551 0 O-C-N 120.711 -1.243 . . . . 0.0 110.19 -179.757 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 5.0 tmtm? -65.01 -48.52 73.62 Favored 'General case' 0 C--O 1.225 -0.227 0 C-N-CA 125.489 1.515 . . . . 0.0 110.402 176.423 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -59.61 -42.9 93.67 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 126.107 1.763 . . . . 0.0 113.213 172.808 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 36.3 ttmt -74.16 -29.37 61.75 Favored 'General case' 0 CA--C 1.516 -0.342 0 C-N-CA 124.477 1.111 . . . . 0.0 111.838 -175.958 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -50.5 -45.98 56.86 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 118.415 0.552 . . . . 0.0 110.405 176.837 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 35.6 m-85 -64.58 -39.17 93.25 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.75 0.82 . . . . 0.0 111.559 -176.453 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 20.2 mt -71.91 -28.07 29.23 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.623 0 C-N-CA 124.594 1.157 . . . . 0.0 110.955 -179.952 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 25.4 mmmt -76.98 -39.93 48.69 Favored 'General case' 0 N--CA 1.466 0.33 0 O-C-N 120.878 -1.138 . . . . 0.0 112.251 178.032 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 24.2 p30 -97.09 -39.98 9.05 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 119.123 0.874 . . . . 0.0 112.63 -174.771 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 8.0 t -111.29 86.4 2.32 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.778 0.831 . . . . 0.0 111.566 -175.055 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 25.8 p30 -135.78 -40.75 0.69 Allowed 'General case' 0 CA--C 1.545 0.788 0 N-CA-C 116.121 1.897 . . . . 0.0 116.121 -173.805 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 1.2 mpt_? -90.17 -18.93 24.87 Favored 'General case' 0 N--CA 1.484 1.232 0 CA-C-N 119.737 1.153 . . . . 0.0 113.244 168.018 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 8.2 tt -65.56 -42.52 91.74 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 124.559 1.144 . . . . 0.0 111.899 179.302 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -92.88 22.15 35.59 Favored Glycine 0 CA--C 1.535 1.298 0 CA-C-O 119.202 -0.777 . . . . 0.0 114.623 179.873 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 42.1 ttt-85 -108.45 -71.93 0.74 Allowed 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 124.658 1.183 . . . . 0.0 111.786 -173.263 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 2.6 t -166.1 124.8 1.55 Allowed 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 124.977 1.311 . . . . 0.0 110.625 174.419 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 65.3 m-80 -144.79 162.0 37.86 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.647 1.579 . . . . 0.0 111.55 -177.902 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 54.75 38.44 30.12 Favored 'General case' 0 CA--C 1.553 1.08 0 C-N-CA 125.68 1.592 . . . . 0.0 113.622 179.9 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 12.0 tp -147.15 40.35 1.04 Allowed 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 125.084 1.353 . . . . 0.0 111.416 -175.655 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 54.3 tptt -85.24 -26.52 26.64 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 125.559 1.544 . . . . 0.0 111.473 -179.092 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 8.8 t -162.55 128.81 3.49 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 126.721 2.009 . . . . 0.0 109.662 176.895 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -142.72 2.14 0.38 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.743 0 C-N-CA 125.131 1.372 . . . . 0.0 114.621 -178.037 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 66.28 12.62 58.62 Favored Glycine 0 CA--C 1.541 1.677 0 O-C-N 120.734 -1.229 . . . . 0.0 114.229 -169.638 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . 0.276 3.4 mp 51.03 40.77 0.35 Allowed 'Isoleucine or valine' 0 CA--C 1.549 0.924 0 C-N-CA 127.307 2.243 . . . . 0.0 111.984 176.689 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER 52.56 27.12 4.79 Favored 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 126.622 1.969 . . . . 0.0 114.607 178.818 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 31.9 mt-30 -132.35 76.57 1.7 Allowed 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 125.54 1.536 . . . . 0.0 110.566 -170.308 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -121.44 -50.44 2.11 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.801 1.24 . . . . 0.0 112.549 -178.21 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -132.17 43.07 3.06 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 125.092 1.357 . . . . 0.0 112.291 -179.911 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 7.2 p -152.37 142.83 15.38 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.442 0 C-N-CA 124.916 1.286 . . . . 0.0 111.321 -173.369 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 43.9 m 53.17 28.26 6.84 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 125.859 1.664 . . . . 0.0 115.361 177.618 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 35.4 t -153.57 -49.42 0.09 Allowed 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 124.916 1.286 . . . . 0.0 112.145 -179.029 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 78.1 mtm -131.16 69.08 1.48 Allowed 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 125.401 1.48 . . . . 0.0 110.556 178.648 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -77.1 74.7 3.67 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 124.836 1.255 . . . . 0.0 110.318 176.376 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 56.27 -170.98 0.08 Allowed 'General case' 0 CA--C 1.554 1.133 0 C-N-CA 126.479 1.912 . . . . 0.0 113.899 -167.887 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -133.53 149.78 51.68 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 126.028 1.731 . . . . 0.0 111.712 178.757 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 23.1 t -94.55 133.07 38.57 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.546 1.139 . . . . 0.0 110.646 170.263 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 25.0 ptp -157.6 170.43 22.42 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 125.169 1.388 . . . . 0.0 112.324 -178.211 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 13.7 t -142.78 158.16 43.91 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 125.147 1.379 . . . . 0.0 111.024 167.234 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 17.3 t-105 . . . . . 0 C--O 1.254 1.298 0 C-N-CA 126.083 1.753 . . . . 0.0 112.637 -168.479 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.57 0 N-CA-C 111.557 -0.617 . . . . 0.0 111.557 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 77.4 p -146.85 158.0 43.8 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 125.065 1.346 . . . . 0.0 112.719 -178.466 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 7.6 m-70 -115.64 161.89 18.02 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 125.993 1.717 . . . . 0.0 111.164 174.918 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 42.0 ttm 53.0 51.72 15.27 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 125.286 1.435 . . . . 0.0 112.943 -177.777 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -151.3 169.16 22.64 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.826 1.25 . . . . 0.0 112.883 -175.141 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 40.9 m -121.67 152.24 39.57 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 125.974 1.71 . . . . 0.0 112.266 -172.704 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 98.8 mmm -108.94 145.75 34.93 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 125.407 1.483 . . . . 0.0 111.437 177.291 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 22.2 m-20 -122.42 102.18 39.79 Favored Pre-proline 0 CA--C 1.547 0.834 0 C-N-CA 125.225 1.41 . . . . 0.0 111.008 177.902 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 65.1 Cg_endo -86.29 2.82 7.18 Favored 'Trans proline' 0 C--N 1.35 0.607 0 C-N-CA 123.66 2.906 . . . . 0.0 114.559 -179.336 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 84.6 mt -111.32 41.69 1.81 Allowed 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 125.449 1.5 . . . . 0.0 113.176 -171.575 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -110.02 1.02 18.72 Favored 'General case' 0 N--CA 1.48 1.031 0 N-CA-C 114.985 1.476 . . . . 0.0 114.985 176.572 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -117.13 -55.51 2.33 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 124.142 0.977 . . . . 0.0 113.418 -168.443 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.9 pp -129.22 12.23 2.61 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 C-N-CA 126.238 1.815 . . . . 0.0 112.996 -171.975 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 11.7 tt -41.98 126.81 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.908 0 C-N-CA 125.569 1.547 . . . . 0.0 113.794 -176.854 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 49.5 t30 -153.93 138.93 17.26 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.497 1.519 . . . . 0.0 110.516 165.515 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 33.5 t0 -152.59 62.07 0.81 Allowed 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.765 1.226 . . . . 0.0 110.204 171.509 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 86.8 mt 54.95 106.57 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.543 0 C-N-CA 128.363 2.665 . . . . 0.0 112.153 -162.013 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 11.6 mmpt? 53.29 34.9 18.83 Favored 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 125.57 1.548 . . . . 0.0 113.438 175.611 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 61.3 mttp 48.95 48.12 20.94 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 126.728 2.011 . . . . 0.0 113.672 -175.481 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -58.95 118.77 6.16 Favored 'General case' 0 CA--C 1.545 0.762 0 O-C-N 121.569 -0.707 . . . . 0.0 111.571 177.126 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -155.54 171.78 19.36 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.857 1.663 . . . . 0.0 111.403 -177.353 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 1.9 t30 -135.71 93.04 2.89 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 124.74 1.216 . . . . 0.0 111.04 -179.078 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 18.8 m-20 -134.85 120.12 18.93 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 125.461 1.504 . . . . 0.0 109.953 174.454 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 37.9 m -137.53 41.21 2.39 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 124.594 1.157 . . . . 0.0 112.918 -167.834 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 79.82 74.11 1.11 Allowed Glycine 0 CA--C 1.531 1.076 0 C-N-CA 124.464 1.031 . . . . 0.0 112.56 -179.313 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 9.9 p -111.62 5.19 8.44 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.108 0 C-N-CA 126.119 1.768 . . . . 0.0 113.853 -170.776 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 3.8 m -106.94 143.75 34.58 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 124.677 1.191 . . . . 0.0 113.06 -162.55 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.584 HD23 ' H ' ' A' ' 22' ' ' LEU . 2.4 pt? -82.97 30.64 0.44 Allowed 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 126.235 1.814 . . . . 0.0 115.303 -178.157 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -143.63 145.88 33.01 Favored Pre-proline 0 CA--C 1.547 0.845 0 C-N-CA 125.311 1.445 . . . . 0.0 112.201 -174.745 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 95.0 Cg_endo -78.19 -39.65 0.43 Allowed 'Trans proline' 0 CA--C 1.538 0.722 0 C-N-CA 122.859 2.373 . . . . 0.0 113.003 -178.251 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 24.3 tp -154.45 56.58 0.7 Allowed 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.202 1.401 . . . . 0.0 110.282 -177.309 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 5.0 t 61.21 176.73 0.11 Allowed 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 124.916 1.286 . . . . 0.0 113.653 -165.374 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 72.7 t 62.35 148.99 0.09 OUTLIER Pre-proline 0 N--CA 1.481 1.096 0 C-N-CA 128.114 2.565 . . . . 0.0 113.062 -172.257 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -67.47 75.16 0.55 Allowed 'Trans proline' 0 CA--C 1.548 1.188 0 C-N-CA 123.357 2.704 . . . . 0.0 112.163 171.3 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 49.9 tptt 50.7 82.09 0.25 Allowed Pre-proline 0 CA--C 1.549 0.925 0 C-N-CA 129.291 3.036 . . . . 0.0 113.638 175.299 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_endo -71.33 130.41 17.38 Favored 'Trans proline' 0 C--N 1.35 0.649 0 C-N-CA 122.982 2.454 . . . . 0.0 113.66 -174.588 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 21.2 ptmt -47.96 147.91 1.88 Allowed 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 127.685 2.394 . . . . 0.0 115.48 -172.595 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 22.5 tp -137.69 148.95 46.12 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 126.255 1.822 . . . . 0.0 111.533 -172.052 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -139.9 74.18 1.46 Allowed 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 125.37 1.468 . . . . 0.0 111.788 174.641 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 25.2 tt0 -126.44 72.8 1.34 Allowed 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 125.291 1.436 . . . . 0.0 112.49 -171.623 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.1 mt -129.43 150.36 50.81 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 126.224 1.81 . . . . 0.0 111.081 179.649 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 23.2 t -73.45 166.34 23.4 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.452 0.701 . . . . 0.0 110.768 169.015 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -56.98 -44.29 82.52 Favored 'General case' 0 N--CA 1.476 0.83 0 O-C-N 120.343 -1.473 . . . . 0.0 113.106 -174.732 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 6.7 pt20 -76.3 -35.88 58.63 Favored 'General case' 0 N--CA 1.47 0.542 0 O-C-N 121.642 -0.661 . . . . 0.0 112.233 175.028 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 92.7 mt-30 -65.35 -38.98 91.75 Favored 'General case' 0 N--CA 1.464 0.271 0 O-C-N 121.595 -0.69 . . . . 0.0 111.21 179.254 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 40.9 ttmt -58.87 -41.44 87.06 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 124.522 1.129 . . . . 0.0 110.814 175.569 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 42.5 mt -71.24 -41.21 74.85 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.638 0 CA-C-O 118.358 -0.829 . . . . 0.0 111.219 177.911 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 37.9 mt -65.15 -41.44 91.77 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.964 0 CA-C-N 120.166 1.348 . . . . 0.0 110.363 177.416 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -60.72 -48.45 81.72 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.541 1.137 . . . . 0.0 110.737 176.763 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -66.04 -50.21 64.96 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 124.472 1.109 . . . . 0.0 112.141 178.608 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -65.56 -22.65 66.72 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 119.222 0.919 . . . . 0.0 113.104 -176.185 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.437 ' CE2' HG22 ' A' ' 55' ' ' ILE . 1.2 t80 -71.58 -58.96 3.02 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.228 1.011 . . . . 0.0 110.834 173.075 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 86.8 mt -63.84 -33.06 59.61 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.451 0 C-N-CA 126.794 2.038 . . . . 0.0 111.598 -179.861 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -71.04 -24.75 62.41 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.076 0.951 . . . . 0.0 112.704 176.234 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -90.78 -38.81 12.76 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.199 0.999 . . . . 0.0 112.517 175.767 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.3 m -110.24 -3.41 10.54 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.111 0 N-CA-C 114.167 1.173 . . . . 0.0 114.167 -173.577 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 85.21 23.11 49.75 Favored Glycine 0 N--CA 1.473 1.112 0 C-N-CA 125.219 1.39 . . . . 0.0 115.457 159.326 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 56.87 6.9 0.35 Allowed 'General case' 0 CA--C 1.554 1.128 0 C-N-CA 127.577 2.351 . . . . 0.0 115.181 -170.335 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 29.2 mt-30 -104.71 -17.69 14.55 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 125.545 1.538 . . . . 0.0 112.977 -173.005 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 44.5 m-80 -123.98 4.17 8.68 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.396 1.078 . . . . 0.0 113.634 -173.543 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.437 HG22 ' CE2' ' A' ' 46' ' ' TYR . 23.1 pt -75.28 155.26 6.22 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 C-N-CA 122.976 0.51 . . . . 0.0 111.291 173.377 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -137.62 142.85 41.23 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 124.487 1.115 . . . . 0.0 110.257 179.106 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -60.7 -27.45 67.89 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.741 0.816 . . . . 0.0 112.227 -179.867 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -65.93 -49.76 74.64 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.484 0 C-N-CA 125.606 1.562 . . . . 0.0 110.125 175.044 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 61.9 m -77.79 -43.41 30.73 Favored 'General case' 0 C--O 1.222 -0.387 0 C-N-CA 123.612 0.765 . . . . 0.0 109.962 -175.642 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 19.8 tp -61.39 -35.11 76.6 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 125.481 1.513 . . . . 0.0 112.171 174.322 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.459 ' HA ' HG13 ' A' ' 66' ' ' ILE . 30.3 t -54.96 -31.65 60.82 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 124.719 1.208 . . . . 0.0 112.513 168.501 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -100.57 -26.9 13.67 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 125.033 1.333 . . . . 0.0 114.162 -174.892 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 64.6 mmtt -61.44 -37.7 84.51 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 125.018 1.327 . . . . 0.0 111.773 174.974 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.2 mp -116.95 6.73 13.06 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 114.146 1.165 . . . . 0.0 114.146 -174.373 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 20.4 m-80 56.56 57.46 4.82 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 126.485 1.914 . . . . 0.0 113.23 -179.046 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.459 HG13 ' HA ' ' A' ' 61' ' ' SER . 1.6 pt -124.76 -170.93 0.67 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.693 0 C-N-CA 126.584 1.954 . . . . 0.0 110.917 -172.753 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.5 p -89.76 159.98 16.77 Favored 'General case' 0 N--CA 1.476 0.862 0 O-C-N 121.311 -0.868 . . . . 0.0 110.921 170.258 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 88.8 t -62.14 -30.18 48.2 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.893 0 C-N-CA 123.187 0.595 . . . . 0.0 111.307 172.641 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -79.73 -36.7 36.99 Favored 'General case' 0 N--CA 1.469 0.492 0 O-C-N 121.001 -1.062 . . . . 0.0 110.514 -179.055 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 4.6 tmtm? -68.08 -44.45 76.26 Favored 'General case' 0 C--O 1.222 -0.362 0 C-N-CA 124.421 1.088 . . . . 0.0 110.715 177.242 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -59.33 -46.87 87.42 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 125.046 1.338 . . . . 0.0 112.752 170.107 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 18.9 ttmm -67.67 -26.69 66.32 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 124.417 1.087 . . . . 0.0 111.523 -176.79 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -51.26 -42.14 60.86 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-N 118.171 0.441 . . . . 0.0 111.216 174.2 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 24.2 m-85 -70.39 -39.71 74.37 Favored 'General case' 0 C--O 1.225 -0.211 0 C-N-CA 124.479 1.111 . . . . 0.0 111.588 -177.474 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 52.6 mt -67.15 -24.79 32.58 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 C-N-CA 125.608 1.563 . . . . 0.0 111.185 179.292 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.428 ' HA ' ' HE2' ' A' ' 76' ' ' LYS . 10.6 mmpt? -95.23 -25.44 16.37 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 125.322 1.449 . . . . 0.0 113.177 178.46 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 42.6 m-20 -80.89 -41.93 22.28 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 125.305 1.442 . . . . 0.0 110.679 174.242 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 50.6 m -123.17 123.32 40.54 Favored 'General case' 0 N--CA 1.465 0.281 0 C-N-CA 123.818 0.847 . . . . 0.0 112.347 174.491 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 6.8 t-20 -148.15 -66.35 0.24 Allowed 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 113.377 0.88 . . . . 0.0 113.377 -171.142 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 23.6 mmt85 -96.49 -13.37 23.11 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 125.366 1.466 . . . . 0.0 113.779 -179.588 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 50.4 tp -87.94 -51.63 5.72 Favored 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 125.156 1.383 . . . . 0.0 113.186 -173.225 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 71.24 -62.2 1.05 Allowed Glycine 0 CA--C 1.539 1.576 0 N-CA-C 115.162 0.825 . . . . 0.0 115.162 -171.599 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 23.5 mmt85 -136.57 154.73 50.61 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 126.141 1.776 . . . . 0.0 112.6 -175.101 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 6.7 t -71.47 -14.5 62.15 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 125.608 1.563 . . . . 0.0 115.037 -174.744 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 71.5 m-80 -100.14 127.01 46.47 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.247 1.019 . . . . 0.0 111.979 -177.726 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 45.5 t30 -151.28 -70.51 0.17 Allowed 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.603 1.161 . . . . 0.0 111.611 169.465 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 12.0 tp -150.77 36.79 0.63 Allowed 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 125.883 1.673 . . . . 0.0 111.672 -177.606 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 39.9 ttpt -84.87 -27.56 26.61 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 125.937 1.695 . . . . 0.0 111.519 -179.065 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 8.9 t -157.41 127.44 6.25 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 126.465 1.906 . . . . 0.0 109.621 175.978 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -142.92 3.64 0.37 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.791 0 C-N-CA 125.645 1.578 . . . . 0.0 113.832 -178.672 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 65.74 12.69 57.45 Favored Glycine 0 CA--C 1.541 1.659 0 O-C-N 120.65 -1.281 . . . . 0.0 114.154 -168.355 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . 0.293 3.0 mp 50.66 33.3 0.2 Allowed 'Isoleucine or valine' 0 CA--C 1.552 1.034 0 C-N-CA 127.559 2.344 . . . . 0.0 112.11 179.245 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 8.0 tp 51.35 26.86 3.29 Favored 'General case' 0 CA--C 1.553 1.077 0 C-N-CA 126.638 1.975 . . . . 0.0 114.761 -179.034 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 6.3 pt20 -121.18 32.2 6.04 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 125.439 1.496 . . . . 0.0 113.397 -172.802 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 17.3 mm-40 -70.65 -21.97 62.55 Favored 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 114.083 1.142 . . . . 0.0 114.083 -175.192 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -143.41 79.9 1.65 Allowed 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 124.579 1.152 . . . . 0.0 111.2 178.614 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 11.6 p -151.1 154.77 7.95 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.715 0 C-N-CA 125.71 1.604 . . . . 0.0 110.578 177.099 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 25.5 m 63.76 -39.42 0.2 Allowed 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 128.301 2.64 . . . . 0.0 116.909 -179.333 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 49.8 m -86.01 -19.56 30.16 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.738 1.215 . . . . 0.0 114.122 -177.547 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 13.5 ttt -144.57 28.99 1.28 Allowed 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.986 1.315 . . . . 0.0 112.458 -177.731 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -83.54 59.68 5.25 Favored 'General case' 0 CA--C 1.55 0.943 0 C-N-CA 124.881 1.273 . . . . 0.0 111.624 -174.75 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -152.02 165.1 35.71 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 125.841 1.656 . . . . 0.0 112.442 -177.628 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 36.4 mtmm -128.56 151.73 49.11 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 125.848 1.659 . . . . 0.0 111.539 171.569 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 61.0 m -136.22 145.92 46.2 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 125.748 1.619 . . . . 0.0 111.003 178.228 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 64.5 mtm -139.56 165.5 27.08 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 125.589 1.556 . . . . 0.0 112.084 -174.955 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 12.2 t -137.09 162.72 32.59 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 125.386 1.474 . . . . 0.0 112.03 175.631 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 44.4 t-105 . . . . . 0 C--O 1.254 1.325 0 C-N-CA 126.126 1.771 . . . . 0.0 112.791 -168.509 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.606 0 N-CA-C 112.197 -0.361 . . . . 0.0 112.197 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 27.9 m -125.83 27.16 6.46 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 125.102 1.361 . . . . 0.0 113.53 -171.165 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 25.3 t60 -111.24 126.25 54.68 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 125.238 1.415 . . . . 0.0 111.699 -176.689 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 26.6 ttt -155.21 137.28 14.65 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 125.09 1.356 . . . . 0.0 111.336 -176.953 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -151.44 159.55 44.16 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 113.822 1.045 . . . . 0.0 113.822 175.937 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 86.8 p -153.43 154.79 35.1 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 125.769 1.628 . . . . 0.0 112.028 -178.3 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 60.6 mtt -143.74 63.41 1.35 Allowed 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 125.253 1.421 . . . . 0.0 111.231 -175.972 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -130.09 110.03 16.78 Favored Pre-proline 0 CA--C 1.55 0.949 0 C-N-CA 124.75 1.22 . . . . 0.0 111.79 -173.726 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 69.3 Cg_endo -85.28 -8.52 8.69 Favored 'Trans proline' 0 C--N 1.352 0.741 0 C-N-CA 123.51 2.807 . . . . 0.0 115.179 -176.609 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 96.6 mt -111.92 48.65 0.95 Allowed 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 126.261 1.825 . . . . 0.0 111.183 -177.757 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -118.29 1.52 11.86 Favored 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 114.26 1.208 . . . . 0.0 114.26 -179.836 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -119.12 -55.84 2.13 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 124.673 1.189 . . . . 0.0 112.879 -168.402 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.1 pp -128.98 14.32 2.72 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 C-N-CA 126.414 1.886 . . . . 0.0 112.762 -173.741 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 7.7 tt -46.54 105.31 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.1 0 C-N-CA 125.346 1.458 . . . . 0.0 112.4 179.79 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -154.71 -3.29 0.16 Allowed 'General case' 0 N--CA 1.478 0.929 0 N-CA-C 114.519 1.303 . . . . 0.0 114.519 -177.406 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -84.62 12.12 7.65 Favored 'General case' 0 CA--C 1.546 0.796 0 N-CA-C 115.157 1.54 . . . . 0.0 115.157 -162.383 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 7.1 tp -147.01 29.29 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 C-N-CA 125.73 1.612 . . . . 0.0 113.32 -173.707 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 2.3 tppp? -121.09 -46.78 2.3 Favored 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 114.824 1.416 . . . . 0.0 114.824 -179.085 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 95.2 mttt 44.58 45.34 7.83 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 126.267 1.827 . . . . 0.0 114.247 -173.473 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -106.0 132.69 51.79 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.707 1.203 . . . . 0.0 111.882 179.578 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -154.64 172.03 18.53 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 125.643 1.577 . . . . 0.0 111.967 177.083 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 62.8 t30 -144.04 158.18 43.87 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 125.569 1.547 . . . . 0.0 111.035 174.02 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 56.6 t0 -145.24 106.92 4.25 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.768 1.227 . . . . 0.0 110.975 178.224 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 74.2 m -133.18 103.53 6.05 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 125.399 1.48 . . . . 0.0 110.757 -179.167 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 147.51 -20.43 1.5 Allowed Glycine 0 N--CA 1.475 1.261 0 C-N-CA 124.635 1.112 . . . . 0.0 115.309 171.253 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 7.1 p -139.71 124.08 19.56 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 C-N-CA 125.171 1.388 . . . . 0.0 110.633 174.728 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -157.21 157.85 35.11 Favored 'General case' 0 N--CA 1.478 0.972 0 N-CA-C 113.955 1.094 . . . . 0.0 113.955 178.479 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.429 HD23 ' H ' ' A' ' 22' ' ' LEU . 1.0 OUTLIER -83.02 32.49 0.44 Allowed 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 126.618 1.967 . . . . 0.0 114.78 -179.207 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -119.79 91.53 45.26 Favored Pre-proline 0 CA--C 1.546 0.816 0 C-N-CA 124.49 1.116 . . . . 0.0 112.541 -166.833 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo -77.18 -35.08 1.85 Allowed 'Trans proline' 0 CA--C 1.541 0.832 0 C-N-CA 122.298 1.999 . . . . 0.0 113.784 -178.168 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 1.8 tt -153.83 68.98 0.78 Allowed 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 124.587 1.155 . . . . 0.0 111.117 -175.558 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 1.8 t 53.65 39.44 30.17 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 125.287 1.435 . . . . 0.0 114.662 177.448 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 7.4 p -154.93 142.89 14.24 Favored Pre-proline 0 N--CA 1.475 0.782 0 C-N-CA 125.796 1.639 . . . . 0.0 109.839 -175.088 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -77.37 66.11 7.92 Favored 'Trans proline' 0 CA--C 1.547 1.149 0 C-N-CA 123.607 2.871 . . . . 0.0 111.568 176.931 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 41.5 tptt 60.1 123.1 0.02 OUTLIER Pre-proline 0 N--CA 1.478 0.973 0 C-N-CA 130.061 3.344 . . . . 0.0 114.892 -172.151 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 93.1 Cg_endo -76.27 147.24 29.14 Favored 'Trans proline' 0 CA--C 1.54 0.792 0 C-N-CA 122.791 2.327 . . . . 0.0 111.826 177.059 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 9.7 mtpm? -74.0 139.55 44.86 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.562 1.145 . . . . 0.0 111.313 177.834 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 5.0 tp -143.51 129.4 19.46 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 126.171 1.788 . . . . 0.0 109.549 -176.595 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -141.41 61.22 1.48 Allowed 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.533 1.133 . . . . 0.0 110.66 -174.138 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -124.07 80.47 1.82 Allowed 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.957 1.303 . . . . 0.0 113.059 -170.924 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 49.7 mt -126.55 157.0 39.93 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 127.1 2.16 . . . . 0.0 111.045 175.736 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 70.7 m -72.98 164.8 26.14 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 122.891 0.476 . . . . 0.0 110.255 169.794 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -55.21 -44.2 75.18 Favored 'General case' 0 N--CA 1.478 0.932 0 O-C-N 120.76 -1.213 . . . . 0.0 112.797 -176.261 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 12.8 tt0 -69.7 -42.92 73.41 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 123.552 0.741 . . . . 0.0 111.19 176.187 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 83.9 mt-30 -63.71 -39.0 93.2 Favored 'General case' 0 CA--C 1.536 0.42 0 O-C-N 121.659 -0.65 . . . . 0.0 112.12 179.183 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -61.21 -40.11 92.77 Favored 'General case' 0 N--CA 1.468 0.475 0 O-C-N 121.06 -1.025 . . . . 0.0 110.903 173.719 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 51.6 mt -69.62 -39.51 78.36 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 CA-C-O 117.789 -1.101 . . . . 0.0 111.704 175.817 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 47.3 mt -64.03 -43.28 97.53 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.947 0 CA-C-N 121.01 1.732 . . . . 0.0 110.285 176.814 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -59.5 -47.49 85.3 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.056 0.943 . . . . 0.0 110.885 176.795 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -69.44 -49.17 57.51 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 124.335 1.054 . . . . 0.0 112.86 -179.714 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -64.29 -23.14 67.19 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-N 118.91 0.777 . . . . 0.0 112.96 -176.646 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.445 ' CE2' HG22 ' A' ' 55' ' ' ILE . 1.4 t80 -69.4 -59.55 2.92 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 124.206 1.002 . . . . 0.0 110.72 174.309 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 50.5 mt -60.74 -34.28 58.37 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.436 0 C-N-CA 125.309 1.444 . . . . 0.0 111.492 176.95 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -67.07 -21.04 65.91 Favored 'General case' 0 CA--C 1.546 0.807 0 O-C-N 121.269 -0.895 . . . . 0.0 113.271 176.379 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -98.03 -31.27 12.23 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 124.748 1.219 . . . . 0.0 113.309 178.308 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 5.9 m -122.36 -19.21 4.36 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 N-CA-C 114.139 1.163 . . . . 0.0 114.139 -173.857 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 83.43 147.1 7.21 Favored Glycine 0 CA--C 1.532 1.096 0 C-N-CA 124.964 1.269 . . . . 0.0 112.864 -172.128 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 12.3 tp -61.63 -13.25 20.66 Favored 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 125.244 1.418 . . . . 0.0 113.81 -175.05 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 7.6 pt20 -87.8 -16.26 34.62 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 127.143 2.177 . . . . 0.0 114.134 179.437 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 76.1 m-80 -111.15 -11.66 14.22 Favored 'General case' 0 N--CA 1.476 0.858 0 N-CA-C 114.513 1.301 . . . . 0.0 114.513 -178.138 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.445 HG22 ' CE2' ' A' ' 46' ' ' TYR . 43.8 pt -67.92 156.87 6.64 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.614 0 C-N-CA 123.83 0.852 . . . . 0.0 111.722 168.856 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.2 p -131.21 142.24 50.15 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 125.704 1.602 . . . . 0.0 109.645 174.215 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -63.17 -25.81 68.52 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 123.769 0.828 . . . . 0.0 112.27 177.573 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.9 mp -63.29 -49.61 82.31 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 C-N-CA 125.124 1.37 . . . . 0.0 109.601 173.055 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 97.2 m -75.26 -41.7 56.77 Favored 'General case' 0 C--O 1.224 -0.289 0 C-N-CA 123.929 0.892 . . . . 0.0 110.749 -177.846 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.9 tt -67.03 -32.63 73.97 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 124.627 1.171 . . . . 0.0 111.954 177.825 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.453 ' HA ' HG13 ' A' ' 66' ' ' ILE . 44.5 t -53.98 -33.33 56.73 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 124.791 1.236 . . . . 0.0 113.034 165.455 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -97.87 -22.79 16.16 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 125.071 1.348 . . . . 0.0 113.667 -175.166 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 7.9 mmtm -69.04 -37.95 78.86 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 124.792 1.237 . . . . 0.0 111.386 175.924 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.4 mp -107.52 -0.98 21.76 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 125.14 1.376 . . . . 0.0 114.057 -175.577 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 16.7 m-80 57.89 48.13 14.03 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 126.133 1.773 . . . . 0.0 112.603 -175.041 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.453 HG13 ' HA ' ' A' ' 61' ' ' SER . 15.3 pt -111.98 -159.19 0.14 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.632 0 C-N-CA 125.964 1.706 . . . . 0.0 110.992 -177.078 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 44.6 p -100.79 161.04 13.87 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 124.649 1.179 . . . . 0.0 111.323 168.084 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 59.6 t -61.59 -24.31 33.47 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 O-C-N 121.58 -0.7 . . . . 0.0 111.059 169.34 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -78.18 -37.02 46.73 Favored 'General case' 0 C--O 1.232 0.166 0 O-C-N 120.901 -1.124 . . . . 0.0 110.246 -178.15 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 33.5 mttm -64.71 -52.86 54.91 Favored 'General case' 0 C--N 1.347 0.498 0 CA-C-N 118.888 0.767 . . . . 0.0 110.568 167.395 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -58.99 -37.55 77.11 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.012 0.925 . . . . 0.0 112.773 -172.13 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 23.7 ttmm -77.57 -31.02 52.88 Favored 'General case' 0 CA--C 1.522 -0.123 0 C-N-CA 125.444 1.498 . . . . 0.0 111.889 177.777 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -57.09 -42.38 80.6 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 119.037 0.835 . . . . 0.0 111.531 179.596 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 39.3 m-85 -61.93 -51.5 67.88 Favored 'General case' 0 C--O 1.222 -0.389 0 C-N-CA 124.451 1.101 . . . . 0.0 109.641 178.481 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 71.3 mt -62.27 -25.07 36.69 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.875 0 C-N-CA 124.475 1.11 . . . . 0.0 111.517 -179.363 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 13.1 tppt? -87.48 -27.29 22.75 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 126.498 1.919 . . . . 0.0 113.28 -179.385 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 31.6 p30 -103.66 -33.87 8.81 Favored 'General case' 0 CA--C 1.546 0.825 0 CA-C-N 119.897 1.226 . . . . 0.0 113.401 177.88 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 11.8 p -83.67 -6.47 59.45 Favored 'General case' 0 N--CA 1.478 0.931 0 N-CA-C 115.545 1.683 . . . . 0.0 115.545 -171.086 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 24.8 p30 -67.3 9.13 0.24 Allowed 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 117.086 2.254 . . . . 0.0 117.086 -168.805 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 19.8 mmt85 -104.38 -3.5 24.03 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 125.958 1.703 . . . . 0.0 113.803 172.737 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -94.24 -47.36 6.66 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 124.858 1.263 . . . . 0.0 112.081 -177.816 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -88.55 159.47 29.51 Favored Glycine 0 CA--C 1.536 1.352 0 C-N-CA 124.346 0.974 . . . . 0.0 112.933 171.293 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER 64.85 33.4 10.11 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 126.061 1.744 . . . . 0.0 115.283 179.687 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 1.9 t -165.73 69.13 0.13 Allowed 'General case' 0 N--CA 1.478 0.965 0 CA-C-O 123.058 1.409 . . . . 0.0 109.906 179.48 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 66.1 m-80 -138.86 141.2 38.64 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 125.352 1.461 . . . . 0.0 110.451 176.605 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 22.6 t-20 -128.71 -16.03 4.31 Favored 'General case' 0 CA--C 1.547 0.844 0 N-CA-C 114.435 1.272 . . . . 0.0 114.435 -171.631 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 6.6 tp -137.9 30.44 2.52 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 124.07 0.948 . . . . 0.0 112.394 -163.824 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 60.6 tttp -83.91 -24.86 30.59 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 126.262 1.825 . . . . 0.0 111.63 -179.983 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 9.9 t -156.55 127.9 7.04 Favored 'General case' 0 C--O 1.234 0.245 0 C-N-CA 125.939 1.695 . . . . 0.0 109.732 173.976 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -142.68 2.03 0.39 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.788 0 C-N-CA 125.46 1.504 . . . . 0.0 114.014 -178.829 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 69.67 11.22 65.29 Favored Glycine 0 CA--C 1.539 1.563 0 O-C-N 120.797 -1.19 . . . . 0.0 114.627 -170.202 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . 0.267 4.2 mp 51.88 41.8 0.35 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.979 0 C-N-CA 126.814 2.046 . . . . 0.0 111.614 174.668 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 9.0 tp 52.91 24.56 3.42 Favored 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 126.632 1.973 . . . . 0.0 114.864 -179.406 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 34.4 mt-30 -133.99 55.83 1.88 Allowed 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.939 1.695 . . . . 0.0 111.479 -173.253 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -93.01 108.43 20.0 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.336 1.054 . . . . 0.0 110.302 172.835 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -133.62 65.22 1.59 Allowed 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 125.096 1.358 . . . . 0.0 111.307 -173.933 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 94.6 t -132.28 143.68 39.24 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.687 0 C-N-CA 125.061 1.344 . . . . 0.0 111.227 -179.569 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 82.8 p -147.4 -53.64 0.21 Allowed 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 173.138 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 22.6 t -149.99 113.32 4.93 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 124.634 1.173 . . . . 0.0 111.322 177.33 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 54.2 mtt 55.0 24.39 5.91 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 126.041 1.737 . . . . 0.0 115.145 -178.089 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 -82.62 67.48 8.69 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 125.33 1.452 . . . . 0.0 111.329 179.291 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -140.12 159.58 41.87 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 125.391 1.476 . . . . 0.0 112.6 -178.217 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -133.34 150.65 51.84 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 125.92 1.688 . . . . 0.0 111.993 177.901 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 51.1 m -83.6 164.42 19.75 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 125.014 1.326 . . . . 0.0 112.211 172.54 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 7.3 ttp -137.55 -175.79 4.19 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 125.421 1.489 . . . . 0.0 111.202 176.186 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 23.0 m -113.34 146.24 39.76 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 125.317 1.447 . . . . 0.0 110.872 179.71 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 27.6 m-90 . . . . . 0 C--O 1.252 1.203 0 C-N-CA 126.11 1.764 . . . . 0.0 112.372 -179.729 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.472 0 N-CA-C 111.451 -0.659 . . . . 0.0 111.451 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 49.0 m -98.47 153.02 18.91 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.937 1.295 . . . . 0.0 112.499 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 11.3 m-70 60.09 157.85 0.03 OUTLIER 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 127.028 2.131 . . . . 0.0 114.937 -168.983 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 9.9 tpt -88.0 60.17 5.7 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 124.895 1.278 . . . . 0.0 112.189 -173.552 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -146.19 157.81 43.84 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.838 1.255 . . . . 0.0 113.239 -177.721 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 20.1 t -153.3 160.5 42.73 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 126.082 1.753 . . . . 0.0 110.939 175.551 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -136.24 59.52 1.7 Allowed 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 124.882 1.273 . . . . 0.0 111.802 179.94 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 59.6 m-20 47.15 70.71 1.92 Allowed Pre-proline 0 CA--C 1.551 1.007 0 C-N-CA 127.006 2.122 . . . . 0.0 114.59 171.828 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 88.8 Cg_endo -69.35 0.39 5.4 Favored 'Trans proline' 0 CA--C 1.542 0.893 0 C-N-CA 124.21 3.274 . . . . 0.0 115.455 -173.634 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -134.93 33.14 3.17 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 126.408 1.883 . . . . 0.0 113.626 -178.65 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -99.58 -2.08 36.59 Favored 'General case' 0 N--CA 1.477 0.898 0 N-CA-C 114.407 1.262 . . . . 0.0 114.407 172.855 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -131.5 -60.78 0.93 Allowed 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 124.782 1.233 . . . . 0.0 113.458 -160.361 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.8 pp -106.45 9.66 9.35 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 C-N-CA 125.609 1.564 . . . . 0.0 112.937 -178.55 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 19.2 tt -46.11 129.06 2.45 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 124.632 1.173 . . . . 0.0 112.854 175.967 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -151.48 49.67 0.82 Allowed 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 125.683 1.593 . . . . 0.0 109.935 -179.646 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -115.71 15.56 16.46 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 124.347 1.059 . . . . 0.0 112.84 -170.378 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 15.9 tt -159.23 40.25 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 C-N-CA 126.692 1.997 . . . . 0.0 112.272 -175.815 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -139.92 -42.59 0.43 Allowed 'General case' 0 N--CA 1.476 0.85 0 N-CA-C 115.914 1.82 . . . . 0.0 115.914 -170.574 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 48.5 tttm -133.7 37.96 3.26 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 125.588 1.555 . . . . 0.0 112.624 -166.106 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -129.23 156.76 43.45 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 125.329 1.452 . . . . 0.0 112.95 -172.93 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -94.62 174.86 6.91 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 125.359 1.464 . . . . 0.0 113.405 179.081 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 28.4 m120 -129.26 67.52 1.43 Allowed 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.912 1.685 . . . . 0.0 111.511 -172.496 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 36.0 m-20 -85.24 39.95 0.8 Allowed 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 125.251 1.421 . . . . 0.0 113.554 -177.805 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 38.0 m -80.45 71.37 7.28 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.662 1.185 . . . . 0.0 112.816 -172.325 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 90.05 91.97 1.23 Allowed Glycine 0 CA--C 1.531 1.04 0 C-N-CA 125.693 1.615 . . . . 0.0 112.494 -178.255 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 12.8 p -146.95 137.05 17.21 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 C-N-CA 125.522 1.529 . . . . 0.0 111.073 178.358 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 10.9 m 63.11 164.01 0.11 Allowed 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 126.631 1.972 . . . . 0.0 114.568 -179.83 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -124.61 32.5 5.45 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 126.325 1.85 . . . . 0.0 114.235 -176.876 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -90.89 134.94 29.41 Favored Pre-proline 0 CA--C 1.549 0.934 0 C-N-CA 125.062 1.345 . . . . 0.0 112.339 -177.873 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -76.75 -27.73 7.03 Favored 'Trans proline' 0 CA--C 1.542 0.893 0 C-N-CA 122.953 2.435 . . . . 0.0 112.631 173.756 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 65.2 tp -149.04 -59.19 0.22 Allowed 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 125.268 1.427 . . . . 0.0 111.75 173.881 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 87.1 p -152.79 149.43 28.32 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 126.992 2.117 . . . . 0.0 110.466 178.942 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 62.6 t 59.88 144.74 0.06 OUTLIER Pre-proline 0 N--CA 1.484 1.246 0 C-N-CA 126.803 2.041 . . . . 0.0 112.155 -160.923 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 69.2 Cg_endo -68.24 75.64 0.71 Allowed 'Trans proline' 0 CA--C 1.545 1.06 0 C-N-CA 123.524 2.816 . . . . 0.0 111.907 175.234 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 57.44 90.64 0.09 OUTLIER Pre-proline 0 N--CA 1.475 0.783 0 C-N-CA 128.942 2.897 . . . . 0.0 112.555 -175.961 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo -79.11 137.76 13.85 Favored 'Trans proline' 0 CA--C 1.541 0.853 0 C-N-CA 122.644 2.229 . . . . 0.0 111.273 169.086 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 49.1 mtmt -69.71 117.41 11.28 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 123.79 0.836 . . . . 0.0 111.307 175.598 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.5 pp -148.47 149.31 31.45 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 125.537 1.535 . . . . 0.0 112.37 179.156 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 58.2 mt-10 -146.67 77.6 1.47 Allowed 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 125.725 1.61 . . . . 0.0 110.289 174.178 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -118.42 111.04 18.17 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.917 1.287 . . . . 0.0 111.988 -174.795 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 62.8 mt -141.71 161.79 37.07 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 127.364 2.266 . . . . 0.0 112.015 -178.878 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 66.0 m -71.33 164.3 26.01 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 123.295 0.638 . . . . 0.0 110.491 170.889 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -56.6 -44.72 81.4 Favored 'General case' 0 N--CA 1.477 0.901 0 O-C-N 120.633 -1.292 . . . . 0.0 112.974 -174.669 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 10.7 tt0 -68.82 -43.1 76.24 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 123.763 0.825 . . . . 0.0 110.989 175.752 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 85.0 mt-30 -61.13 -42.44 98.54 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 122.914 0.486 . . . . 0.0 111.968 178.349 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 40.1 ttmt -59.94 -39.07 84.26 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 124.073 0.949 . . . . 0.0 111.232 176.139 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 45.2 mt -68.26 -41.83 84.1 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 CA-C-O 118.121 -0.942 . . . . 0.0 111.386 174.386 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 48.3 mt -64.3 -44.66 97.32 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.982 0 CA-C-N 120.777 1.626 . . . . 0.0 110.48 178.555 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -56.02 -49.41 73.75 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 124.799 1.24 . . . . 0.0 110.195 176.54 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -65.52 -52.34 53.37 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.177 0.991 . . . . 0.0 113.024 178.185 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 19.6 mm-40 -62.24 -26.95 68.66 Favored 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 112.925 0.713 . . . . 0.0 112.925 -179.137 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -70.38 -55.28 9.48 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 123.576 0.751 . . . . 0.0 111.126 175.875 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 44.6 mt -60.57 -35.11 61.24 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.553 0 C-N-CA 124.958 1.303 . . . . 0.0 111.48 175.571 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -68.51 -21.46 64.58 Favored 'General case' 0 CA--C 1.545 0.765 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 176.761 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -95.92 -30.2 13.76 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.666 1.187 . . . . 0.0 113.029 178.963 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 6.0 m -122.27 -25.21 2.3 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.003 0 CA-C-N 119.651 1.114 . . . . 0.0 113.946 -173.966 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 94.07 142.38 12.19 Favored Glycine 0 CA--C 1.533 1.21 0 C-N-CA 125.303 1.43 . . . . 0.0 113.213 -172.694 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 55.0 tp -60.03 -16.85 34.43 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 127.046 2.139 . . . . 0.0 115.503 -171.879 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 7.9 pm0 -99.05 -10.15 22.97 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 127.732 2.413 . . . . 0.0 113.825 179.74 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 80.9 m-20 -107.18 -14.29 14.94 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.86 1.264 . . . . 0.0 114.111 178.907 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 26.5 pt -63.27 157.14 4.39 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 C-N-CA 123.267 0.627 . . . . 0.0 111.276 164.679 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -130.09 145.93 51.72 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.523 1.129 . . . . 0.0 110.035 175.28 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -61.73 -26.82 68.29 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 123.773 0.829 . . . . 0.0 112.271 177.288 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.9 mp -69.99 -40.08 78.18 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.454 0 C-N-CA 125.993 1.717 . . . . 0.0 110.519 175.857 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 90.8 m -80.78 -41.31 23.63 Favored 'General case' 0 C--O 1.223 -0.292 0 O-C-N 121.64 -0.663 . . . . 0.0 109.522 179.209 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 17.0 tp -64.77 -35.65 81.78 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 125.014 1.326 . . . . 0.0 111.946 177.026 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.441 ' HA ' HG13 ' A' ' 66' ' ' ILE . 60.2 p -60.38 -24.62 65.26 Favored 'General case' 0 N--CA 1.476 0.841 0 CA-C-N 118.893 0.77 . . . . 0.0 113.006 170.449 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -100.94 -31.03 11.32 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 125.3 1.44 . . . . 0.0 114.107 -177.119 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 54.9 mmtt -63.76 -34.51 78.06 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 125.331 1.452 . . . . 0.0 111.582 177.875 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.4 mp -117.67 4.23 12.33 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 124.987 1.315 . . . . 0.0 114.415 -175.165 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 21.6 m-80 57.58 60.96 2.62 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 126.276 1.831 . . . . 0.0 113.375 -178.591 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.441 HG13 ' HA ' ' A' ' 61' ' ' SER . 1.1 pt -133.48 174.8 12.64 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.843 0 C-N-CA 126.771 2.028 . . . . 0.0 111.946 -171.536 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.3 p -76.72 157.9 31.36 Favored 'General case' 0 N--CA 1.478 0.945 0 O-C-N 121.096 -1.003 . . . . 0.0 111.352 173.082 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 89.5 t -62.92 -28.47 45.09 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 CA-C-O 118.838 -0.601 . . . . 0.0 111.421 173.637 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 65.3 mm-40 -81.75 -36.62 28.34 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 120.307 1.412 . . . . 0.0 110.825 -178.872 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 5.2 tmtm? -62.6 -44.67 95.73 Favored 'General case' 0 N--CA 1.464 0.268 0 C-N-CA 125.456 1.503 . . . . 0.0 110.348 175.249 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -66.25 -48.74 69.51 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.989 1.716 . . . . 0.0 112.757 173.927 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -71.12 -27.95 63.95 Favored 'General case' 0 CA--C 1.515 -0.376 0 O-C-N 120.976 -1.077 . . . . 0.0 111.673 -173.388 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -60.59 -36.6 78.93 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 119.929 -0.708 . . . . 0.0 111.306 178.029 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 23.9 m-85 -61.28 -41.22 96.6 Favored 'General case' 0 N--CA 1.463 0.2 0 O-C-N 121.312 -0.867 . . . . 0.0 111.742 174.063 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 61.1 mt -70.44 -29.12 37.51 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.643 0 C-N-CA 124.683 1.193 . . . . 0.0 110.903 179.598 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 7.3 tptm -76.49 -35.16 58.54 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 125.169 1.388 . . . . 0.0 111.862 174.707 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 96.0 m-20 -85.14 -53.43 5.27 Favored 'General case' 0 N--CA 1.462 0.153 0 C-N-CA 126.405 1.882 . . . . 0.0 110.338 -172.775 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 61.2 m -99.43 107.67 19.95 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 124.96 1.304 . . . . 0.0 111.317 172.177 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 5.0 t-20 -144.34 119.97 10.45 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.133 0.973 . . . . 0.0 111.015 -171.001 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 7.1 mpt_? 55.72 -23.33 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.706 0 C-N-CA 128.327 2.651 . . . . 0.0 117.259 -169.052 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 6.9 tt -86.99 -39.97 15.19 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 126.545 1.938 . . . . 0.0 112.765 -172.32 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 70.07 -133.29 24.35 Favored Glycine 0 CA--C 1.531 1.085 0 C-N-CA 123.362 0.506 . . . . 0.0 112.46 -175.501 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.08 -56.63 4.1 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.826 0.85 . . . . 0.0 109.133 174.663 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 1.7 t -169.0 124.7 0.9 Allowed 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 126.005 1.722 . . . . 0.0 109.664 172.417 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 52.1 m-80 -138.79 151.77 47.34 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 124.935 1.294 . . . . 0.0 111.935 178.928 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 53.5 t30 -147.18 174.11 11.9 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 126.233 1.813 . . . . 0.0 110.486 -177.653 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 8.6 tp 60.02 28.59 18.15 Favored 'General case' 0 CA--C 1.551 0.986 0 C-N-CA 125.329 1.451 . . . . 0.0 113.85 179.29 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 20.0 ptmt -129.21 2.52 5.18 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 126.027 1.731 . . . . 0.0 114.68 -176.939 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 12.6 t -156.76 131.15 8.63 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 125.41 1.484 . . . . 0.0 109.966 -179.629 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -136.69 6.17 0.85 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.812 0 C-N-CA 126.358 1.863 . . . . 0.0 112.906 179.15 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 66.52 7.25 39.34 Favored Glycine 0 CA--C 1.539 1.581 0 O-C-N 120.792 -1.192 . . . . 0.0 114.709 -170.689 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 13.7 mm 52.19 36.6 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.008 0 C-N-CA 126.894 2.078 . . . . 0.0 111.623 178.062 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 54.66 25.36 6.33 Favored 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 127.004 2.121 . . . . 0.0 114.601 179.914 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 37.2 mt-30 -133.67 23.31 3.98 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 125.988 1.715 . . . . 0.0 112.626 -172.463 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -138.6 142.83 39.15 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 125.459 1.504 . . . . 0.0 111.403 -178.636 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 54.18 65.82 1.4 Allowed 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 126.094 1.758 . . . . 0.0 113.594 -179.225 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 21.0 t -130.17 72.49 0.43 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 C-N-CA 125.166 1.387 . . . . 0.0 110.428 179.272 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 45.4 t -163.82 -68.32 0.04 OUTLIER 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.766 0.826 . . . . 0.0 113.013 172.638 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 17.1 t -74.05 -31.92 63.09 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 123.611 0.765 . . . . 0.0 112.786 -175.403 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 97.2 mtp -127.29 137.25 52.8 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 125.949 1.7 . . . . 0.0 109.556 169.524 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 17.7 tt0 -153.85 41.66 0.52 Allowed 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 124.616 1.166 . . . . 0.0 111.046 -177.317 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 52.41 -141.87 0.8 Allowed 'General case' 0 CA--C 1.552 1.045 0 C-N-CA 125.233 1.413 . . . . 0.0 112.253 -165.694 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 66.9 mttm -123.37 154.42 38.99 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 125.777 1.631 . . . . 0.0 111.512 177.294 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 49.1 m -121.77 156.73 32.54 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 125.566 1.546 . . . . 0.0 112.407 -176.486 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 1.8 pmm? -142.29 161.39 38.15 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 125.583 1.553 . . . . 0.0 112.317 177.117 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 3.6 m -142.89 144.27 32.39 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 124.867 1.267 . . . . 0.0 110.371 172.453 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 8.1 t-105 . . . . . 0 C--O 1.253 1.276 0 C-N-CA 125.23 1.412 . . . . 0.0 112.716 -174.216 . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.574 0 N-CA-C 111.893 -0.483 . . . . 0.0 111.893 . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 19.6 m -66.93 -35.4 79.9 Favored 'General case' 0 N--CA 1.477 0.923 0 N-CA-C 114.639 1.348 . . . . 0.0 114.639 -169.245 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 28.3 t60 -151.96 105.7 3.12 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 124.745 1.218 . . . . 0.0 110.571 178.666 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 35.1 ttp -148.18 40.74 0.96 Allowed 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 124.16 0.984 . . . . 0.0 113.0 -177.769 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -154.75 148.35 25.31 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 113.066 0.765 . . . . 0.0 113.066 -178.593 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 30.4 t -156.46 130.69 8.64 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 125.401 1.48 . . . . 0.0 110.641 175.242 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 16.9 ttt -151.21 19.83 0.76 Allowed 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 124.636 1.174 . . . . 0.0 112.716 -177.046 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 11.6 t0 -138.97 121.68 10.56 Favored Pre-proline 0 CA--C 1.55 0.981 0 O-C-N 120.626 -1.296 . . . . 0.0 112.344 -170.053 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_endo -83.83 -2.32 10.26 Favored 'Trans proline' 0 C--N 1.352 0.726 0 C-N-CA 123.768 2.979 . . . . 0.0 114.971 179.054 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 75.7 mt -107.54 41.59 1.48 Allowed 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.867 1.667 . . . . 0.0 112.173 -176.82 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -106.91 0.83 24.13 Favored 'General case' 0 N--CA 1.476 0.873 0 N-CA-C 114.779 1.4 . . . . 0.0 114.779 178.345 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -120.05 -56.87 1.98 Allowed 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 124.396 1.079 . . . . 0.0 113.328 -167.975 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.0 pp -129.1 14.7 2.67 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.925 0 C-N-CA 126.176 1.791 . . . . 0.0 112.988 -171.888 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 14.1 tt -41.08 130.4 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.917 0 C-N-CA 125.496 1.518 . . . . 0.0 112.851 177.824 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 35.3 t30 -141.71 0.63 1.45 Allowed 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 115.332 1.604 . . . . 0.0 115.332 -176.881 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -85.1 11.25 10.08 Favored 'General case' 0 CA--C 1.546 0.805 0 N-CA-C 114.601 1.334 . . . . 0.0 114.601 -173.777 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 13.5 tt -147.97 27.17 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.913 0 C-N-CA 125.533 1.533 . . . . 0.0 113.694 -170.989 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 58.5 mtmt -122.98 -40.62 2.4 Favored 'General case' 0 N--CA 1.477 0.909 0 N-CA-C 115.311 1.597 . . . . 0.0 115.311 179.392 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 22.0 ttmm -146.75 144.74 29.61 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 125.126 1.37 . . . . 0.0 112.358 -177.755 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -109.75 60.47 0.6 Allowed 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 125.823 1.649 . . . . 0.0 110.869 179.224 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -127.43 7.29 6.38 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 125.06 1.344 . . . . 0.0 114.281 -175.393 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.5 t-20 -97.67 116.1 29.23 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 124.543 1.137 . . . . 0.0 111.645 -177.327 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 20.2 m-20 -144.69 134.61 23.81 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 125.918 1.687 . . . . 0.0 110.483 176.645 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 21.4 t -152.47 101.33 2.65 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 124.145 0.978 . . . . 0.0 111.081 173.652 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 69.37 35.09 75.5 Favored Glycine 0 N--CA 1.473 1.108 0 C-N-CA 124.543 1.068 . . . . 0.0 115.742 171.395 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 92.9 t -88.86 142.73 12.47 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.385 0 C-N-CA 125.101 1.361 . . . . 0.0 110.985 -177.863 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 2.8 t -130.38 -177.24 4.24 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 125.649 1.58 . . . . 0.0 111.809 174.503 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -74.95 25.01 0.09 Allowed 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 116.895 2.183 . . . . 0.0 116.895 -173.885 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -90.37 131.09 39.43 Favored Pre-proline 0 CA--C 1.55 0.953 0 C-N-CA 126.126 1.77 . . . . 0.0 112.512 -172.163 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -79.27 -38.69 0.39 Allowed 'Trans proline' 0 CA--C 1.541 0.84 0 C-N-CA 122.629 2.219 . . . . 0.0 112.885 178.055 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 24.7 tp -156.35 92.34 1.32 Allowed 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 125.441 1.496 . . . . 0.0 110.141 173.245 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 24.3 p 54.69 28.54 10.22 Favored 'General case' 0 N--CA 1.475 0.81 0 N-CA-C 116.949 2.203 . . . . 0.0 116.949 166.839 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 5.8 p -152.06 146.12 18.27 Favored Pre-proline 0 N--CA 1.476 0.845 0 C-N-CA 125.964 1.706 . . . . 0.0 110.623 -170.686 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_endo -75.59 60.71 5.94 Favored 'Trans proline' 0 CA--C 1.548 1.21 0 C-N-CA 123.933 3.089 . . . . 0.0 112.275 175.836 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 60.66 124.91 0.02 OUTLIER Pre-proline 0 N--CA 1.479 0.997 0 C-N-CA 129.052 2.941 . . . . 0.0 114.372 -172.873 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -84.03 165.92 13.07 Favored 'Trans proline' 0 CA--C 1.541 0.864 0 C-N-CA 123.381 2.721 . . . . 0.0 112.586 175.445 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 21.8 ptmt -99.83 126.99 46.02 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 126.038 1.735 . . . . 0.0 109.56 166.387 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 8.1 mp -118.38 150.29 39.78 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 124.832 1.253 . . . . 0.0 112.564 178.821 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -147.27 45.77 1.14 Allowed 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.632 1.573 . . . . 0.0 111.479 173.339 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -138.56 102.62 4.65 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 125.638 1.575 . . . . 0.0 112.224 -171.553 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.9 mt -129.39 154.87 46.5 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 128.548 2.739 . . . . 0.0 109.227 167.796 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 23.3 t -71.95 163.46 27.81 Favored 'General case' 0 N--CA 1.48 1.052 0 O-C-N 121.878 -0.514 . . . . 0.0 110.26 170.253 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -56.26 -45.48 80.05 Favored 'General case' 0 N--CA 1.477 0.924 0 O-C-N 120.257 -1.527 . . . . 0.0 112.863 -174.175 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 9.4 tt0 -71.18 -43.15 68.03 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 123.526 0.73 . . . . 0.0 111.553 175.675 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 89.3 mt-30 -61.29 -38.28 86.21 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 123.302 0.641 . . . . 0.0 111.885 178.587 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 41.2 ttmt -62.91 -44.23 96.65 Favored 'General case' 0 N--CA 1.464 0.249 0 C-N-CA 124.86 1.264 . . . . 0.0 110.731 175.732 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 49.8 mt -65.65 -43.97 93.7 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 CA-C-O 118.45 -0.786 . . . . 0.0 110.924 177.117 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 52.6 mt -63.97 -46.44 94.01 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 CA-C-N 120.078 1.308 . . . . 0.0 110.299 179.296 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -59.04 -48.9 79.91 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 125.14 1.376 . . . . 0.0 110.931 178.263 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -63.82 -53.04 56.98 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 124.954 1.301 . . . . 0.0 112.185 177.096 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 17.0 mm-40 -60.13 -30.45 69.3 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 119.088 0.858 . . . . 0.0 112.5 179.476 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.404 ' CD2' ' HE2' ' A' ' 63' ' ' LYS . 1.4 t80 -66.2 -58.83 4.53 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 118.988 0.813 . . . . 0.0 110.705 175.592 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 70.6 mt -62.72 -35.02 68.72 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.329 0 C-N-CA 126.573 1.949 . . . . 0.0 111.622 179.884 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -74.65 -29.42 61.25 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.05 0.94 . . . . 0.0 112.415 178.98 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -82.69 -40.0 21.23 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.778 0.831 . . . . 0.0 112.183 174.621 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.8 m -104.15 -12.55 9.15 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.086 0 N-CA-C 114.386 1.254 . . . . 0.0 114.386 -173.612 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 91.59 27.85 16.16 Favored Glycine 0 CA--C 1.534 1.253 0 C-N-CA 125.108 1.337 . . . . 0.0 115.805 164.589 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 56.13 9.08 0.45 Allowed 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 127.427 2.291 . . . . 0.0 115.027 -173.9 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 2.5 pt20 -117.92 -7.96 10.84 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 125.798 1.639 . . . . 0.0 113.435 -167.087 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 67.3 m-80 -123.28 -1.4 8.68 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 125.094 1.358 . . . . 0.0 113.305 178.339 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 21.7 pt -72.16 150.39 8.7 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 CA-C-O 121.016 0.436 . . . . 0.0 111.417 177.734 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -138.04 143.61 40.62 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 124.448 1.099 . . . . 0.0 109.398 177.687 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -61.39 -26.62 67.97 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 118.787 0.722 . . . . 0.0 112.468 -179.418 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -66.96 -42.99 89.48 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 C-N-CA 125.654 1.582 . . . . 0.0 110.548 174.601 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 81.6 m -79.77 -46.46 16.94 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 123.681 0.793 . . . . 0.0 109.192 -177.466 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 17.3 tp -62.59 -34.69 77.5 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.561 1.544 . . . . 0.0 112.511 177.563 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.455 ' HA ' HG13 ' A' ' 66' ' ' ILE . 60.2 p -61.95 -25.2 67.46 Favored 'General case' 0 N--CA 1.475 0.81 0 N-CA-C 113.222 0.823 . . . . 0.0 113.222 171.667 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -101.55 -24.67 14.1 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 125.434 1.493 . . . . 0.0 114.115 -178.112 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.404 ' HE2' ' CD2' ' A' ' 46' ' ' TYR . 21.0 mmmt -65.74 -34.87 79.19 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.9 1.28 . . . . 0.0 111.497 172.82 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 49.6 mt -115.91 -1.1 12.64 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 125.931 1.692 . . . . 0.0 113.52 -169.319 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 26.7 m-80 57.0 61.63 2.52 Favored 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 126.683 1.993 . . . . 0.0 113.542 -177.342 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.455 HG13 ' HA ' ' A' ' 61' ' ' SER . 0.6 OUTLIER -136.17 178.18 5.4 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 C-N-CA 127.118 2.167 . . . . 0.0 111.548 -171.838 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -78.25 159.13 28.67 Favored 'General case' 0 N--CA 1.478 0.975 0 O-C-N 121.047 -1.033 . . . . 0.0 111.392 172.266 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 98.6 t -63.49 -31.44 52.91 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.955 0 O-C-N 121.605 -0.685 . . . . 0.0 111.187 172.808 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -78.4 -35.95 46.44 Favored 'General case' 0 N--CA 1.471 0.584 0 O-C-N 120.895 -1.128 . . . . 0.0 110.065 -177.353 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 5.4 tmtm? -65.24 -49.96 67.65 Favored 'General case' 0 C--O 1.223 -0.292 0 C-N-CA 125.316 1.447 . . . . 0.0 110.379 174.255 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -58.53 -42.9 88.81 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 125.036 1.334 . . . . 0.0 112.605 174.23 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 34.5 ttmt -71.73 -28.13 63.46 Favored 'General case' 0 CA--C 1.519 -0.219 0 CA-C-O 118.076 -0.964 . . . . 0.0 111.577 -176.586 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -50.58 -44.6 56.89 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 118.973 0.806 . . . . 0.0 111.145 175.849 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 40.3 m-85 -65.54 -38.1 88.63 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.815 0.846 . . . . 0.0 110.782 -177.191 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 35.5 mt -69.39 -27.63 35.13 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.674 0 C-N-CA 124.916 1.286 . . . . 0.0 110.724 176.967 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 45.1 mttt -79.11 -31.88 44.35 Favored 'General case' 0 N--CA 1.47 0.563 0 O-C-N 120.393 -1.442 . . . . 0.0 114.553 176.51 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 24.7 p30 -105.09 -45.58 4.49 Favored 'General case' 0 N--CA 1.471 0.625 0 CA-C-N 119.844 1.202 . . . . 0.0 112.351 -176.155 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 2.5 t -73.01 -16.1 61.51 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 115.326 1.602 . . . . 0.0 115.326 -176.326 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 8.6 p30 -62.94 -18.25 62.92 Favored 'General case' 0 N--CA 1.478 0.931 0 O-C-N 120.121 -1.612 . . . . 0.0 114.957 -176.15 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 1.6 mpt_? -66.59 -13.48 61.12 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 125.231 1.412 . . . . 0.0 113.508 174.746 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 8.0 tp -70.86 -31.85 68.67 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 124.796 1.239 . . . . 0.0 113.306 178.5 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -85.08 -163.72 37.52 Favored Glycine 0 CA--C 1.541 1.695 0 C-N-CA 124.189 0.899 . . . . 0.0 114.55 -179.367 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 74.6 mtp85 -118.32 -101.68 0.43 Allowed 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 125.644 1.578 . . . . 0.0 111.605 177.966 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 5.7 t -155.57 120.2 4.71 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 125.592 1.557 . . . . 0.0 110.438 -179.124 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 64.9 m-80 -143.25 18.79 1.91 Allowed 'General case' 0 CA--C 1.553 1.059 0 C-N-CA 124.508 1.123 . . . . 0.0 113.654 -174.207 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 53.7 t30 -108.29 16.33 23.27 Favored 'General case' 0 CA--C 1.552 1.039 0 C-N-CA 125.166 1.386 . . . . 0.0 113.78 -169.886 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 9.7 mt -145.24 163.17 35.25 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 126.455 1.902 . . . . 0.0 111.194 -173.262 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 54.2 pttt -121.94 10.89 10.24 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 126.587 1.955 . . . . 0.0 113.362 -176.838 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 13.7 t -146.3 124.83 12.42 Favored 'General case' 0 C--O 1.233 0.219 0 C-N-CA 125.407 1.483 . . . . 0.0 109.603 174.378 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -139.37 10.46 0.62 Allowed 'Isoleucine or valine' 0 CA--C 1.548 0.867 0 C-N-CA 125.9 1.68 . . . . 0.0 113.032 -175.584 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 77.72 -12.5 15.88 Favored Glycine 0 N--CA 1.477 1.381 0 O-C-N 120.784 -1.198 . . . . 0.0 114.497 -166.326 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 4.9 mp 54.53 93.58 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.549 0 C-N-CA 127.059 2.144 . . . . 0.0 109.788 -163.696 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 74.1 mt -60.98 94.58 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.957 1.303 . . . . 0.0 112.148 -175.402 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 84.9 mt-30 -111.73 -69.11 0.89 Allowed 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 125.196 1.398 . . . . 0.0 112.22 -179.581 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 2.7 pp20? -153.68 162.43 41.26 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 125.124 1.37 . . . . 0.0 112.234 178.268 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -147.12 57.12 1.14 Allowed 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 124.155 0.982 . . . . 0.0 111.939 175.617 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 26.5 t -134.87 133.54 53.85 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.94 0 C-N-CA 124.126 0.97 . . . . 0.0 112.14 -179.361 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 9.2 t -114.38 78.37 1.15 Allowed 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 125.015 1.326 . . . . 0.0 111.294 177.025 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 6.1 t 47.37 74.52 0.16 Allowed 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 126.848 2.059 . . . . 0.0 114.364 175.821 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 91.4 mtp 54.21 61.74 2.9 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 125.743 1.617 . . . . 0.0 113.485 -176.032 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -79.05 47.31 0.76 Allowed 'General case' 0 CA--C 1.553 1.07 0 C-N-CA 125.126 1.371 . . . . 0.0 112.037 174.808 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -147.74 155.73 42.01 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 126.165 1.786 . . . . 0.0 112.02 -176.213 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 36.6 mtmm -107.78 96.03 6.1 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 125.397 1.479 . . . . 0.0 111.002 -176.976 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 48.8 m -137.59 60.24 1.64 Allowed 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 125.313 1.445 . . . . 0.0 111.449 -174.456 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 28.5 ptm -139.51 158.63 43.8 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 124.901 1.281 . . . . 0.0 113.178 -178.418 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 3.3 m -144.77 145.26 31.58 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 125.302 1.441 . . . . 0.0 110.352 172.214 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 15.6 t-105 . . . . . 0 C--O 1.254 1.3 0 C-N-CA 124.936 1.294 . . . . 0.0 112.825 -176.563 . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.482 0 N-CA-C 111.242 -0.743 . . . . 0.0 111.242 . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 33.6 t -153.04 -52.63 0.11 Allowed 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 124.275 1.03 . . . . 0.0 112.205 176.106 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 35.2 t-80 -147.74 159.34 43.91 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 125.339 1.456 . . . . 0.0 111.498 176.435 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 25.0 ttp -102.3 15.06 30.27 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 115.106 1.521 . . . . 0.0 115.106 -169.04 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -150.51 155.93 40.45 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 114.85 1.426 . . . . 0.0 114.85 -176.62 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 58.3 m -141.43 118.97 11.59 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 127.06 2.144 . . . . 0.0 108.8 -178.368 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 83.6 mtp -139.62 51.25 1.75 Allowed 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.735 1.214 . . . . 0.0 111.175 -167.338 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -119.99 148.25 46.31 Favored Pre-proline 0 CA--C 1.545 0.758 0 C-N-CA 125.552 1.541 . . . . 0.0 112.194 -170.852 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -69.24 -19.08 39.08 Favored 'Trans proline' 0 C--N 1.35 0.632 0 C-N-CA 123.284 2.656 . . . . 0.0 114.745 -175.04 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.44 HD23 ' H ' ' A' ' 4' ' ' LEU . 1.2 pt? -95.11 12.41 28.77 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 126.271 1.828 . . . . 0.0 114.343 -179.585 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -71.05 -8.04 50.62 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 115.189 1.551 . . . . 0.0 115.189 -176.809 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -116.72 -63.31 1.46 Allowed 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 124.796 1.238 . . . . 0.0 113.243 -163.631 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.3 pp -103.15 -18.09 6.79 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.85 0 C-N-CA 124.72 1.208 . . . . 0.0 113.053 -175.875 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . 0.287 11.3 tt 35.99 48.81 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.167 0 C-N-CA 127.301 2.24 . . . . 0.0 116.332 170.903 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -126.33 88.9 2.92 Favored 'General case' 0 CA--C 1.542 0.658 0 O-C-N 120.844 -1.16 . . . . 0.0 111.911 -177.136 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -138.17 79.98 1.77 Allowed 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.84 1.256 . . . . 0.0 110.813 -178.707 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . 0.358 9.5 tt 50.31 26.23 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.205 0 C-N-CA 127.708 2.403 . . . . 0.0 115.124 179.458 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 3.8 ttpt -124.72 -21.69 4.74 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 124.949 1.299 . . . . 0.0 114.462 -178.316 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 80.8 tttt -128.69 68.93 1.38 Allowed 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 125.525 1.53 . . . . 0.0 111.727 -176.26 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 4.1 tm-20 -146.87 130.34 16.77 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 125.137 1.375 . . . . 0.0 109.886 -178.063 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -151.32 153.61 35.14 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.546 1.138 . . . . 0.0 112.96 -179.126 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 30.1 t30 -94.61 154.41 17.38 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.305 1.442 . . . . 0.0 112.576 179.859 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 31.5 m-20 -80.0 54.74 1.96 Allowed 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 125.472 1.509 . . . . 0.0 112.511 175.817 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 49.0 m -79.0 98.95 6.65 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.619 1.168 . . . . 0.0 111.803 -177.13 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 75.53 98.31 0.13 Allowed Glycine 0 CA--C 1.535 1.305 0 C-N-CA 125.319 1.438 . . . . 0.0 113.111 -179.376 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 58.2 t -132.68 131.14 59.73 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.961 0 C-N-CA 125.085 1.354 . . . . 0.0 110.482 -177.551 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.402 HG22 ' H ' ' A' ' 22' ' ' LEU . 0.2 OUTLIER 52.79 -154.8 0.2 Allowed 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 125.737 1.615 . . . . 0.0 112.694 -178.39 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.402 ' H ' HG22 ' A' ' 21' ' ' THR . 44.9 mt -112.17 24.47 12.56 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 126.411 1.885 . . . . 0.0 112.35 -175.818 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -153.49 98.56 2.68 Favored Pre-proline 0 CA--C 1.55 0.965 0 C-N-CA 125.523 1.529 . . . . 0.0 111.098 -166.068 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 90.3 Cg_endo -78.34 -15.94 13.92 Favored 'Trans proline' 0 CA--C 1.543 0.934 0 C-N-CA 123.228 2.619 . . . . 0.0 113.124 178.722 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.424 ' HG ' ' H ' ' A' ' 26' ' ' SER . 6.7 tp -144.51 -157.94 0.84 Allowed 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 127.107 2.163 . . . . 0.0 109.083 178.541 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.424 ' H ' ' HG ' ' A' ' 25' ' ' LEU . 57.3 p -75.12 35.61 0.11 Allowed 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 126.74 2.016 . . . . 0.0 114.594 178.707 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 7.9 p -156.7 142.59 12.86 Favored Pre-proline 0 CA--C 1.543 0.702 0 C-N-CA 126.561 1.944 . . . . 0.0 110.257 -172.518 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 90.5 Cg_endo -77.06 69.53 7.01 Favored 'Trans proline' 0 CA--C 1.547 1.174 0 C-N-CA 123.655 2.903 . . . . 0.0 111.978 179.156 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 53.4 tptt 61.1 109.13 0.03 OUTLIER Pre-proline 0 N--CA 1.481 1.125 0 C-N-CA 129.346 3.058 . . . . 0.0 113.597 -176.12 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -76.86 156.3 34.78 Favored 'Trans proline' 0 C--N 1.352 0.741 0 C-N-CA 122.788 2.326 . . . . 0.0 111.873 -178.847 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 20.0 pttp -64.52 150.82 45.97 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.929 0.892 . . . . 0.0 112.984 -179.946 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 42.8 tp -143.57 130.33 20.34 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 124.813 1.245 . . . . 0.0 110.88 175.695 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 5.2 mp0 -122.1 69.04 0.94 Allowed 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.233 1.413 . . . . 0.0 110.736 176.116 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -127.29 84.6 2.27 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.133 1.373 . . . . 0.0 111.707 -173.204 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.4 mt -136.3 151.74 49.95 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 127.263 2.225 . . . . 0.0 109.898 178.089 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 67.1 m -74.3 165.09 25.77 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 123.199 0.6 . . . . 0.0 110.829 171.925 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -55.06 -43.99 74.35 Favored 'General case' 0 N--CA 1.48 1.037 0 O-C-N 120.665 -1.272 . . . . 0.0 113.54 -172.983 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 8.5 pt20 -77.82 -35.21 51.5 Favored 'General case' 0 N--CA 1.472 0.625 0 O-C-N 121.56 -0.713 . . . . 0.0 112.547 174.802 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 84.6 mt-30 -65.17 -38.47 90.63 Favored 'General case' 0 N--CA 1.466 0.369 0 O-C-N 121.616 -0.678 . . . . 0.0 111.397 178.961 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 23.4 ttmm -58.99 -42.34 89.78 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 124.555 1.142 . . . . 0.0 110.879 175.173 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 41.0 mt -71.01 -42.3 76.86 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.557 0 CA-C-O 118.265 -0.874 . . . . 0.0 110.977 178.818 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 43.3 mt -63.13 -44.34 99.38 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 CA-C-N 120.412 1.46 . . . . 0.0 110.215 177.246 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -59.0 -49.11 79.15 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 125.12 1.368 . . . . 0.0 110.897 178.069 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -63.25 -52.83 60.51 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 124.858 1.263 . . . . 0.0 112.435 176.374 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -58.52 -31.48 67.94 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-N 119.28 0.945 . . . . 0.0 112.771 179.205 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.432 ' CE2' HG22 ' A' ' 55' ' ' ILE . 1.2 t80 -66.83 -58.44 5.04 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 118.794 0.725 . . . . 0.0 110.593 177.296 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 72.3 mt -65.82 -33.48 63.89 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.442 0 C-N-CA 126.323 1.849 . . . . 0.0 111.615 -178.638 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -72.41 -26.83 62.01 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 123.693 0.797 . . . . 0.0 112.294 177.733 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -86.21 -40.88 15.14 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.039 0.935 . . . . 0.0 112.096 174.939 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.2 m -108.4 -5.57 10.7 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.241 0 N-CA-C 114.552 1.315 . . . . 0.0 114.552 -171.918 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 86.72 26.94 30.76 Favored Glycine 0 CA--C 1.532 1.1 0 C-N-CA 124.711 1.148 . . . . 0.0 115.519 160.543 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 55.99 10.11 0.55 Allowed 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 127.479 2.312 . . . . 0.0 115.322 -173.991 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 5.1 pt20 -123.18 -3.7 8.49 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 124.946 1.298 . . . . 0.0 113.694 -168.948 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 58.8 m-80 -122.43 0.88 9.52 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 124.995 1.318 . . . . 0.0 113.191 174.638 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.432 HG22 ' CE2' ' A' ' 46' ' ' TYR . 18.0 pt -76.97 154.25 5.59 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 C-N-CA 123.039 0.535 . . . . 0.0 111.593 175.963 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -139.82 143.65 36.93 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 124.805 1.242 . . . . 0.0 109.634 179.623 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -60.65 -27.09 67.54 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 118.871 0.76 . . . . 0.0 112.379 179.698 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -67.14 -48.45 78.71 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.463 0 C-N-CA 125.644 1.577 . . . . 0.0 110.194 175.574 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 76.9 m -78.33 -43.65 27.25 Favored 'General case' 0 C--O 1.224 -0.257 0 C-N-CA 123.477 0.711 . . . . 0.0 109.97 -176.659 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 18.6 tp -60.17 -34.58 73.78 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 125.375 1.47 . . . . 0.0 112.082 173.713 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.55 ' HA ' HG13 ' A' ' 66' ' ' ILE . 35.1 t -52.92 -36.14 59.24 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 124.363 1.065 . . . . 0.0 112.571 168.527 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -100.66 -22.82 14.8 Favored 'General case' 0 CA--C 1.533 0.299 0 N-CA-C 114.405 1.261 . . . . 0.0 114.405 -173.088 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 66.6 mmtt -63.99 -34.64 78.46 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 124.721 1.208 . . . . 0.0 111.947 174.953 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.5 mp -117.72 2.67 12.29 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 124.866 1.266 . . . . 0.0 114.076 -174.781 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 12.9 m-80 56.57 46.4 20.52 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 125.613 1.565 . . . . 0.0 112.763 -172.917 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.55 HG13 ' HA ' ' A' ' 61' ' ' SER . 9.9 pt -105.15 -171.99 0.36 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.619 0 C-N-CA 125.913 1.685 . . . . 0.0 111.11 -179.953 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -89.33 158.16 17.91 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 123.523 0.729 . . . . 0.0 110.41 170.081 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 49.7 t -59.1 -31.23 45.41 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.119 0 O-C-N 121.595 -0.69 . . . . 0.0 111.422 170.059 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -80.41 -35.95 34.44 Favored 'General case' 0 CA--C 1.53 0.211 0 O-C-N 121.139 -0.976 . . . . 0.0 110.184 -177.111 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 26.0 tttt -65.97 -44.71 84.14 Favored 'General case' 0 C--N 1.344 0.341 0 C-N-CA 123.393 0.677 . . . . 0.0 110.731 174.06 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -58.51 -49.56 76.95 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.673 1.589 . . . . 0.0 112.35 173.923 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 35.0 ttmt -68.88 -30.0 68.41 Favored 'General case' 0 N--CA 1.463 0.18 0 O-C-N 121.11 -0.994 . . . . 0.0 111.195 -177.152 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -56.15 -37.28 69.29 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 122.97 0.508 . . . . 0.0 112.362 175.311 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 48.6 m-85 -68.55 -45.13 72.96 Favored 'General case' 0 N--CA 1.463 0.218 0 C-N-CA 125.482 1.513 . . . . 0.0 110.609 176.092 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 79.7 mt -64.33 -31.53 53.88 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 C-N-CA 124.961 1.304 . . . . 0.0 111.35 -179.535 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 47.9 mtmt -81.81 -33.65 30.66 Favored 'General case' 0 N--CA 1.469 0.521 0 N-CA-C 113.875 1.065 . . . . 0.0 113.875 -178.188 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 5.7 p30 -86.92 -41.49 13.92 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 119.417 1.008 . . . . 0.0 111.31 173.944 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 8.5 t -105.57 104.85 14.66 Favored 'General case' 0 N--CA 1.456 -0.163 0 O-C-N 123.496 0.498 . . . . 0.0 110.882 -176.963 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -152.98 129.47 10.68 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 123.666 0.786 . . . . 0.0 111.014 -172.204 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 2.0 mpt_? 54.92 1.28 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.58 0 C-N-CA 126.463 1.905 . . . . 0.0 116.026 -169.62 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 29.3 tp -122.98 -44.04 2.2 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 124.832 1.253 . . . . 0.0 113.864 -164.057 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -77.07 95.47 1.16 Allowed Glycine 0 CA--C 1.533 1.175 0 CA-C-N 118.327 0.512 . . . . 0.0 113.171 -177.01 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 40.5 ttm-85 -94.91 -79.46 0.43 Allowed 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 123.985 0.914 . . . . 0.0 113.236 -176.013 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 15.3 t -160.67 26.86 0.15 Allowed 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 124.667 1.187 . . . . 0.0 112.285 -169.752 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 69.2 m-80 -130.77 126.88 37.51 Favored 'General case' 0 N--CA 1.472 0.641 0 O-C-N 120.487 -1.383 . . . . 0.0 111.477 -175.198 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 2.5 t30 -157.34 140.82 15.66 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 125.378 1.471 . . . . 0.0 111.112 175.879 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 4.8 mp -128.39 167.98 16.23 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 127.702 2.401 . . . . 0.0 110.198 178.715 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 4.9 ptpp? -118.36 8.27 12.15 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 126.28 1.832 . . . . 0.0 113.469 -177.556 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 15.3 t -148.55 132.37 17.02 Favored 'General case' 0 C--O 1.233 0.216 0 C-N-CA 125.504 1.522 . . . . 0.0 109.668 171.517 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -144.71 11.82 0.26 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.808 0 C-N-CA 126.608 1.963 . . . . 0.0 112.822 -173.57 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 65.79 11.59 54.55 Favored Glycine 0 CA--C 1.536 1.387 0 O-C-N 120.75 -1.219 . . . . 0.0 114.532 -172.31 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . 0.3 3.1 mp 52.89 33.27 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 C-N-CA 126.768 2.027 . . . . 0.0 111.889 -178.809 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 8.9 mp 51.37 27.7 3.86 Favored 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 127.484 2.313 . . . . 0.0 114.312 175.459 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 6.9 pt20 -129.11 10.4 5.84 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 125.152 1.381 . . . . 0.0 114.289 -172.416 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -74.22 155.59 38.15 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.148 0.979 . . . . 0.0 112.331 174.273 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 57.91 49.98 11.07 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 125.498 1.519 . . . . 0.0 114.41 179.671 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 45.3 t -130.27 137.52 56.14 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.743 0 C-N-CA 125.383 1.473 . . . . 0.0 110.546 176.066 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 13.7 t -136.81 -44.13 0.58 Allowed 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 123.829 0.851 . . . . 0.0 113.131 174.71 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 21.1 t -147.42 103.36 3.55 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.048 0.939 . . . . 0.0 111.826 175.101 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 24.8 mmt 52.13 31.92 9.73 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 126.04 1.736 . . . . 0.0 114.8 178.99 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 11.7 mt-10 -83.4 48.68 1.44 Allowed 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 125.657 1.583 . . . . 0.0 113.221 -176.227 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -119.23 155.44 31.71 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 126.642 1.977 . . . . 0.0 111.787 177.35 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 8.8 mptt -124.49 119.19 28.41 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 125.091 1.357 . . . . 0.0 110.667 -178.963 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 45.3 t -158.74 -65.94 0.08 Allowed 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 124.367 1.067 . . . . 0.0 111.814 175.432 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 25.2 mtm -150.12 164.67 35.0 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 126.42 1.888 . . . . 0.0 111.661 -174.644 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 9.9 t -114.3 166.77 11.32 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 125.63 1.572 . . . . 0.0 111.809 171.763 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 6.7 t-105 . . . . . 0 C--O 1.254 1.294 0 C-N-CA 125.566 1.546 . . . . 0.0 113.177 -168.495 . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.567 0 N-CA-C 112.284 -0.326 . . . . 0.0 112.284 . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 22.8 t -72.84 -41.52 64.74 Favored 'General case' 0 N--CA 1.476 0.835 0 N-CA-C 113.092 0.775 . . . . 0.0 113.092 -176.324 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 43.5 t-80 -153.17 156.75 39.17 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 125.396 1.478 . . . . 0.0 111.414 177.685 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 22.1 ttt -146.43 134.25 21.24 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 124.603 1.161 . . . . 0.0 111.336 177.441 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -150.23 174.1 13.2 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 124.892 1.277 . . . . 0.0 112.801 -178.512 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 9.3 t -132.02 160.25 36.43 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 125.822 1.649 . . . . 0.0 111.918 176.234 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 77.6 mtm -134.52 65.14 1.58 Allowed 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 125.523 1.529 . . . . 0.0 112.184 -168.58 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -128.84 75.04 80.49 Favored Pre-proline 0 CA--C 1.551 0.986 0 C-N-CA 124.981 1.312 . . . . 0.0 112.049 176.79 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 80.3 Cg_endo -78.9 -3.83 13.51 Favored 'Trans proline' 0 C--N 1.352 0.735 0 C-N-CA 123.973 3.115 . . . . 0.0 114.909 -179.834 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 94.1 mt -108.76 41.34 1.61 Allowed 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 126.279 1.832 . . . . 0.0 112.167 -177.261 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -107.14 -5.04 18.24 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 114.472 1.286 . . . . 0.0 114.472 178.035 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.21 -58.29 2.15 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 124.296 1.038 . . . . 0.0 113.027 -162.508 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.1 pp -129.04 15.11 2.69 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 C-N-CA 126.615 1.966 . . . . 0.0 112.713 -174.981 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 10.2 tt -41.55 124.35 0.49 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.995 0 C-N-CA 125.413 1.485 . . . . 0.0 112.488 177.121 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -147.11 29.87 0.96 Allowed 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 124.027 0.931 . . . . 0.0 112.996 -175.113 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -106.19 11.57 31.1 Favored 'General case' 0 N--CA 1.476 0.841 0 O-C-N 120.899 -1.126 . . . . 0.0 113.553 -179.321 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 15.5 tt -150.13 36.78 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.477 0.876 0 C-N-CA 126.509 1.924 . . . . 0.0 111.799 -175.343 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 2.9 tppt? -136.89 -37.55 0.66 Allowed 'General case' 0 N--CA 1.478 0.935 0 N-CA-C 115.309 1.596 . . . . 0.0 115.309 -176.175 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -151.02 151.12 31.58 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 126.556 1.942 . . . . 0.0 110.783 -179.923 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -138.01 143.13 40.44 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 124.969 1.308 . . . . 0.0 110.954 173.567 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -145.55 171.8 14.15 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 125.572 1.549 . . . . 0.0 111.678 179.825 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.8 t-20 -135.47 151.34 50.29 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 125.546 1.539 . . . . 0.0 111.668 -178.566 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 19.2 m-20 -122.14 136.71 54.95 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 125.507 1.523 . . . . 0.0 112.265 -178.938 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 21.4 t -82.75 101.41 10.88 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-O 121.72 0.771 . . . . 0.0 110.294 174.558 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 97.36 114.37 3.21 Favored Glycine 0 CA--C 1.531 1.049 0 C-N-CA 125.769 1.652 . . . . 0.0 112.649 -177.607 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 61.0 t -122.3 132.48 70.98 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 C-N-CA 126.413 1.885 . . . . 0.0 109.914 173.957 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 54.97 -161.9 0.15 Allowed 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 125.923 1.689 . . . . 0.0 113.299 -175.378 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 45.4 mt -130.02 32.21 4.56 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 126.113 1.765 . . . . 0.0 112.02 -164.227 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -126.78 81.03 69.79 Favored Pre-proline 0 CA--C 1.55 0.956 0 C-N-CA 124.129 0.972 . . . . 0.0 113.547 -156.691 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_endo -76.15 -27.65 8.04 Favored 'Trans proline' 0 CA--C 1.543 0.947 0 C-N-CA 123.728 2.952 . . . . 0.0 114.168 -178.047 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 1.1 tt -150.95 52.62 0.86 Allowed 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 124.049 0.94 . . . . 0.0 112.266 -173.786 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.2 t 56.66 37.78 29.06 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 124.817 1.247 . . . . 0.0 114.018 -179.009 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 10.0 p -157.7 144.46 13.18 Favored Pre-proline 0 N--CA 1.473 0.722 0 C-N-CA 126.466 1.906 . . . . 0.0 109.141 -171.908 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_endo -78.26 60.27 7.38 Favored 'Trans proline' 0 CA--C 1.548 1.193 0 C-N-CA 123.63 2.886 . . . . 0.0 112.667 -178.675 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 59.85 115.11 0.02 OUTLIER Pre-proline 0 N--CA 1.481 1.121 0 C-N-CA 128.532 2.733 . . . . 0.0 112.927 -172.314 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -95.06 137.51 0.82 Allowed 'Trans proline' 0 CA--C 1.538 0.711 0 C-N-CA 122.814 2.343 . . . . 0.0 111.282 178.644 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 35.6 mmtt -72.52 112.38 8.52 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 124.76 1.224 . . . . 0.0 111.253 175.686 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.5 pt? -141.36 161.3 38.22 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 125.661 1.585 . . . . 0.0 113.251 168.879 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -148.8 44.27 1.0 Allowed 'General case' 0 N--CA 1.474 0.758 0 CA-C-O 123.266 1.508 . . . . 0.0 112.759 179.152 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -95.66 98.69 10.67 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 125.186 1.395 . . . . 0.0 112.007 -171.183 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 6.9 mt -124.5 150.44 45.79 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 126.424 1.89 . . . . 0.0 110.796 -179.576 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 63.4 m -75.88 165.09 25.51 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 123.302 0.641 . . . . 0.0 110.528 171.628 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -55.15 -44.46 75.15 Favored 'General case' 0 N--CA 1.48 1.042 0 O-C-N 120.72 -1.237 . . . . 0.0 113.472 -173.526 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 8.9 pt20 -75.35 -36.64 60.95 Favored 'General case' 0 N--CA 1.469 0.51 0 O-C-N 121.601 -0.687 . . . . 0.0 112.486 175.306 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 76.4 mt-30 -65.75 -36.92 84.94 Favored 'General case' 0 N--CA 1.466 0.341 0 O-C-N 121.508 -0.745 . . . . 0.0 111.595 178.9 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 40.3 ttmt -61.59 -42.17 98.49 Favored 'General case' 0 N--CA 1.465 0.307 0 C-N-CA 124.405 1.082 . . . . 0.0 111.008 174.99 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 46.2 mt -69.03 -43.14 82.15 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 CA-C-O 118.449 -0.786 . . . . 0.0 111.045 176.732 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 44.0 mt -63.01 -44.25 99.54 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 CA-C-N 120.167 1.349 . . . . 0.0 110.343 178.73 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -59.53 -49.07 79.22 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.9 1.28 . . . . 0.0 110.794 176.586 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -67.42 -51.46 51.44 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 124.364 1.065 . . . . 0.0 112.799 -179.369 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 18.9 mm-40 -61.9 -24.12 66.75 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 118.968 0.804 . . . . 0.0 113.162 -178.385 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.502 ' CE2' HG22 ' A' ' 55' ' ' ILE . 1.4 t80 -70.29 -60.17 2.44 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 123.891 0.876 . . . . 0.0 110.841 174.031 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 64.7 mt -59.72 -35.15 58.24 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 C-N-CA 127.003 2.121 . . . . 0.0 111.762 177.846 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -70.86 -22.57 62.28 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 123.969 0.908 . . . . 0.0 113.116 178.143 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -94.9 -32.19 13.33 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.472 1.109 . . . . 0.0 112.731 178.013 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 4.5 m -118.57 -20.61 5.05 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.916 0 CA-C-N 119.552 1.069 . . . . 0.0 113.731 -173.461 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 83.2 141.98 4.54 Favored Glycine 0 CA--C 1.531 1.061 0 C-N-CA 124.787 1.184 . . . . 0.0 112.33 -171.312 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -66.83 -9.96 42.92 Favored 'General case' 0 N--CA 1.479 0.994 0 CA-C-O 122.721 1.248 . . . . 0.0 113.93 -171.485 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 5.6 pt20 -84.96 -11.74 54.85 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 126.268 1.827 . . . . 0.0 113.854 174.753 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 73.4 m-80 -114.35 -9.4 12.79 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 114.585 1.328 . . . . 0.0 114.585 -177.877 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.502 HG22 ' CE2' ' A' ' 46' ' ' TYR . 21.8 pt -71.43 159.98 5.46 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 C-N-CA 123.574 0.749 . . . . 0.0 111.608 168.684 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.1 p -129.22 144.37 51.19 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 125.149 1.379 . . . . 0.0 110.014 173.805 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -63.9 -26.14 68.46 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.933 0.893 . . . . 0.0 112.169 175.875 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -63.49 -49.26 83.37 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.459 0 C-N-CA 125.291 1.436 . . . . 0.0 109.48 173.099 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 99.2 m -75.14 -43.02 54.89 Favored 'General case' 0 C--O 1.223 -0.309 0 C-N-CA 123.538 0.735 . . . . 0.0 110.156 -178.248 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 17.3 tp -62.22 -35.13 77.95 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.469 1.108 . . . . 0.0 112.093 176.23 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.47 ' HA ' HG13 ' A' ' 66' ' ' ILE . 47.2 t -53.79 -32.5 52.79 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.367 1.067 . . . . 0.0 113.015 168.349 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -100.74 -23.55 14.59 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 125.621 1.568 . . . . 0.0 114.008 -174.137 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 67.1 mmtt -66.05 -37.58 86.19 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 124.858 1.263 . . . . 0.0 111.343 173.977 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.3 mp -114.21 1.38 14.51 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 125.092 1.357 . . . . 0.0 114.256 -172.819 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 12.7 m-80 57.21 46.36 18.89 Favored 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 125.712 1.605 . . . . 0.0 112.868 -175.155 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.47 HG13 ' HA ' ' A' ' 61' ' ' SER . 7.0 pt -106.39 -166.42 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 C-N-CA 125.974 1.709 . . . . 0.0 111.537 -178.992 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -94.5 159.41 15.11 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 123.9 0.88 . . . . 0.0 110.491 167.644 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 93.8 t -60.39 -30.1 45.66 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 O-C-N 121.563 -0.711 . . . . 0.0 111.241 172.22 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -82.68 -32.52 28.06 Favored 'General case' 0 N--CA 1.465 0.287 0 O-C-N 121.049 -1.032 . . . . 0.0 110.567 -178.194 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 15.2 tttt -70.19 -41.59 73.52 Favored 'General case' 0 C--N 1.343 0.326 0 C-N-CA 123.313 0.645 . . . . 0.0 110.855 174.502 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -60.78 -47.33 86.8 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 125.56 1.544 . . . . 0.0 112.355 171.531 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 36.7 ttmt -72.78 -28.04 62.36 Favored 'General case' 0 CA--C 1.517 -0.296 0 CA-C-O 118.004 -0.998 . . . . 0.0 111.298 -173.519 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -49.72 -47.24 50.69 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 118.833 0.742 . . . . 0.0 110.408 174.272 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 18.9 m-85 -63.56 -43.19 97.75 Favored 'General case' 0 C--O 1.223 -0.326 0 C-N-CA 123.491 0.716 . . . . 0.0 110.43 -175.593 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 48.4 mt -67.92 -28.39 41.15 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.675 0 C-N-CA 125.435 1.494 . . . . 0.0 111.637 -178.773 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 28.4 mmmt -80.46 -23.41 40.23 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 125.423 1.489 . . . . 0.0 112.369 174.941 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 90.2 m-20 -100.29 -62.85 1.19 Allowed 'General case' 0 C--O 1.234 0.244 0 C-N-CA 126.326 1.85 . . . . 0.0 111.609 -173.502 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 69.7 m -98.59 102.66 14.46 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 126.318 1.847 . . . . 0.0 110.862 177.027 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 7.9 p30 -139.13 -74.5 0.38 Allowed 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 123.608 0.763 . . . . 0.0 112.839 -177.476 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 1.2 mpp_? -65.24 -26.64 68.2 Favored 'General case' 0 N--CA 1.484 1.257 0 CA-C-N 119.482 1.037 . . . . 0.0 112.646 177.919 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -92.92 0.4 57.4 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 126.466 1.906 . . . . 0.0 113.492 176.84 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -72.77 -17.29 78.17 Favored Glycine 0 CA--C 1.538 1.492 0 O-C-N 120.89 -1.131 . . . . 0.0 115.415 -174.103 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 13.8 ttt85 -144.84 165.83 26.99 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 126.724 2.009 . . . . 0.0 109.381 170.309 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 8.9 t -49.87 107.88 0.18 Allowed 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 125.73 1.612 . . . . 0.0 113.545 178.739 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 54.7 m-80 -150.6 137.65 19.28 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 126.116 1.767 . . . . 0.0 110.301 179.615 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -153.15 88.86 1.33 Allowed 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 124.785 1.234 . . . . 0.0 109.74 170.821 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -143.57 30.47 1.36 Allowed 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 124.168 0.987 . . . . 0.0 112.027 -175.804 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 85.2 tttt -94.19 -24.2 17.6 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 125.768 1.627 . . . . 0.0 111.933 174.339 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 9.5 t -158.92 127.32 5.22 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 126.439 1.896 . . . . 0.0 109.282 179.415 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -143.25 2.26 0.35 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.786 0 C-N-CA 125.505 1.522 . . . . 0.0 113.975 -177.789 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 70.65 10.22 66.8 Favored Glycine 0 CA--C 1.541 1.669 0 O-C-N 120.728 -1.232 . . . . 0.0 114.682 -169.963 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . 0.257 4.0 mp 53.28 39.22 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.106 0 C-N-CA 126.485 1.914 . . . . 0.0 111.824 174.121 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 14.4 tp 50.93 25.03 2.02 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 127.148 2.179 . . . . 0.0 114.426 -177.758 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 33.6 mt-30 -114.2 86.5 2.43 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 126.008 1.723 . . . . 0.0 110.22 -174.655 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -133.43 147.6 51.73 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 126.791 2.036 . . . . 0.0 110.018 179.024 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -133.6 122.41 23.48 Favored 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 124.694 1.197 . . . . 0.0 110.721 -176.336 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 60.6 t -134.21 108.7 11.52 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.469 0 C-N-CA 125.375 1.47 . . . . 0.0 109.712 178.749 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 32.2 t -162.99 -79.32 0.04 OUTLIER 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 123.757 0.823 . . . . 0.0 112.126 169.014 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 42.9 m -95.3 -27.54 15.43 Favored 'General case' 0 N--CA 1.478 0.948 0 N-CA-C 114.079 1.14 . . . . 0.0 114.079 -172.588 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 65.6 mtt -137.57 110.41 7.65 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 125.419 1.488 . . . . 0.0 109.658 -179.69 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -144.52 85.98 1.8 Allowed 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 124.768 1.227 . . . . 0.0 109.145 -179.693 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -153.29 161.71 42.08 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 124.884 1.273 . . . . 0.0 112.566 -178.437 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 52.3 mmtt -116.95 -65.34 1.2 Allowed 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 125.75 1.62 . . . . 0.0 111.88 174.24 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 56.9 m -144.12 145.32 32.06 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.801 1.64 . . . . 0.0 110.954 -179.176 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 31.9 ttm -154.45 154.01 32.48 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 124.573 1.149 . . . . 0.0 111.805 179.778 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 10.6 m -100.94 142.97 31.66 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 124.811 1.244 . . . . 0.0 110.94 173.807 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 48.6 p90 . . . . . 0 C--O 1.253 1.259 0 C-N-CA 126.522 1.929 . . . . 0.0 113.655 -178.186 . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.625 0 N-CA-C 111.671 -0.572 . . . . 0.0 111.671 . . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 21.3 t -148.29 145.99 28.4 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.824 1.249 . . . . 0.0 111.626 177.884 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 69.1 m80 -141.76 151.06 42.55 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 125.822 1.649 . . . . 0.0 111.597 -178.808 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 27.9 ttt -147.6 139.0 23.76 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 125.29 1.436 . . . . 0.0 111.235 -179.815 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -85.35 152.06 23.55 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 124.05 0.94 . . . . 0.0 112.366 176.228 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 26.9 t -141.69 94.71 2.71 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.932 1.293 . . . . 0.0 109.778 177.782 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 33.9 ttm -149.75 26.28 0.83 Allowed 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 124.834 1.253 . . . . 0.0 112.518 -173.352 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 15.6 m-20 -126.96 156.23 74.47 Favored Pre-proline 0 CA--C 1.548 0.872 0 C-N-CA 125.691 1.597 . . . . 0.0 111.945 -177.001 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 91.7 Cg_endo -74.29 -0.25 9.4 Favored 'Trans proline' 0 CA--C 1.538 0.688 0 C-N-CA 123.468 2.778 . . . . 0.0 114.601 179.969 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 95.0 mt -117.28 36.69 4.14 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 125.878 1.671 . . . . 0.0 112.998 -175.296 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 27.9 m-20 -103.84 2.62 32.92 Favored 'General case' 0 N--CA 1.477 0.898 0 N-CA-C 114.301 1.223 . . . . 0.0 114.301 173.36 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -119.92 -57.17 1.97 Allowed 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 124.398 1.079 . . . . 0.0 113.525 -164.502 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.1 pp -131.36 16.39 1.87 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.94 0 C-N-CA 126.144 1.778 . . . . 0.0 112.869 -172.534 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 15.5 tt -42.03 -39.08 0.76 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.284 0 C-N-CA 126.156 1.782 . . . . 0.0 115.772 -177.164 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 15.9 m120 -121.54 108.38 13.54 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 125.514 1.526 . . . . 0.0 110.497 177.594 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 29.2 t0 -165.38 62.91 0.12 Allowed 'General case' 0 CA--C 1.533 0.29 0 CA-C-O 122.352 1.072 . . . . 0.0 110.655 -168.582 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 29.5 mt 50.08 59.36 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.742 0 C-N-CA 125.931 1.693 . . . . 0.0 110.626 -169.097 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -147.75 -51.38 0.19 Allowed 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 114.62 -1.173 . . . . 0.0 112.064 -179.814 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 61.0 mttp 54.81 177.79 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.558 0 C-N-CA 125.932 1.693 . . . . 0.0 114.495 -174.889 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -142.57 71.3 1.34 Allowed 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 124.986 1.314 . . . . 0.0 110.816 178.393 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -139.19 161.9 36.28 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 125.578 1.551 . . . . 0.0 112.048 177.36 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 29.1 t-20 -154.34 -54.28 0.1 Allowed 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 123.936 0.895 . . . . 0.0 113.092 -174.351 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 51.68 38.97 24.19 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 126.0 1.72 . . . . 0.0 115.402 176.364 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 27.1 t -69.2 109.86 4.29 Favored 'General case' 0 CA--C 1.539 0.532 0 O-C-N 121.439 -0.788 . . . . 0.0 111.377 175.567 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 75.52 105.86 0.11 Allowed Glycine 0 CA--C 1.537 1.442 0 C-N-CA 125.936 1.732 . . . . 0.0 113.947 -177.355 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 14.8 p -141.03 140.33 32.67 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.858 0 C-N-CA 125.421 1.489 . . . . 0.0 111.432 172.47 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 27.6 m 63.92 156.65 0.07 Allowed 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 127.017 2.127 . . . . 0.0 115.329 179.947 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -133.43 31.83 3.71 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 126.217 1.807 . . . . 0.0 114.575 -174.311 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -83.3 151.3 62.47 Favored Pre-proline 0 CA--C 1.549 0.917 0 C-N-CA 125.453 1.501 . . . . 0.0 112.84 -179.199 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 65.3 Cg_endo -72.73 -44.84 0.59 Allowed 'Trans proline' 0 CA--C 1.541 0.846 0 C-N-CA 122.679 2.253 . . . . 0.0 112.605 178.01 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 41.7 tp -159.04 81.32 0.78 Allowed 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 125.61 1.564 . . . . 0.0 109.53 174.063 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 60.47 175.86 0.1 Allowed 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.992 1.317 . . . . 0.0 114.16 -172.863 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 40.8 t 63.31 151.33 0.11 Allowed Pre-proline 0 N--CA 1.486 1.352 0 C-N-CA 127.04 2.136 . . . . 0.0 112.882 -172.945 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -69.59 66.14 1.68 Allowed 'Trans proline' 0 CA--C 1.548 1.224 0 C-N-CA 123.43 2.754 . . . . 0.0 112.094 169.392 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 55.95 102.79 0.03 OUTLIER Pre-proline 0 N--CA 1.478 0.965 0 C-N-CA 128.845 2.858 . . . . 0.0 113.084 -174.058 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 82.3 Cg_endo -69.11 163.09 39.09 Favored 'Trans proline' 0 CA--C 1.539 0.753 0 C-N-CA 122.309 2.006 . . . . 0.0 112.369 175.438 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 96.6 mttt -117.65 111.07 18.67 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 126.245 1.818 . . . . 0.0 110.136 178.979 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -149.29 156.04 41.47 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.264 1.426 . . . . 0.0 113.269 -176.528 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -151.1 46.71 0.84 Allowed 'General case' 0 N--CA 1.474 0.77 0 CA-C-O 123.088 1.423 . . . . 0.0 112.844 -177.791 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -106.36 83.04 1.82 Allowed 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 125.188 1.395 . . . . 0.0 112.357 -172.568 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 5.2 mt -104.65 156.06 18.31 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 126.744 2.018 . . . . 0.0 111.104 175.19 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 18.3 t -73.57 165.89 24.25 Favored 'General case' 0 N--CA 1.479 0.99 0 O-C-N 121.965 -0.459 . . . . 0.0 110.396 167.54 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -59.57 -43.18 93.68 Favored 'General case' 0 CA--C 1.542 0.656 0 O-C-N 120.461 -1.399 . . . . 0.0 112.824 -173.724 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 10.2 tt0 -73.47 -41.88 62.6 Favored 'General case' 0 N--CA 1.469 0.524 0 O-C-N 121.299 -0.875 . . . . 0.0 111.43 175.743 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 30.4 mm-40 -57.06 -43.42 82.02 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 123.894 0.877 . . . . 0.0 111.032 176.637 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 40.8 ttmt -60.14 -42.31 94.57 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 124.981 1.313 . . . . 0.0 111.651 176.733 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 47.1 mt -68.88 -40.87 81.73 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 CA-C-O 118.413 -0.803 . . . . 0.0 111.053 177.535 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 43.6 mt -63.91 -44.22 97.95 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.933 0 CA-C-N 120.307 1.412 . . . . 0.0 110.385 177.705 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -59.22 -50.07 75.44 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.681 1.193 . . . . 0.0 110.396 176.105 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -65.68 -50.68 64.04 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.346 1.058 . . . . 0.0 112.93 -179.576 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.8 mm-40 -60.89 -24.38 65.92 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 118.997 0.817 . . . . 0.0 113.13 -179.145 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.435 ' CE2' HG22 ' A' ' 55' ' ' ILE . 1.7 t80 -73.23 -58.17 3.5 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 123.714 0.806 . . . . 0.0 111.31 175.865 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 15.3 mt -59.91 -33.79 53.91 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.583 0 C-N-CA 125.903 1.681 . . . . 0.0 111.629 175.815 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -69.78 -22.4 63.34 Favored 'General case' 0 CA--C 1.545 0.771 0 O-C-N 121.267 -0.895 . . . . 0.0 113.293 175.372 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -93.76 -32.96 13.78 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 124.526 1.13 . . . . 0.0 112.732 178.539 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 10.5 m -120.15 -19.68 5.04 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.911 0 N-CA-C 114.005 1.113 . . . . 0.0 114.005 -174.094 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 83.58 142.56 5.02 Favored Glycine 0 CA--C 1.531 1.052 0 C-N-CA 124.802 1.192 . . . . 0.0 112.145 -171.486 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 2.2 tt -65.48 -11.19 40.94 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 114.928 1.455 . . . . 0.0 114.928 -170.219 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 38.8 mt-30 -80.18 -20.69 44.19 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.672 1.589 . . . . 0.0 112.921 174.813 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 69.5 m-80 -109.63 -7.07 15.16 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 114.4 1.259 . . . . 0.0 114.4 -171.793 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.435 HG22 ' CE2' ' A' ' 46' ' ' TYR . 16.5 pt -71.85 160.67 5.15 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 C-N-CA 123.676 0.791 . . . . 0.0 111.492 166.689 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.1 p -130.81 144.77 51.69 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 125.357 1.463 . . . . 0.0 109.991 173.923 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -62.98 -27.83 69.68 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 123.935 0.894 . . . . 0.0 112.239 176.679 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -62.83 -52.04 64.44 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.313 0 C-N-CA 125.41 1.484 . . . . 0.0 109.144 174.043 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 58.6 m -73.83 -42.89 60.22 Favored 'General case' 0 C--O 1.223 -0.303 0 C-N-CA 123.357 0.663 . . . . 0.0 110.442 -177.968 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 18.4 tp -59.79 -35.31 74.41 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.413 1.085 . . . . 0.0 111.996 174.819 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.489 ' HA ' HG13 ' A' ' 66' ' ' ILE . 47.7 t -55.39 -34.37 64.3 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 124.132 0.973 . . . . 0.0 113.124 170.156 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.1 -22.41 16.24 Favored 'General case' 0 CA--C 1.534 0.362 0 N-CA-C 114.533 1.308 . . . . 0.0 114.533 -177.448 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 68.0 mmtt -64.1 -38.44 91.06 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 119.508 1.049 . . . . 0.0 111.154 173.744 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.2 mp -112.34 -0.2 15.48 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 125.315 1.446 . . . . 0.0 114.363 -173.162 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 48.8 m-80 54.39 47.84 21.99 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 125.459 1.504 . . . . 0.0 112.84 -172.569 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.489 HG13 ' HA ' ' A' ' 61' ' ' SER . 8.2 pt -104.35 -162.63 0.14 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.766 0 C-N-CA 126.456 1.902 . . . . 0.0 110.849 178.72 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -100.2 159.22 15.28 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 124.364 1.066 . . . . 0.0 110.4 167.701 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 67.7 t -60.96 -29.18 45.06 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.958 0 O-C-N 121.634 -0.666 . . . . 0.0 111.26 172.425 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 85.6 mt-10 -80.16 -34.11 37.88 Favored 'General case' 0 N--CA 1.466 0.357 0 O-C-N 120.953 -1.092 . . . . 0.0 110.092 -178.766 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 13.5 tttp -69.7 -44.38 70.52 Favored 'General case' 0 C--N 1.345 0.378 0 C-N-CA 124.287 1.035 . . . . 0.0 110.344 175.984 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -59.85 -46.75 88.3 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 125.843 1.657 . . . . 0.0 112.688 173.293 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 38.8 ttmt -75.28 -25.12 57.71 Favored 'General case' 0 CA--C 1.518 -0.28 0 C-N-CA 124.099 0.96 . . . . 0.0 111.799 -172.42 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -52.79 -50.11 64.24 Favored 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 118.138 0.426 . . . . 0.0 110.47 171.597 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 19.0 m-85 -62.15 -39.16 91.67 Favored 'General case' 0 C--N 1.34 0.183 0 C-N-CA 124.113 0.965 . . . . 0.0 111.319 -175.847 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 73.8 mt -68.04 -37.78 78.79 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.409 0 C-N-CA 123.956 0.902 . . . . 0.0 110.122 179.4 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 15.8 ttmt -73.0 -40.42 65.24 Favored 'General case' 0 C--N 1.344 0.333 0 C-N-CA 124.338 1.055 . . . . 0.0 112.533 -176.618 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 23.9 p30 -90.97 -44.32 9.41 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 123.324 0.65 . . . . 0.0 111.696 -178.035 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 1.3 t -88.28 45.14 1.25 Allowed 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 115.013 1.486 . . . . 0.0 115.013 -175.772 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -88.29 -37.58 15.88 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 115.454 1.65 . . . . 0.0 115.454 -163.527 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -108.2 -5.91 16.65 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 124.755 1.222 . . . . 0.0 113.657 175.44 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 9.4 tt -74.37 -37.67 63.39 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 124.282 1.033 . . . . 0.0 111.278 170.95 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -79.77 43.02 2.54 Favored Glycine 0 CA--C 1.537 1.42 0 C-N-CA 124.186 0.898 . . . . 0.0 114.994 179.433 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 16.7 mmt85 -127.77 -178.52 4.53 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 126.295 1.838 . . . . 0.0 112.606 -173.586 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 6.4 t -124.98 5.73 7.97 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 126.865 2.066 . . . . 0.0 113.904 -174.93 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 75.4 m-20 -85.36 54.94 3.29 Favored 'General case' 0 CA--C 1.547 0.852 0 O-C-N 120.568 -1.332 . . . . 0.0 112.988 -168.175 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 1.7 p-10 -134.71 19.1 3.55 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 126.025 1.73 . . . . 0.0 113.519 -172.845 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -144.81 45.85 1.36 Allowed 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.635 1.174 . . . . 0.0 110.984 -167.791 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 64.9 tttm -101.81 -25.31 13.86 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 125.801 1.64 . . . . 0.0 112.44 178.845 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 8.9 t -158.07 120.22 3.69 Favored 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 125.897 1.679 . . . . 0.0 109.547 -179.737 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -146.26 3.16 0.18 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.809 0 N-CA-C 114.117 1.154 . . . . 0.0 114.117 -175.543 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 69.79 7.79 59.44 Favored Glycine 0 CA--C 1.54 1.619 0 O-C-N 120.572 -1.33 . . . . 0.0 114.568 -169.288 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . 0.258 21.5 mm 56.98 24.06 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.112 0 C-N-CA 127.272 2.229 . . . . 0.0 113.021 174.756 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 11.3 tp 53.44 22.07 2.71 Favored 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 126.41 1.884 . . . . 0.0 114.306 -171.128 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 16.5 mm100 -98.2 -32.71 11.44 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 125.61 1.564 . . . . 0.0 112.505 -179.959 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -139.08 145.4 39.47 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 125.329 1.452 . . . . 0.0 111.384 177.825 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -145.47 111.04 5.39 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.792 1.237 . . . . 0.0 110.512 176.223 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 57.8 t -141.26 133.65 29.5 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 C-N-CA 125.333 1.453 . . . . 0.0 109.651 178.936 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 42.7 t -162.94 -71.43 0.05 OUTLIER 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 123.701 0.8 . . . . 0.0 112.498 175.322 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 60.8 p -85.85 -20.57 28.92 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 124.881 1.272 . . . . 0.0 113.956 -176.179 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 97.0 mtp -124.02 113.79 18.89 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 126.076 1.75 . . . . 0.0 109.199 176.035 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -142.62 74.21 1.44 Allowed 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.084 1.354 . . . . 0.0 109.757 -177.461 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -147.39 147.88 30.74 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 124.779 1.232 . . . . 0.0 112.144 -179.076 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 30.1 mtpp -138.32 142.72 39.73 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 125.946 1.698 . . . . 0.0 110.751 177.47 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 52.2 m -139.77 67.95 1.37 Allowed 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 124.794 1.238 . . . . 0.0 111.619 -171.806 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 10.3 mmt -133.37 167.58 20.15 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.217 1.407 . . . . 0.0 113.432 -179.174 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 11.6 t -140.02 160.61 39.55 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 126.71 2.004 . . . . 0.0 111.419 -178.475 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 41.2 t-105 . . . . . 0 C--O 1.253 1.249 0 C-N-CA 125.976 1.71 . . . . 0.0 112.845 -170.911 . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.523 0 N-CA-C 111.993 -0.443 . . . . 0.0 111.993 . . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 52.7 m -107.33 115.73 30.69 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 124.727 1.211 . . . . 0.0 111.585 -176.23 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 96.2 m-70 -139.16 -57.17 0.6 Allowed 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.503 1.121 . . . . 0.0 113.021 179.969 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 11.9 tpt -148.11 57.25 1.08 Allowed 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 124.347 1.059 . . . . 0.0 111.937 -174.759 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -151.0 148.37 28.29 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 124.367 1.067 . . . . 0.0 112.713 179.945 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 30.2 t -156.48 124.16 5.49 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 125.038 1.335 . . . . 0.0 110.934 175.525 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 11.2 mmt -140.29 7.01 2.16 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 125.193 1.397 . . . . 0.0 114.203 -178.819 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 46.5 t0 -148.4 108.76 3.62 Favored Pre-proline 0 CA--C 1.549 0.939 0 O-C-N 121.065 -1.022 . . . . 0.0 112.312 -178.183 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 65.2 Cg_endo -83.8 -2.09 10.21 Favored 'Trans proline' 0 C--N 1.351 0.682 0 C-N-CA 123.828 3.019 . . . . 0.0 114.712 178.333 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 96.8 mt -120.8 39.35 3.8 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 126.212 1.805 . . . . 0.0 111.78 -175.576 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -106.13 -3.58 21.31 Favored 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 114.253 1.205 . . . . 0.0 114.253 176.533 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.09 -57.06 2.31 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 124.233 1.013 . . . . 0.0 113.112 -161.017 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.9 pp -129.05 12.22 2.67 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.794 0 C-N-CA 126.389 1.876 . . . . 0.0 112.863 -175.118 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 8.4 tt -42.34 105.73 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.082 0 C-N-CA 126.0 1.72 . . . . 0.0 113.46 -176.459 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 4.3 t30 -150.52 10.94 0.67 Allowed 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 114.878 1.436 . . . . 0.0 114.878 179.87 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -81.6 5.25 18.7 Favored 'General case' 0 CA--C 1.545 0.771 0 N-CA-C 115.147 1.536 . . . . 0.0 115.147 -168.53 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 13.5 tt -148.33 27.57 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 C-N-CA 125.616 1.566 . . . . 0.0 113.975 -172.717 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 52.7 mtmt -120.04 -51.04 2.24 Favored 'General case' 0 N--CA 1.477 0.883 0 N-CA-C 113.981 1.104 . . . . 0.0 113.981 176.555 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 14.2 ptpt -168.19 136.98 2.37 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 125.259 1.424 . . . . 0.0 112.802 -174.031 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 11.7 tt0 -156.82 16.63 0.3 Allowed 'General case' 0 CA--C 1.554 1.118 0 N-CA-C 113.957 1.095 . . . . 0.0 113.957 176.378 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -140.07 158.62 43.76 Favored 'General case' 0 CA--C 1.543 0.701 0 O-C-N 120.584 -1.323 . . . . 0.0 113.675 -169.54 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 9.4 t-20 -85.56 -36.74 20.25 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 124.369 1.067 . . . . 0.0 113.407 -174.428 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 -147.11 123.51 10.99 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 125.872 1.669 . . . . 0.0 110.793 172.914 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 67.5 m -144.86 43.56 1.35 Allowed 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 125.221 1.409 . . . . 0.0 112.771 -177.431 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -156.9 57.71 0.37 Allowed Glycine 0 N--CA 1.47 0.904 0 O-C-N 121.348 -0.845 . . . . 0.0 114.395 -176.998 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 11.0 p -142.08 16.81 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 C-N-CA 125.361 1.465 . . . . 0.0 112.87 -171.592 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -138.51 149.39 45.33 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 125.107 1.363 . . . . 0.0 111.833 -169.781 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 2.3 mp -105.11 31.25 4.98 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 125.498 1.519 . . . . 0.0 113.264 -169.8 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -150.84 87.32 4.75 Favored Pre-proline 0 CA--C 1.549 0.912 0 C-N-CA 124.341 1.056 . . . . 0.0 111.234 -157.098 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -77.18 -29.65 4.87 Favored 'Trans proline' 0 CA--C 1.54 0.795 0 C-N-CA 123.122 2.548 . . . . 0.0 114.1 -169.137 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 1.9 tt -147.75 61.04 1.14 Allowed 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 125.005 1.322 . . . . 0.0 109.374 178.149 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 51.2 m 60.56 168.76 0.09 Allowed 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 125.502 1.521 . . . . 0.0 113.778 -165.203 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 70.5 t 63.41 148.53 0.1 OUTLIER Pre-proline 0 N--CA 1.483 1.186 0 C-N-CA 127.224 2.21 . . . . 0.0 113.873 -178.173 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 64.6 Cg_endo -65.98 79.38 0.29 Allowed 'Trans proline' 0 CA--C 1.544 0.997 0 C-N-CA 122.939 2.426 . . . . 0.0 110.923 165.146 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 53.8 tptt 43.44 86.99 0.12 Allowed Pre-proline 0 N--CA 1.48 1.073 0 C-N-CA 129.735 3.214 . . . . 0.0 114.568 176.44 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -67.24 155.88 68.66 Favored 'Trans proline' 0 CA--C 1.541 0.84 0 C-N-CA 123.178 2.585 . . . . 0.0 113.343 -177.641 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 59.7 pttt -60.39 151.84 26.96 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 125.111 1.365 . . . . 0.0 113.698 -176.089 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 29.6 tp -141.95 149.69 40.44 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 126.143 1.777 . . . . 0.0 110.258 179.29 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -145.13 50.07 1.25 Allowed 'General case' 0 N--CA 1.475 0.822 0 CA-C-O 122.949 1.357 . . . . 0.0 112.804 -179.233 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 25.5 mt-10 -111.68 89.16 2.98 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 125.287 1.435 . . . . 0.0 112.446 -175.757 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.1 mt -132.66 152.98 51.54 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 127.661 2.384 . . . . 0.0 109.26 170.065 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 70.0 m -71.48 164.64 25.43 Favored 'General case' 0 N--CA 1.481 1.077 0 O-C-N 121.788 -0.57 . . . . 0.0 110.5 169.559 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -55.89 -43.76 77.55 Favored 'General case' 0 N--CA 1.481 1.078 0 O-C-N 120.492 -1.38 . . . . 0.0 113.181 -174.949 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 11.6 tt0 -72.24 -41.42 66.82 Favored 'General case' 0 CA--C 1.536 0.442 0 O-C-N 121.549 -0.719 . . . . 0.0 111.537 175.47 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 86.8 mt-30 -62.4 -39.29 92.75 Favored 'General case' 0 N--CA 1.466 0.374 0 O-C-N 121.657 -0.652 . . . . 0.0 111.79 178.465 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 40.0 ttmt -60.81 -41.32 95.45 Favored 'General case' 0 N--CA 1.465 0.281 0 C-N-CA 123.987 0.915 . . . . 0.0 110.625 175.764 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 46.7 mt -67.86 -43.46 86.03 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 CA-C-O 118.332 -0.842 . . . . 0.0 111.266 176.673 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 45.5 mt -64.74 -44.78 96.48 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.956 0 CA-C-N 120.518 1.508 . . . . 0.0 110.481 179.314 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -58.63 -48.77 79.88 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.434 1.494 . . . . 0.0 110.87 176.154 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -64.0 -51.7 63.0 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 124.042 0.937 . . . . 0.0 112.333 176.939 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 13.9 mm-40 -59.75 -23.0 62.86 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 119.318 0.963 . . . . 0.0 113.394 -179.745 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.443 ' CE2' HG22 ' A' ' 55' ' ' ILE . 1.4 t80 -71.47 -64.15 0.98 Allowed 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 119.001 0.819 . . . . 0.0 110.824 172.905 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 27.4 mt -58.84 -34.61 52.81 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 C-N-CA 126.534 1.934 . . . . 0.0 112.019 178.862 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -71.71 -23.45 61.64 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.265 1.026 . . . . 0.0 112.996 177.721 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -91.44 -36.28 13.87 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 124.327 1.051 . . . . 0.0 112.624 176.109 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 19.4 m -112.66 -23.56 4.32 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.269 0 N-CA-C 115.326 1.602 . . . . 0.0 115.326 -174.385 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 83.86 139.16 3.89 Favored Glycine 0 CA--C 1.533 1.183 0 C-N-CA 124.916 1.246 . . . . 0.0 112.288 -167.845 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.2 tt -65.64 -7.94 17.78 Favored 'General case' 0 CA--C 1.551 0.992 0 N-CA-C 114.16 1.17 . . . . 0.0 114.16 -173.4 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 37.7 mt-30 -74.26 -19.3 60.55 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 126.411 1.884 . . . . 0.0 113.566 -178.548 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 13.5 p30 -130.7 2.34 4.47 Favored 'General case' 0 N--CA 1.476 0.868 0 N-CA-C 115.741 1.756 . . . . 0.0 115.741 -176.166 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.443 HG22 ' CE2' ' A' ' 46' ' ' TYR . 31.2 pt -63.01 156.98 4.33 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.655 0 CA-C-N 118.797 0.726 . . . . 0.0 111.707 164.826 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -130.63 144.79 51.67 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 125.139 1.376 . . . . 0.0 110.631 176.063 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -62.97 -26.39 68.81 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 124.005 0.922 . . . . 0.0 112.256 175.923 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -66.35 -41.07 88.27 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.502 0 C-N-CA 125.415 1.486 . . . . 0.0 110.562 174.222 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 98.7 m -80.84 -43.65 19.64 Favored 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 123.23 0.612 . . . . 0.0 109.738 -179.289 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.4 tt -66.06 -33.45 75.82 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 124.648 1.179 . . . . 0.0 112.333 178.158 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.444 ' HA ' HG13 ' A' ' 66' ' ' ILE . 60.4 p -60.91 -26.28 67.34 Favored 'General case' 0 N--CA 1.475 0.795 0 CA-C-N 119.232 0.924 . . . . 0.0 112.978 169.878 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -96.32 -31.27 12.97 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 125.026 1.33 . . . . 0.0 113.39 -178.497 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 8.3 mmtm -61.06 -36.53 79.85 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 125.255 1.422 . . . . 0.0 111.75 175.7 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.1 mt -118.22 9.31 12.53 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 125.678 1.591 . . . . 0.0 113.654 -171.1 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . 0.291 7.4 p30 47.31 60.32 3.53 Favored 'General case' 0 CA--C 1.551 0.996 0 C-N-CA 126.771 2.029 . . . . 0.0 114.132 -176.821 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.444 HG13 ' HA ' ' A' ' 61' ' ' SER . 0.6 OUTLIER -130.64 178.5 5.34 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 127.788 2.435 . . . . 0.0 111.359 -173.438 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.1 p -79.56 158.88 27.05 Favored 'General case' 0 N--CA 1.477 0.91 0 O-C-N 121.011 -1.056 . . . . 0.0 111.598 173.337 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 86.3 t -63.7 -29.94 48.59 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.029 0 O-C-N 121.628 -0.67 . . . . 0.0 111.36 172.468 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -76.68 -38.4 54.54 Favored 'General case' 0 N--CA 1.468 0.468 0 O-C-N 120.985 -1.072 . . . . 0.0 109.951 -178.344 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 5.6 tmtm? -65.06 -47.92 75.61 Favored 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 125.56 1.544 . . . . 0.0 110.771 176.359 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -60.62 -43.03 97.94 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 125.95 1.7 . . . . 0.0 113.479 174.062 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 34.8 ttmt -72.31 -27.09 62.22 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 124.633 1.173 . . . . 0.0 111.657 -179.352 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -56.91 -43.11 81.07 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-O 119.02 -0.515 . . . . 0.0 111.245 177.419 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 65.2 m-85 -60.9 -42.74 98.64 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 124.922 1.289 . . . . 0.0 111.571 175.243 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 62.5 mt -69.23 -21.05 24.85 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.765 0 C-N-CA 124.457 1.103 . . . . 0.0 111.168 -179.855 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 30.3 mmtm -92.96 -23.46 18.71 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 125.656 1.582 . . . . 0.0 113.394 178.547 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 10.3 p30 -104.05 -35.31 8.13 Favored 'General case' 0 N--CA 1.468 0.466 0 N-CA-C 113.822 1.045 . . . . 0.0 113.822 177.986 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 5.2 t -86.82 -12.18 48.74 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 114.218 1.192 . . . . 0.0 114.218 -170.974 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 20.1 p30 -64.38 -10.81 27.1 Favored 'General case' 0 CA--C 1.547 0.833 0 N-CA-C 116.366 1.988 . . . . 0.0 116.366 -170.294 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -85.58 -9.71 56.93 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.874 1.27 . . . . 0.0 113.599 179.078 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.6 tt -84.31 -46.14 12.09 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.561 1.144 . . . . 0.0 112.171 -175.489 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 71.24 -96.27 0.62 Allowed Glycine 0 CA--C 1.533 1.187 0 C-N-CA 123.701 0.667 . . . . 0.0 112.524 177.498 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -101.36 -70.82 0.73 Allowed 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 125.114 1.366 . . . . 0.0 110.706 173.813 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 2.7 t -162.57 110.14 1.3 Allowed 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 126.089 1.755 . . . . 0.0 109.302 -179.867 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 65.7 m-80 -147.03 137.95 23.82 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.992 1.317 . . . . 0.0 110.765 -174.746 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 12.3 m120 -146.93 158.01 43.8 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.284 1.434 . . . . 0.0 112.305 178.581 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 11.2 mp -88.93 -64.49 1.14 Allowed 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 113.342 0.867 . . . . 0.0 113.342 -174.506 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 14.2 pttm -144.86 26.44 1.38 Allowed 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 126.822 2.049 . . . . 0.0 113.797 -174.988 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 13.6 t -148.04 116.47 6.59 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 124.977 1.311 . . . . 0.0 110.199 -172.819 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -138.48 8.06 0.68 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.789 0 C-N-CA 124.996 1.319 . . . . 0.0 113.048 -179.572 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 74.82 -9.66 10.76 Favored Glycine 0 CA--C 1.542 1.742 0 C-N-CA 124.894 1.235 . . . . 0.0 115.311 -173.606 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . 0.273 35.2 mm 63.01 45.19 0.2 Allowed 'Isoleucine or valine' 0 CA--C 1.551 1.012 0 C-N-CA 125.715 1.606 . . . . 0.0 111.611 -176.689 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER 45.71 51.64 10.07 Favored 'General case' 0 CA--C 1.552 1.033 0 C-N-CA 127.07 2.148 . . . . 0.0 114.232 168.722 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 11.7 mt-30 -134.01 15.48 3.88 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 125.693 1.597 . . . . 0.0 112.964 -171.58 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 11.0 mp0 -99.51 43.24 1.07 Allowed 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 126.808 2.043 . . . . 0.0 112.427 -170.276 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 24.5 tt0 -126.21 45.33 2.67 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 125.162 1.385 . . . . 0.0 112.325 -174.969 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 15.2 t -140.64 68.17 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 C-N-CA 124.978 1.311 . . . . 0.0 110.691 -179.911 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 36.0 t -161.49 -72.02 0.06 Allowed 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.375 0.67 . . . . 0.0 112.636 169.946 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 46.2 m -90.19 -22.67 21.57 Favored 'General case' 0 N--CA 1.478 0.972 0 N-CA-C 113.815 1.043 . . . . 0.0 113.815 -173.391 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 7.4 tpt -144.41 136.1 25.84 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 125.668 1.587 . . . . 0.0 109.358 174.823 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 13.6 tt0 -148.52 29.18 0.86 Allowed 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 124.191 0.996 . . . . 0.0 112.009 -172.904 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -123.59 151.18 43.23 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 125.326 1.45 . . . . 0.0 112.83 -171.678 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 52.2 mtmt -93.37 137.05 33.05 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 125.474 1.509 . . . . 0.0 111.149 177.635 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 23.4 t -149.38 124.21 9.9 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 124.912 1.285 . . . . 0.0 110.575 175.632 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 60.5 mtm -146.29 164.78 31.27 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 126.319 1.848 . . . . 0.0 111.284 -174.085 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 9.9 t -121.87 163.58 18.98 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 125.235 1.414 . . . . 0.0 112.107 173.958 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 39.5 t-105 . . . . . 0 C--O 1.252 1.216 0 C-N-CA 126.15 1.78 . . . . 0.0 112.902 -170.964 . . . . . . . . 0 0 . 1 . 026 nuclear build full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.596 0 N-CA-C 111.79 -0.524 . . . . 0.0 111.79 . . . . . . . . . 0 0 . 1 . 026 nuclear build full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 23.5 m -117.1 4.94 12.73 Favored 'General case' 0 N--CA 1.481 1.115 0 N-CA-C 114.517 1.303 . . . . 0.0 114.517 -171.997 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 9.0 t60 -73.7 131.54 41.73 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.035 0.934 . . . . 0.0 111.419 -179.211 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -151.61 149.95 29.73 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.446 1.098 . . . . 0.0 111.813 -176.076 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -82.87 153.91 24.9 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 124.22 1.008 . . . . 0.0 113.508 -179.291 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 46.9 m -144.53 142.94 30.57 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 126.319 1.847 . . . . 0.0 110.912 -176.258 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 79.7 mtp -135.29 14.31 3.51 Favored 'General case' 0 N--CA 1.48 1.026 0 N-CA-C 114.083 1.142 . . . . 0.0 114.083 -174.207 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 10.9 t0 -88.2 123.69 68.06 Favored Pre-proline 0 CA--C 1.553 1.082 0 C-N-CA 124.422 1.089 . . . . 0.0 112.027 -175.49 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_endo -87.68 0.2 7.2 Favored 'Trans proline' 0 C--N 1.353 0.779 0 C-N-CA 123.607 2.871 . . . . 0.0 115.224 -178.136 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 74.8 mt -109.85 28.78 8.24 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 124.874 1.27 . . . . 0.0 113.94 -171.376 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -99.15 -5.52 29.94 Favored 'General case' 0 N--CA 1.478 0.93 0 N-CA-C 115.661 1.726 . . . . 0.0 115.661 176.889 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -130.47 -30.58 1.89 Allowed 'General case' 0 N--CA 1.481 1.109 0 N-CA-C 117.17 2.285 . . . . 0.0 117.17 -169.066 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.5 pp -135.4 17.82 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.334 0 C-N-CA 125.337 1.455 . . . . 0.0 113.601 -177.531 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 13.1 tt -51.22 135.16 11.87 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 C-N-CA 125.289 1.435 . . . . 0.0 112.876 -176.826 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -156.24 124.74 5.84 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.876 1.27 . . . . 0.0 110.097 -175.762 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 18.9 p-10 -163.23 62.82 0.18 Allowed 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 122.654 1.216 . . . . 0.0 110.793 -178.101 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 52.5 mt 53.31 59.01 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.75 0 C-N-CA 126.125 1.77 . . . . 0.0 110.378 -173.797 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 4.3 tmmm? -154.12 -42.19 0.09 Allowed 'General case' 0 N--CA 1.475 0.823 0 CA-C-N 114.807 -1.088 . . . . 0.0 113.67 -177.447 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.2 mmmt -107.97 68.19 0.7 Allowed 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 125.54 1.536 . . . . 0.0 112.44 -176.114 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -141.12 11.63 2.18 Favored 'General case' 0 N--CA 1.481 1.081 0 N-CA-C 115.735 1.754 . . . . 0.0 115.735 -174.031 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -79.6 -41.17 27.67 Favored 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 114.101 1.148 . . . . 0.0 114.101 -172.938 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 26.2 m120 -147.18 90.84 1.92 Allowed 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 125.356 1.462 . . . . 0.0 110.255 -176.429 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 12.0 m-20 -136.81 97.13 3.46 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 124.852 1.261 . . . . 0.0 110.534 -175.022 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 25.0 t -146.61 116.76 7.36 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 125.165 1.386 . . . . 0.0 110.105 175.693 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 127.02 -17.4 6.3 Favored Glycine 0 CA--C 1.535 1.294 0 C-N-CA 125.76 1.647 . . . . 0.0 114.739 177.199 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 2.6 p -117.7 100.3 9.87 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.581 0 C-N-CA 126.126 1.771 . . . . 0.0 109.444 175.192 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -154.61 169.55 23.59 Favored 'General case' 0 N--CA 1.474 0.768 0 CA-C-O 121.977 0.894 . . . . 0.0 113.132 -177.209 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 14.1 mt -86.1 18.15 3.22 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 126.59 1.956 . . . . 0.0 113.886 -167.908 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -156.78 140.69 11.57 Favored Pre-proline 0 CA--C 1.55 0.97 0 C-N-CA 127.337 2.255 . . . . 0.0 110.801 -164.133 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 69.3 Cg_endo -85.26 -24.53 1.99 Allowed 'Trans proline' 0 CA--C 1.542 0.901 0 C-N-CA 122.963 2.442 . . . . 0.0 114.0 -175.34 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.462 ' HG ' ' H ' ' A' ' 26' ' ' SER . 6.7 tp -153.94 -159.25 0.95 Allowed 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 126.521 1.928 . . . . 0.0 109.382 -175.608 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.462 ' H ' ' HG ' ' A' ' 25' ' ' LEU . 46.6 p -74.65 41.55 0.15 Allowed 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 127.341 2.256 . . . . 0.0 114.003 177.114 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 8.5 p -151.44 142.18 15.06 Favored Pre-proline 0 CA--C 1.541 0.627 0 C-N-CA 126.269 1.828 . . . . 0.0 110.547 -170.753 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -77.86 60.96 7.46 Favored 'Trans proline' 0 CA--C 1.547 1.162 0 C-N-CA 123.909 3.073 . . . . 0.0 111.774 176.511 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 21.8 tptp 62.15 125.85 0.02 OUTLIER Pre-proline 0 N--CA 1.481 1.104 0 C-N-CA 129.466 3.106 . . . . 0.0 114.3 -169.584 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_endo -74.77 152.36 41.9 Favored 'Trans proline' 0 CA--C 1.539 0.764 0 C-N-CA 122.728 2.285 . . . . 0.0 111.386 173.533 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 56.0 mtmt -80.61 143.2 33.33 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 123.97 0.908 . . . . 0.0 111.861 -179.598 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.1 tp -151.29 132.98 14.89 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 127.094 2.158 . . . . 0.0 108.374 -177.399 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 22.3 mm-40 -146.05 77.49 1.49 Allowed 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 125.766 1.626 . . . . 0.0 109.276 -176.11 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -133.35 75.49 1.62 Allowed 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 124.469 1.108 . . . . 0.0 111.902 -173.881 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.3 mt -109.29 152.73 24.86 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 126.51 1.924 . . . . 0.0 110.609 174.067 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 21.4 t -73.15 166.76 22.51 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 123.053 0.541 . . . . 0.0 110.509 166.95 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -57.52 -44.54 85.13 Favored 'General case' 0 N--CA 1.475 0.794 0 O-C-N 120.705 -1.247 . . . . 0.0 112.744 -175.131 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -74.58 -36.16 63.02 Favored 'General case' 0 N--CA 1.47 0.554 0 O-C-N 121.509 -0.744 . . . . 0.0 112.317 176.045 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 30.0 mm-40 -63.19 -41.47 99.19 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 123.669 0.788 . . . . 0.0 110.438 177.896 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 21.4 ttmm -60.02 -42.59 94.67 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 124.3 1.04 . . . . 0.0 111.159 176.18 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 46.5 mt -69.28 -42.6 81.44 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 CA-C-O 118.341 -0.838 . . . . 0.0 111.115 178.466 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 31.6 mt -63.67 -42.85 97.43 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 CA-C-N 120.586 1.539 . . . . 0.0 110.518 178.218 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -58.47 -47.69 83.23 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.629 1.172 . . . . 0.0 110.621 174.795 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -67.53 -50.42 58.82 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.569 1.147 . . . . 0.0 113.12 -179.597 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -60.46 -26.16 66.56 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-N 118.991 0.814 . . . . 0.0 113.188 -179.625 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 2.1 t80 -74.24 -54.37 7.86 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 123.606 0.762 . . . . 0.0 111.447 177.249 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 45.8 mt -58.81 -35.01 53.86 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 C-N-CA 125.053 1.341 . . . . 0.0 111.23 173.168 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -68.0 -21.07 65.06 Favored 'General case' 0 CA--C 1.547 0.835 0 N-CA-C 113.37 0.878 . . . . 0.0 113.37 175.655 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -95.34 -30.39 13.96 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.833 1.253 . . . . 0.0 113.165 178.406 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 7.7 m -124.54 -22.46 2.48 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 CA-C-N 119.695 1.134 . . . . 0.0 114.049 -173.659 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 89.12 143.96 10.14 Favored Glycine 0 CA--C 1.534 1.256 0 C-N-CA 125.56 1.552 . . . . 0.0 113.246 -172.96 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 58.2 tp -60.08 -17.96 43.49 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 125.707 1.603 . . . . 0.0 115.243 -172.218 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 1.2 pm0 -88.55 -13.4 40.21 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.13 1.372 . . . . 0.0 114.5 176.495 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 77.7 m-20 -110.83 -11.68 14.35 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 114.45 1.278 . . . . 0.0 114.45 -175.084 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 32.2 pt -64.38 156.46 5.46 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 C-N-CA 123.379 0.672 . . . . 0.0 111.205 166.101 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -126.81 144.05 51.08 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 124.752 1.221 . . . . 0.0 110.591 173.886 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -60.62 -26.73 67.23 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.723 0.809 . . . . 0.0 112.099 174.0 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 27.9 mm -63.9 -53.58 42.43 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.396 0 C-N-CA 124.831 1.252 . . . . 0.0 110.6 174.005 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 79.5 m -72.16 -41.52 67.0 Favored 'General case' 0 C--O 1.223 -0.338 0 C-N-CA 123.735 0.814 . . . . 0.0 109.895 -178.331 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 21.0 tp -62.86 -36.88 84.71 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.938 1.295 . . . . 0.0 111.868 177.052 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.498 ' HA ' HG13 ' A' ' 66' ' ' ILE . 43.5 t -54.04 -32.67 55.19 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 124.47 1.108 . . . . 0.0 113.143 168.724 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -100.44 -23.3 14.77 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 114.57 1.322 . . . . 0.0 114.57 -175.153 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 68.5 mmtt -65.76 -38.08 88.09 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 125.093 1.357 . . . . 0.0 111.262 172.861 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.4 mp -111.17 -0.61 16.46 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 125.342 1.457 . . . . 0.0 114.431 -173.535 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 42.7 m-80 55.21 49.51 17.12 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 125.535 1.534 . . . . 0.0 112.78 -173.513 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.498 HG13 ' HA ' ' A' ' 61' ' ' SER . 6.2 pt -109.14 -163.4 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 C-N-CA 126.467 1.907 . . . . 0.0 111.022 -179.33 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.2 p -99.16 161.45 13.62 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.33 1.052 . . . . 0.0 110.538 168.435 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 92.3 t -61.05 -29.11 45.05 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 O-C-N 121.601 -0.687 . . . . 0.0 111.196 173.339 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -82.27 -34.31 28.77 Favored 'General case' 0 N--CA 1.472 0.65 0 O-C-N 120.615 -1.303 . . . . 0.0 110.868 179.489 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 4.1 tttp -80.36 -3.83 51.15 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 126.341 1.856 . . . . 0.0 113.379 178.644 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -102.88 -46.35 4.71 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 129.248 3.019 . . . . 0.0 112.84 167.69 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 36.9 ttmt -69.92 -28.77 65.86 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 124.843 1.257 . . . . 0.0 111.14 -175.307 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 42.5 p-10 -45.7 -55.05 6.92 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 123.239 0.616 . . . . 0.0 111.07 171.646 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 25.0 m-85 -55.14 -42.1 72.6 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 126.021 1.728 . . . . 0.0 112.47 -179.844 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 50.5 mt -70.25 -26.53 29.52 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.728 0 C-N-CA 125.745 1.618 . . . . 0.0 111.467 -178.866 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 30.8 mmmt -87.17 -36.31 18.1 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 125.994 1.718 . . . . 0.0 112.27 175.641 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 73.6 m-20 -76.55 -43.3 39.64 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 125.858 1.663 . . . . 0.0 108.692 -175.381 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 68.9 m -124.77 125.52 44.17 Favored 'General case' 0 C--N 1.342 0.251 0 C-N-CA 124.642 1.177 . . . . 0.0 112.678 175.363 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 7.5 t-20 -151.13 -49.16 0.12 Allowed 'General case' 0 CA--C 1.54 0.558 0 N-CA-C 114.108 1.151 . . . . 0.0 114.108 -171.457 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 53.5 mmm-85 -99.87 8.82 43.85 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 125.624 1.569 . . . . 0.0 113.957 -178.503 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 58.7 tp -123.86 -41.35 2.24 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.678 1.591 . . . . 0.0 114.126 -170.424 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -85.52 66.94 3.69 Favored Glycine 0 CA--C 1.535 1.305 0 N-CA-C 115.169 0.828 . . . . 0.0 115.169 -166.232 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 58.4 mtt85 -112.2 -79.01 0.58 Allowed 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 125.031 1.333 . . . . 0.0 112.207 178.436 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 3.3 t -158.58 123.41 4.22 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 123.685 0.794 . . . . 0.0 111.339 177.303 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 58.5 m-80 -142.25 9.54 1.87 Allowed 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 125.391 1.476 . . . . 0.0 112.768 -177.614 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -135.01 18.77 3.45 Favored 'General case' 0 CA--C 1.554 1.102 0 C-N-CA 125.367 1.467 . . . . 0.0 112.633 -167.027 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 6.2 mp -124.78 160.83 27.78 Favored 'General case' 0 CA--C 1.541 0.596 0 C-N-CA 126.141 1.776 . . . . 0.0 110.254 -176.684 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 53.1 pttt -122.02 8.52 9.86 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 126.274 1.83 . . . . 0.0 113.486 -173.717 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 13.4 t -145.7 121.86 10.81 Favored 'General case' 0 N--CA 1.463 0.202 0 C-N-CA 124.974 1.31 . . . . 0.0 109.831 170.195 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -140.27 4.74 0.55 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.814 0 C-N-CA 125.774 1.629 . . . . 0.0 113.183 -177.58 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 67.33 8.8 52.65 Favored Glycine 0 CA--C 1.539 1.561 0 O-C-N 120.751 -1.218 . . . . 0.0 114.633 -170.304 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . 0.265 2.8 mp 49.43 39.18 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 C-N-CA 127.183 2.193 . . . . 0.0 111.805 -179.928 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 9.8 tp 55.01 22.26 4.28 Favored 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 126.764 2.026 . . . . 0.0 114.91 -178.352 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 36.6 mt-30 -137.28 66.23 1.47 Allowed 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.918 1.687 . . . . 0.0 111.264 -167.254 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -98.25 153.36 18.55 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 125.065 1.346 . . . . 0.0 112.451 177.722 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -141.19 39.29 1.76 Allowed 'General case' 0 N--CA 1.479 0.982 0 N-CA-C 114.431 1.271 . . . . 0.0 114.431 -171.488 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 34.4 m -83.34 148.75 4.87 Favored 'Isoleucine or valine' 0 C--O 1.234 0.279 0 C-N-CA 124.71 1.204 . . . . 0.0 112.663 177.662 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 43.4 t -164.96 -73.36 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 124.477 1.111 . . . . 0.0 112.475 168.919 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 18.2 t -74.64 -31.2 61.89 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 123.863 0.865 . . . . 0.0 112.476 -177.98 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 62.5 mtt -128.3 151.4 49.36 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 125.914 1.685 . . . . 0.0 110.742 169.367 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 20.2 tt0 -141.4 19.65 2.22 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 125.393 1.477 . . . . 0.0 111.822 -176.451 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -119.95 105.52 11.14 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 125.257 1.423 . . . . 0.0 112.048 -170.776 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -127.54 8.79 6.48 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 125.802 1.641 . . . . 0.0 113.584 174.581 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 51.2 p -76.25 160.77 29.35 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 125.417 1.487 . . . . 0.0 112.688 175.002 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 3.5 mmt -144.09 162.2 36.85 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 125.398 1.479 . . . . 0.0 112.526 -179.709 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 10.9 t -107.55 166.23 10.82 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 125.529 1.532 . . . . 0.0 111.752 172.522 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 2.9 t-105 . . . . . 0 C--O 1.253 1.284 0 C-N-CA 125.818 1.647 . . . . 0.0 112.772 -171.751 . . . . . . . . 0 0 . 1 . 027 nuclear build full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.52 0 N-CA-C 111.217 -0.753 . . . . 0.0 111.217 . . . . . . . . . 0 0 . 1 . 027 nuclear build full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 6.8 t -145.09 56.45 1.25 Allowed 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 124.853 1.261 . . . . 0.0 111.311 179.97 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 42.2 t-80 -136.09 92.13 2.76 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 125.301 1.441 . . . . 0.0 109.972 -179.239 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 25.5 ptt? -146.12 21.72 1.39 Allowed 'General case' 0 N--CA 1.475 0.822 0 N-CA-C 114.937 1.458 . . . . 0.0 114.937 -170.898 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -153.99 134.29 13.37 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 123.553 0.741 . . . . 0.0 112.758 179.753 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 40.1 m -151.25 103.08 2.98 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 125.981 1.712 . . . . 0.0 110.294 -173.351 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 16.9 ttp -147.77 24.1 1.09 Allowed 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 124.082 0.953 . . . . 0.0 113.112 -179.565 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 -120.42 130.7 24.72 Favored Pre-proline 0 CA--C 1.547 0.833 0 C-N-CA 124.834 1.254 . . . . 0.0 111.848 -171.931 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -80.07 -15.73 11.53 Favored 'Trans proline' 0 C--N 1.352 0.75 0 C-N-CA 123.084 2.522 . . . . 0.0 114.992 -175.454 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 96.9 mt -116.78 42.05 2.57 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 126.165 1.786 . . . . 0.0 111.806 -174.884 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -113.18 1.29 15.2 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 114.307 1.225 . . . . 0.0 114.307 179.241 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -119.22 -56.0 2.11 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 124.767 1.227 . . . . 0.0 113.063 -167.762 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.1 pp -129.72 14.38 2.44 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.875 0 C-N-CA 126.407 1.883 . . . . 0.0 112.892 -173.199 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 9.4 tt -44.73 124.05 0.83 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 C-N-CA 125.12 1.368 . . . . 0.0 112.254 178.074 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -147.1 12.61 1.09 Allowed 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 113.812 1.042 . . . . 0.0 113.812 -176.62 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -88.46 7.86 30.76 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 114.696 1.369 . . . . 0.0 114.696 -171.753 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 14.2 tt -148.71 30.61 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 C-N-CA 125.763 1.625 . . . . 0.0 113.318 -172.034 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 60.0 tttp -131.87 -43.49 0.99 Allowed 'General case' 0 N--CA 1.476 0.837 0 N-CA-C 114.28 1.215 . . . . 0.0 114.28 -179.437 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 52.2 mtmt -129.32 167.83 17.15 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 126.503 1.921 . . . . 0.0 112.436 179.224 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 57.26 35.99 26.8 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 125.76 1.624 . . . . 0.0 113.189 -176.414 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -145.28 -64.17 0.33 Allowed 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 125.202 1.401 . . . . 0.0 112.515 -176.841 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 23.1 t-20 -148.62 126.84 12.15 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.327 1.451 . . . . 0.0 110.294 -177.894 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -143.28 160.46 40.44 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 125.559 1.544 . . . . 0.0 111.314 173.687 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 87.7 p -134.1 3.47 3.42 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 126.016 1.726 . . . . 0.0 114.881 -176.186 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -163.9 105.28 0.25 Allowed Glycine 0 CA--C 1.531 1.056 0 CA-C-N 119.084 0.857 . . . . 0.0 113.414 172.191 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 4.7 t -125.78 40.83 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.072 0 C-N-CA 125.644 1.578 . . . . 0.0 111.011 -174.992 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -149.98 164.45 35.45 Favored 'General case' 0 N--CA 1.478 0.937 0 N-CA-C 114.737 1.384 . . . . 0.0 114.737 -176.768 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -109.79 26.37 10.73 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 126.354 1.862 . . . . 0.0 114.923 -165.684 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -99.54 122.48 51.4 Favored Pre-proline 0 CA--C 1.55 0.95 0 C-N-CA 125.177 1.391 . . . . 0.0 111.45 -172.128 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -78.65 -23.61 8.15 Favored 'Trans proline' 0 CA--C 1.541 0.827 0 C-N-CA 123.061 2.507 . . . . 0.0 113.001 -179.828 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.409 ' HG ' ' H ' ' A' ' 26' ' ' SER . 7.0 tp -148.44 -156.15 0.69 Allowed 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 126.95 2.1 . . . . 0.0 108.989 178.926 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.409 ' H ' ' HG ' ' A' ' 25' ' ' LEU . 56.2 p -75.72 37.42 0.14 Allowed 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 126.608 1.963 . . . . 0.0 114.638 179.687 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 8.8 p -157.07 139.97 10.84 Favored Pre-proline 0 CA--C 1.542 0.668 0 C-N-CA 126.219 1.807 . . . . 0.0 110.934 -169.989 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -77.88 69.09 7.55 Favored 'Trans proline' 0 CA--C 1.545 1.067 0 C-N-CA 124.001 3.134 . . . . 0.0 111.977 179.282 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 28.6 tptt 59.56 105.67 0.03 OUTLIER Pre-proline 0 N--CA 1.481 1.109 0 C-N-CA 128.981 2.912 . . . . 0.0 113.961 -177.046 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 95.6 Cg_endo -75.59 148.92 33.67 Favored 'Trans proline' 0 CA--C 1.54 0.782 0 C-N-CA 122.74 2.293 . . . . 0.0 112.055 -176.592 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 63.6 pttt -63.36 141.67 58.68 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 124.267 1.027 . . . . 0.0 113.073 -177.344 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 29.0 tp -128.01 143.06 51.07 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 125.678 1.591 . . . . 0.0 111.414 -175.129 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 76.8 mm-40 -138.63 64.07 1.5 Allowed 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 125.377 1.471 . . . . 0.0 110.555 -178.127 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 27.6 mt-10 -127.32 68.32 1.29 Allowed 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 125.021 1.329 . . . . 0.0 112.274 -175.683 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.9 mt -123.44 149.92 44.46 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 127.086 2.155 . . . . 0.0 110.044 172.371 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 17.9 m -71.41 167.56 19.33 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 123.749 0.819 . . . . 0.0 110.733 169.293 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -56.25 -45.37 80.06 Favored 'General case' 0 N--CA 1.478 0.94 0 O-C-N 120.591 -1.318 . . . . 0.0 113.357 -174.799 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 10.4 tt0 -74.61 -42.1 59.23 Favored 'General case' 0 N--CA 1.471 0.593 0 O-C-N 121.416 -0.802 . . . . 0.0 111.46 177.004 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 29.2 mm-40 -55.3 -44.94 76.21 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.079 0.952 . . . . 0.0 110.812 176.577 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt -60.55 -42.03 95.76 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 125.058 1.343 . . . . 0.0 111.396 178.457 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 45.4 mt -69.29 -40.59 80.4 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 CA-C-O 118.117 -0.944 . . . . 0.0 111.245 177.912 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 38.2 mt -64.08 -43.05 97.42 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.848 0 CA-C-N 120.256 1.389 . . . . 0.0 110.205 177.301 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -60.24 -47.67 85.01 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.372 1.069 . . . . 0.0 110.931 177.159 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -67.51 -50.29 59.53 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 124.886 1.274 . . . . 0.0 112.328 179.722 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -64.2 -26.06 68.35 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 118.999 0.818 . . . . 0.0 112.783 -176.61 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.462 ' CD1' ' HE2' ' A' ' 63' ' ' LYS . 1.1 t80 -67.61 -58.43 4.69 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 123.913 0.885 . . . . 0.0 110.509 174.421 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.0 mt -62.61 -35.63 71.25 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 C-N-CA 126.539 1.935 . . . . 0.0 111.368 179.512 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -70.96 -26.64 63.25 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 123.881 0.873 . . . . 0.0 112.617 178.25 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -88.11 -38.84 15.05 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.267 1.027 . . . . 0.0 112.541 175.329 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.5 m -108.56 -6.99 10.96 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.147 0 N-CA-C 114.529 1.307 . . . . 0.0 114.529 -172.616 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 87.52 26.46 30.09 Favored Glycine 0 CA--C 1.531 1.056 0 C-N-CA 124.695 1.141 . . . . 0.0 115.476 161.865 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 57.15 10.21 0.8 Allowed 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 127.223 2.209 . . . . 0.0 115.09 -174.957 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 4.7 pt20 -123.27 -3.78 8.44 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 125.141 1.376 . . . . 0.0 113.713 -168.561 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 59.5 m-80 -123.47 0.52 8.85 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.953 1.301 . . . . 0.0 113.196 174.75 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.434 HG22 ' CE2' ' A' ' 46' ' ' TYR . 19.0 pt -74.9 152.33 6.66 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.57 0 CA-C-O 121.099 0.476 . . . . 0.0 111.223 175.125 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -140.04 143.84 36.58 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 124.668 1.187 . . . . 0.0 109.581 179.625 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -60.4 -28.24 68.08 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 123.417 0.687 . . . . 0.0 112.247 179.732 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -64.78 -48.81 82.95 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 C-N-CA 125.467 1.507 . . . . 0.0 110.157 175.222 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 78.2 m -80.71 -41.43 23.65 Favored 'General case' 0 C--O 1.223 -0.326 0 C-N-CA 124.103 0.961 . . . . 0.0 110.202 -174.722 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 20.0 tp -62.51 -35.6 79.9 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 125.214 1.406 . . . . 0.0 112.265 173.448 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.458 ' HA ' HG13 ' A' ' 66' ' ' ILE . 29.6 t -54.51 -33.47 59.96 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.706 1.203 . . . . 0.0 112.366 168.781 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -94.89 -31.85 13.5 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.755 1.222 . . . . 0.0 113.68 -176.322 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.462 ' HE2' ' CD1' ' A' ' 46' ' ' TYR . 1.0 OUTLIER -62.02 -32.75 73.27 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 125.42 1.488 . . . . 0.0 112.52 178.413 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.6 mp -118.6 8.34 11.95 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.751 1.221 . . . . 0.0 114.01 -177.97 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 44.9 m-80 53.37 56.22 7.66 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 126.243 1.817 . . . . 0.0 113.304 -178.659 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.458 HG13 ' HA ' ' A' ' 61' ' ' SER . 1.5 pt -122.08 -168.33 0.5 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.701 0 C-N-CA 127.132 2.173 . . . . 0.0 110.536 -173.738 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 2.4 p -93.48 160.2 14.9 Favored 'General case' 0 N--CA 1.476 0.835 0 O-C-N 121.264 -0.898 . . . . 0.0 111.04 170.641 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 86.9 t -61.73 -29.98 47.39 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 C-N-CA 123.086 0.554 . . . . 0.0 111.271 172.527 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -79.25 -37.73 37.23 Favored 'General case' 0 N--CA 1.468 0.429 0 O-C-N 120.854 -1.154 . . . . 0.0 110.283 -178.224 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 5.2 tmtm? -67.66 -45.31 75.65 Favored 'General case' 0 C--N 1.339 0.138 0 C-N-CA 124.56 1.144 . . . . 0.0 110.741 178.275 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -60.3 -45.86 91.9 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.713 1.605 . . . . 0.0 113.278 170.877 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 33.5 ttmt -69.46 -27.12 64.96 Favored 'General case' 0 N--CA 1.466 0.373 0 O-C-N 121.005 -1.059 . . . . 0.0 111.546 -177.251 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -55.67 -43.67 76.55 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-O 119.372 -0.347 . . . . 0.0 111.334 175.806 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 30.7 m-85 -62.16 -44.35 96.8 Favored 'General case' 0 C--O 1.224 -0.263 0 C-N-CA 125.269 1.428 . . . . 0.0 111.515 177.339 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 65.0 mt -64.59 -30.34 49.94 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.586 0 C-N-CA 123.947 0.899 . . . . 0.0 110.571 178.653 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -77.24 -38.01 52.03 Favored 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 125.0 1.32 . . . . 0.0 113.368 -178.704 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 8.3 p30 -92.86 -41.86 9.83 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 119.105 0.866 . . . . 0.0 111.587 178.841 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 4.9 t -86.2 68.05 10.15 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-O 121.926 0.87 . . . . 0.0 111.252 -176.58 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -133.17 -10.92 2.92 Favored 'General case' 0 CA--C 1.543 0.697 0 N-CA-C 114.449 1.277 . . . . 0.0 114.449 -173.38 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 2.5 mpt_? -103.32 -10.03 19.01 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 125.112 1.365 . . . . 0.0 112.747 171.75 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 9.3 tt -74.36 -30.93 62.21 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.167 1.387 . . . . 0.0 112.019 174.906 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -162.87 152.35 22.48 Favored Glycine 0 CA--C 1.529 0.96 0 C-N-CA 124.558 1.075 . . . . 0.0 112.984 174.698 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 13.6 tpp85 -150.06 -70.4 0.19 Allowed 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 113.708 1.003 . . . . 0.0 113.708 -173.295 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 14.4 t -162.73 23.49 0.1 Allowed 'General case' 0 N--CA 1.483 1.178 0 CA-C-O 122.515 1.15 . . . . 0.0 112.682 -166.658 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 72.5 m-80 -100.33 77.13 1.92 Allowed 'General case' 0 CA--C 1.542 0.637 0 O-C-N 120.409 -1.432 . . . . 0.0 111.485 -171.145 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 13.7 m120 -136.94 160.05 40.05 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.209 1.404 . . . . 0.0 113.285 -178.754 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 9.4 mp -114.25 169.4 9.05 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 127.53 2.332 . . . . 0.0 109.799 178.437 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 19.2 pttp -127.74 14.01 6.94 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 126.11 1.764 . . . . 0.0 113.506 -173.146 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 14.7 t -148.77 127.35 12.41 Favored 'General case' 0 C--O 1.233 0.212 0 C-N-CA 125.459 1.503 . . . . 0.0 109.604 175.488 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -137.69 6.68 0.75 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.732 0 C-N-CA 125.858 1.663 . . . . 0.0 113.228 -176.587 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 64.1 12.81 51.16 Favored Glycine 0 CA--C 1.538 1.52 0 O-C-N 120.776 -1.203 . . . . 0.0 114.184 -169.983 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . 0.273 3.7 mp 51.78 40.83 0.34 Allowed 'Isoleucine or valine' 0 CA--C 1.548 0.875 0 C-N-CA 126.804 2.042 . . . . 0.0 111.312 179.731 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 54.59 23.61 4.79 Favored 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 127.109 2.164 . . . . 0.0 114.759 -179.413 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 35.9 mt-30 -135.53 65.64 1.54 Allowed 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.915 1.686 . . . . 0.0 110.829 -169.462 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -126.23 152.82 45.57 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 125.549 1.54 . . . . 0.0 111.858 175.937 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -83.11 88.09 6.9 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 124.226 1.01 . . . . 0.0 110.992 178.264 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 12.2 p -149.06 145.77 17.73 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 C-N-CA 124.909 1.284 . . . . 0.0 111.724 176.08 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 75.0 m -147.38 -54.19 0.22 Allowed 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 124.724 1.21 . . . . 0.0 112.814 -178.295 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 25.9 t -107.51 -46.52 3.82 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 124.521 1.128 . . . . 0.0 112.955 -175.424 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 94.8 mtp -88.86 51.49 2.18 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 125.021 1.328 . . . . 0.0 112.143 -176.162 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 21.7 tt0 -80.41 57.73 2.92 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 125.42 1.488 . . . . 0.0 112.126 -177.114 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -137.36 124.74 21.93 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.439 1.496 . . . . 0.0 111.196 -179.522 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 59.9 mtpt -138.15 -46.14 0.52 Allowed 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 125.448 1.499 . . . . 0.0 112.587 -179.029 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 73.9 p -151.38 159.19 44.38 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 125.917 1.687 . . . . 0.0 111.84 178.304 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 53.2 mtt -142.69 165.03 28.5 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 125.761 1.624 . . . . 0.0 112.14 -179.838 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 13.0 t -129.64 164.98 22.72 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 125.914 1.686 . . . . 0.0 111.465 172.332 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 30.9 t-105 . . . . . 0 C--O 1.253 1.281 0 C-N-CA 125.313 1.445 . . . . 0.0 112.921 -168.204 . . . . . . . . 0 0 . 1 . 028 nuclear build full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.516 0 N-CA-C 110.774 -0.93 . . . . 0.0 110.774 . . . . . . . . . 0 0 . 1 . 028 nuclear build full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 48.7 m -139.6 162.22 35.61 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 125.201 1.401 . . . . 0.0 112.156 -173.875 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 66.1 m80 -128.27 157.06 41.95 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 125.535 1.534 . . . . 0.0 111.891 179.754 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 2.3 mpt? -118.61 148.07 43.07 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 125.146 1.378 . . . . 0.0 111.929 -176.253 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -78.58 152.24 31.95 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.134 0.974 . . . . 0.0 112.668 178.25 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 19.2 t -81.73 137.93 35.29 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 124.271 1.029 . . . . 0.0 111.766 177.68 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 12.1 tmm? -150.26 108.04 3.69 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.679 1.192 . . . . 0.0 109.956 178.285 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 77.4 m-20 39.72 58.66 6.8 Favored Pre-proline 0 CA--C 1.555 1.135 0 C-N-CA 127.346 2.258 . . . . 0.0 115.159 177.994 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 78.7 Cg_endo -70.02 -16.53 36.48 Favored 'Trans proline' 0 C--N 1.352 0.752 0 C-N-CA 123.29 2.66 . . . . 0.0 115.365 -170.801 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.445 HD23 ' H ' ' A' ' 4' ' ' LEU . 2.4 pt? -113.93 13.1 18.25 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 126.148 1.779 . . . . 0.0 115.011 -176.974 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -74.94 -2.03 25.2 Favored 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 115.166 1.543 . . . . 0.0 115.166 -175.768 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -125.65 -61.86 1.23 Allowed 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 125.407 1.483 . . . . 0.0 112.951 -163.392 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.4 pp -104.16 -14.83 8.46 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 C-N-CA 124.681 1.193 . . . . 0.0 113.53 -177.105 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . 0.291 14.2 tt 34.44 48.95 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.27 0 C-N-CA 127.502 2.321 . . . . 0.0 116.234 170.04 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -95.94 37.33 1.23 Allowed 'General case' 0 CA--C 1.547 0.83 0 O-C-N 120.418 -1.426 . . . . 0.0 113.077 -170.902 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 -109.44 10.72 25.29 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 113.851 1.056 . . . . 0.0 113.851 -176.635 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 6.9 tp -150.14 31.34 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.48 1.047 0 C-N-CA 125.013 1.325 . . . . 0.0 113.61 -173.299 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 7.0 tmtm? -137.57 -46.04 0.55 Allowed 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 123.717 0.807 . . . . 0.0 113.045 -176.827 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 52.9 mtpt -132.79 157.47 44.89 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 127.158 2.183 . . . . 0.0 112.795 -177.473 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -101.03 104.14 15.28 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 125.313 1.445 . . . . 0.0 110.201 176.985 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -156.12 173.03 17.42 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.815 1.246 . . . . 0.0 112.333 -170.111 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 26.7 t-20 -139.75 -47.54 0.45 Allowed 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 124.157 0.983 . . . . 0.0 113.506 -179.269 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 15.1 t0 -149.76 133.81 17.11 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 124.768 1.227 . . . . 0.0 110.514 178.636 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 37.8 m -127.34 25.73 6.1 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 125.213 1.405 . . . . 0.0 113.311 179.74 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 82.64 65.61 1.6 Allowed Glycine 0 CA--C 1.53 0.983 0 C-N-CA 124.587 1.089 . . . . 0.0 112.372 178.935 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 7.9 p -131.28 14.54 1.9 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.999 0 C-N-CA 125.943 1.697 . . . . 0.0 113.029 -169.866 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 3.6 m -134.37 149.67 50.85 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 124.614 1.165 . . . . 0.0 112.681 -163.007 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.486 HD23 ' H ' ' A' ' 22' ' ' LEU . 1.8 pt? -97.28 28.21 3.78 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 116.091 1.885 . . . . 0.0 116.091 -170.961 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -148.37 149.29 31.36 Favored Pre-proline 0 CA--C 1.548 0.892 0 C-N-CA 125.251 1.42 . . . . 0.0 111.773 179.88 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -78.62 -51.52 0.07 OUTLIER 'Trans proline' 0 C--N 1.352 0.717 0 C-N-CA 122.669 2.246 . . . . 0.0 112.76 -175.887 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -159.59 -52.8 0.06 Allowed 'General case' 0 N--CA 1.476 0.838 0 CA-C-O 122.06 0.933 . . . . 0.0 112.818 176.366 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 13.2 t -152.06 163.08 40.07 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 127.666 2.386 . . . . 0.0 110.312 177.864 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 40.2 t 62.05 151.23 0.1 Allowed Pre-proline 0 N--CA 1.482 1.132 0 C-N-CA 127.334 2.254 . . . . 0.0 112.728 -169.839 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -65.48 76.93 0.26 Allowed 'Trans proline' 0 CA--C 1.547 1.136 0 C-N-CA 123.456 2.771 . . . . 0.0 111.754 168.022 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 43.1 tptt 53.31 81.09 0.27 Allowed Pre-proline 0 CA--C 1.549 0.911 0 C-N-CA 129.196 2.998 . . . . 0.0 113.906 176.069 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_endo -69.85 136.47 32.84 Favored 'Trans proline' 0 C--N 1.351 0.707 0 C-N-CA 123.192 2.594 . . . . 0.0 113.036 -179.825 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.3 151.64 9.5 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 126.027 1.731 . . . . 0.0 115.209 -169.02 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 18.7 tp -138.86 145.04 39.51 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 126.488 1.915 . . . . 0.0 110.931 -171.852 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -137.69 69.39 1.4 Allowed 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 125.614 1.566 . . . . 0.0 110.167 178.084 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 25.7 mt-10 -134.02 79.0 1.79 Allowed 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 124.577 1.151 . . . . 0.0 112.83 -174.886 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.7 mt -126.18 152.86 45.44 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 126.813 2.045 . . . . 0.0 110.194 169.277 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 18.9 t -75.31 166.77 23.11 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 123.178 0.591 . . . . 0.0 110.503 169.727 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -55.83 -46.04 78.21 Favored 'General case' 0 N--CA 1.476 0.844 0 O-C-N 120.591 -1.318 . . . . 0.0 113.077 -173.017 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 11.8 tt0 -72.29 -42.22 65.77 Favored 'General case' 0 N--CA 1.47 0.566 0 O-C-N 121.53 -0.731 . . . . 0.0 111.268 176.796 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 14.8 mm100 -60.22 -42.25 94.78 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.797 0.839 . . . . 0.0 110.695 179.744 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 41.4 ttmt -60.73 -43.07 98.35 Favored 'General case' 0 N--CA 1.466 0.332 0 C-N-CA 125.194 1.398 . . . . 0.0 111.008 176.538 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 53.2 mt -67.25 -41.59 86.83 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 CA-C-O 118.179 -0.915 . . . . 0.0 111.155 177.185 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 44.1 mt -63.89 -45.38 97.14 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.928 0 CA-C-N 120.593 1.542 . . . . 0.0 110.166 178.097 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -58.18 -49.6 76.46 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.709 1.204 . . . . 0.0 110.87 176.953 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -65.59 -52.18 54.08 Favored 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 125.028 1.331 . . . . 0.0 112.677 179.515 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 -61.43 -29.21 69.8 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-N 119.169 0.895 . . . . 0.0 112.798 -179.294 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.46 ' CE1' HG22 ' A' ' 55' ' ' ILE . 1.4 t80 -66.83 -56.42 10.45 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 118.685 0.675 . . . . 0.0 110.849 175.342 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 81.1 mt -65.03 -32.01 56.44 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 C-N-CA 126.886 2.074 . . . . 0.0 111.763 178.856 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -73.0 -28.06 62.15 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 123.9 0.88 . . . . 0.0 112.436 176.149 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -85.29 -39.92 17.16 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.01 0.924 . . . . 0.0 112.165 176.054 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.1 m -109.94 -3.62 10.56 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.199 0 N-CA-C 114.152 1.167 . . . . 0.0 114.152 -173.761 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 86.43 19.87 55.86 Favored Glycine 0 N--CA 1.474 1.172 0 C-N-CA 125.539 1.542 . . . . 0.0 115.525 160.538 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 57.13 5.53 0.26 Allowed 'General case' 0 CA--C 1.555 1.164 0 C-N-CA 127.057 2.143 . . . . 0.0 114.706 -166.778 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 15.9 mt-30 -98.81 -14.31 19.74 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 125.901 1.681 . . . . 0.0 112.751 -173.481 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 39.2 m-80 -131.22 6.23 4.51 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 113.937 1.088 . . . . 0.0 113.937 -171.962 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.46 HG22 ' CE1' ' A' ' 46' ' ' TYR . 20.1 pt -77.23 154.38 5.49 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 CA-C-N 118.691 0.678 . . . . 0.0 111.81 176.123 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -133.15 144.01 49.61 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 124.374 1.069 . . . . 0.0 110.306 175.959 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -60.58 -29.17 69.01 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.959 0.904 . . . . 0.0 111.756 177.995 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.9 mp -63.43 -57.18 12.97 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.218 0 C-N-CA 124.81 1.244 . . . . 0.0 108.903 173.93 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 52.9 m -68.42 -45.67 71.98 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 123.696 0.799 . . . . 0.0 109.764 -175.138 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 19.0 tp -57.87 -35.77 71.42 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.915 1.286 . . . . 0.0 112.175 174.324 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.447 ' HA ' HG13 ' A' ' 66' ' ' ILE . 19.4 p -63.91 -20.67 66.02 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 113.883 1.068 . . . . 0.0 113.883 172.551 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 13.6 mptt -103.82 -31.4 9.82 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 125.224 1.409 . . . . 0.0 113.351 -178.287 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 7.2 mtpp -65.87 -28.98 69.36 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 120.035 1.289 . . . . 0.0 112.105 176.836 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.9 mp -115.55 4.48 14.2 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.402 1.481 . . . . 0.0 114.381 -178.653 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 31.9 m-80 56.19 59.57 3.63 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 125.998 1.719 . . . . 0.0 113.651 179.611 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.447 HG13 ' HA ' ' A' ' 61' ' ' SER . 0.9 OUTLIER -135.41 176.63 8.11 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 C-N-CA 126.607 1.963 . . . . 0.0 111.492 -169.853 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.4 p -77.09 158.73 30.3 Favored 'General case' 0 N--CA 1.479 0.985 0 O-C-N 120.947 -1.095 . . . . 0.0 111.317 172.006 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 98.8 t -64.33 -28.5 45.03 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.984 0 O-C-N 121.684 -0.635 . . . . 0.0 111.349 173.644 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -77.86 -38.13 46.72 Favored 'General case' 0 N--CA 1.469 0.475 0 O-C-N 121.183 -0.948 . . . . 0.0 110.055 179.449 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 5.5 tmtm? -67.25 -43.24 82.4 Favored 'General case' 0 N--CA 1.462 0.175 0 C-N-CA 125.138 1.375 . . . . 0.0 111.346 177.244 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -60.7 -50.0 75.25 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.861 1.264 . . . . 0.0 112.92 170.277 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 33.8 ttmt -68.44 -24.79 64.77 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 124.615 1.166 . . . . 0.0 111.846 -176.525 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -53.64 -40.05 65.49 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 123.679 0.792 . . . . 0.0 111.444 171.899 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -70.79 -42.41 70.37 Favored 'General case' 0 C--O 1.224 -0.24 0 C-N-CA 124.152 0.981 . . . . 0.0 111.633 176.593 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 42.9 mt -65.45 -30.82 51.36 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 C-N-CA 124.711 1.204 . . . . 0.0 111.414 -179.289 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 12.4 tppt? -89.47 -22.8 22.3 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.808 1.643 . . . . 0.0 113.002 179.924 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 56.6 m-20 -82.9 -47.68 11.54 Favored 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 124.942 1.297 . . . . 0.0 110.409 172.961 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 68.0 m -118.69 112.51 19.88 Favored 'General case' 0 N--CA 1.464 0.229 0 C-N-CA 124.608 1.163 . . . . 0.0 112.034 -177.609 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -146.88 -71.4 0.23 Allowed 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 113.213 0.819 . . . . 0.0 113.213 -176.733 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 3.9 mpt_? -77.43 -16.82 58.6 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 124.637 1.175 . . . . 0.0 112.818 178.901 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -98.03 24.34 7.14 Favored 'General case' 0 CA--C 1.551 0.996 0 C-N-CA 127.129 2.172 . . . . 0.0 112.604 176.373 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -72.09 -106.43 0.06 OUTLIER Glycine 0 CA--C 1.538 1.487 0 O-C-N 120.99 -1.069 . . . . 0.0 113.27 177.52 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 80.5 mtt-85 -132.74 159.99 38.1 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 124.566 1.146 . . . . 0.0 113.201 175.598 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 10.1 t -86.66 36.25 0.7 Allowed 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 127.366 2.267 . . . . 0.0 113.615 -173.162 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 69.2 m-80 -124.07 140.7 52.72 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 125.03 1.332 . . . . 0.0 111.244 -179.275 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 18.6 t-20 -138.11 152.49 48.8 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 125.303 1.441 . . . . 0.0 111.426 -178.416 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 10.7 mp -114.46 162.69 16.36 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 127.151 2.181 . . . . 0.0 110.647 -172.041 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 48.5 pttt -120.56 16.89 12.07 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 126.605 1.962 . . . . 0.0 112.753 -173.729 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 14.6 t -146.17 122.7 11.07 Favored 'General case' 0 C--O 1.233 0.205 0 C-N-CA 125.477 1.511 . . . . 0.0 109.662 174.04 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -138.87 10.28 0.65 Allowed 'Isoleucine or valine' 0 CA--C 1.548 0.893 0 C-N-CA 125.95 1.7 . . . . 0.0 112.95 -177.106 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 77.69 -12.74 14.73 Favored Glycine 0 CA--C 1.536 1.345 0 C-N-CA 124.746 1.165 . . . . 0.0 114.505 -165.561 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 4.5 mp 54.67 97.42 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.53 0 C-N-CA 127.373 2.269 . . . . 0.0 109.825 -163.015 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 32.1 tp -67.41 76.46 0.16 Allowed 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 125.733 1.613 . . . . 0.0 112.919 -172.988 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 83.7 mt-30 -92.34 -47.97 6.91 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 124.522 1.129 . . . . 0.0 112.958 178.944 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -143.62 145.43 32.48 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 125.155 1.382 . . . . 0.0 111.108 -168.755 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -99.99 97.71 8.54 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 124.49 1.116 . . . . 0.0 110.159 175.696 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 25.8 t -129.18 -67.48 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 C-N-CA 124.56 1.144 . . . . 0.0 112.589 -172.311 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 31.2 p 51.43 11.41 0.12 Allowed 'General case' 0 CA--C 1.547 0.851 0 N-CA-C 118.89 2.922 . . . . 0.0 118.89 177.31 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 27.6 t -123.79 -44.27 2.09 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 125.349 1.46 . . . . 0.0 113.318 -178.161 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 3.0 tmm? -137.36 60.05 1.66 Allowed 'General case' 0 N--CA 1.474 0.775 0 CA-C-O 123.388 1.566 . . . . 0.0 110.148 178.552 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 22.1 tt0 -82.5 53.78 2.43 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 126.022 1.729 . . . . 0.0 112.63 -170.716 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -75.5 94.01 3.07 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 124.846 1.258 . . . . 0.0 111.769 -178.741 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 20.0 mmmt -128.24 109.46 11.5 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 126.494 1.918 . . . . 0.0 109.439 -177.746 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 11.2 t -151.81 82.49 1.28 Allowed 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.107 0.963 . . . . 0.0 111.791 -178.321 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 26.6 ptt? -156.56 162.82 39.89 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 125.532 1.533 . . . . 0.0 111.605 172.016 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 4.2 m -141.75 144.33 33.95 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 124.569 1.148 . . . . 0.0 110.535 172.612 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 3.4 t-105 . . . . . 0 C--O 1.252 1.234 0 C-N-CA 125.415 1.486 . . . . 0.0 112.675 -172.908 . . . . . . . . 0 0 . 1 . 029 nuclear build full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.622 0 N-CA-C 111.587 -0.605 . . . . 0.0 111.587 . . . . . . . . . 0 0 . 1 . 029 nuclear build full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 1.6 t -137.82 22.77 2.87 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 124.626 1.171 . . . . 0.0 113.461 -176.31 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 69.0 m80 -136.51 150.3 48.6 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 125.557 1.543 . . . . 0.0 112.3 -176.092 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 45.9 ttm -102.06 61.62 0.87 Allowed 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 125.396 1.478 . . . . 0.0 110.99 178.077 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -154.61 169.62 23.43 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.135 1.374 . . . . 0.0 112.17 -178.257 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 29.8 t -122.38 141.02 52.01 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 125.302 1.441 . . . . 0.0 111.447 176.272 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 17.7 ttt -144.44 29.78 1.26 Allowed 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 125.421 1.488 . . . . 0.0 111.617 -178.076 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 -119.65 94.11 48.15 Favored Pre-proline 0 CA--C 1.545 0.778 0 C-N-CA 125.102 1.361 . . . . 0.0 111.481 -172.224 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -78.83 -13.77 14.23 Favored 'Trans proline' 0 C--N 1.351 0.658 0 C-N-CA 122.977 2.451 . . . . 0.0 114.9 -178.949 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 96.8 mt -101.71 46.07 0.95 Allowed 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 126.015 1.726 . . . . 0.0 113.189 -170.709 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -109.79 -2.66 17.19 Favored 'General case' 0 N--CA 1.479 0.975 0 N-CA-C 114.885 1.439 . . . . 0.0 114.885 171.693 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -128.63 -55.76 1.22 Allowed 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 124.303 1.041 . . . . 0.0 113.18 -166.384 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.8 pp -108.4 9.12 9.21 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 C-N-CA 125.593 1.557 . . . . 0.0 112.882 -178.201 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 10.0 tt -54.09 117.62 0.99 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.825 0 C-N-CA 123.781 0.833 . . . . 0.0 111.769 178.301 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -150.35 15.48 0.8 Allowed 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 124.131 0.972 . . . . 0.0 113.621 -178.167 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -85.2 5.2 31.12 Favored 'General case' 0 CA--C 1.545 0.763 0 N-CA-C 114.931 1.456 . . . . 0.0 114.931 -169.183 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 13.6 tt -146.77 24.4 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.805 0 C-N-CA 125.396 1.478 . . . . 0.0 114.262 -170.217 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 35.4 ttpt -118.56 -48.15 2.51 Favored 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 114.546 1.313 . . . . 0.0 114.546 177.98 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 59.2 mttp 51.29 -175.25 0.02 OUTLIER 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 126.379 1.872 . . . . 0.0 113.978 -170.904 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 28.3 mt-10 56.56 34.11 23.83 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 126.14 1.776 . . . . 0.0 114.984 171.968 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -111.02 15.29 21.78 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 125.15 1.38 . . . . 0.0 114.58 -166.416 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 64.6 t-20 -106.1 117.99 35.46 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.971 1.308 . . . . 0.0 110.958 -179.45 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 24.7 m-20 -110.71 14.46 22.28 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 125.634 1.573 . . . . 0.0 114.466 -178.432 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 74.9 m -68.2 115.59 7.84 Favored 'General case' 0 CA--C 1.535 0.387 0 O-C-N 121.215 -0.928 . . . . 0.0 112.088 177.832 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 128.51 -12.79 6.26 Favored Glycine 0 CA--C 1.534 1.235 0 C-N-CA 125.758 1.647 . . . . 0.0 115.422 175.616 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 92.3 t -131.22 127.46 60.51 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.789 0 C-N-CA 125.083 1.353 . . . . 0.0 109.875 178.182 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.441 HG22 ' H ' ' A' ' 22' ' ' LEU . 0.3 OUTLIER 58.49 -163.08 0.21 Allowed 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 125.117 1.367 . . . . 0.0 111.883 -176.968 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.441 ' H ' HG22 ' A' ' 21' ' ' THR . 1.2 pt? -134.91 33.95 3.15 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 125.445 1.498 . . . . 0.0 113.145 -179.406 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -107.61 111.92 62.5 Favored Pre-proline 0 CA--C 1.547 0.849 0 C-N-CA 124.862 1.265 . . . . 0.0 111.954 -173.21 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo -80.27 -31.08 1.8 Allowed 'Trans proline' 0 CA--C 1.54 0.791 0 C-N-CA 122.312 2.008 . . . . 0.0 113.539 -178.805 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 18.8 tp -152.53 61.6 0.81 Allowed 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.666 1.187 . . . . 0.0 111.564 -175.74 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.2 t 56.6 40.42 29.38 Favored 'General case' 0 N--CA 1.479 0.987 0 N-CA-C 114.261 1.208 . . . . 0.0 114.261 178.586 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 10.2 p -154.43 142.71 14.34 Favored Pre-proline 0 N--CA 1.473 0.718 0 C-N-CA 126.046 1.739 . . . . 0.0 109.461 -174.376 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 98.1 Cg_endo -77.76 63.32 8.03 Favored 'Trans proline' 0 CA--C 1.548 1.18 0 C-N-CA 123.588 2.858 . . . . 0.0 112.368 -178.686 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 40.3 tptt 58.87 117.71 0.02 OUTLIER Pre-proline 0 N--CA 1.48 1.052 0 C-N-CA 129.747 3.219 . . . . 0.0 113.743 -168.456 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 82.0 Cg_endo -77.09 146.96 25.99 Favored 'Trans proline' 0 CA--C 1.538 0.696 0 C-N-CA 122.751 2.301 . . . . 0.0 111.421 -178.498 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 9.5 mtpm? -67.15 131.31 45.54 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.434 0.694 . . . . 0.0 111.056 177.964 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.3 tt -147.78 132.94 18.33 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.188 1.395 . . . . 0.0 111.882 -175.561 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -136.17 116.61 13.72 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 126.479 1.912 . . . . 0.0 109.272 173.329 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -148.61 80.16 1.44 Allowed 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 124.224 1.009 . . . . 0.0 110.304 -175.662 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 36.6 mt -135.33 154.06 51.64 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 125.994 1.718 . . . . 0.0 110.885 -173.633 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 71.2 m -71.66 165.15 24.56 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 122.976 0.51 . . . . 0.0 110.412 169.741 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -53.79 -44.9 70.49 Favored 'General case' 0 N--CA 1.478 0.952 0 O-C-N 120.952 -1.092 . . . . 0.0 112.877 -176.19 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 6.9 pt20 -72.41 -36.0 68.53 Favored 'General case' 0 N--CA 1.47 0.539 0 O-C-N 121.733 -0.605 . . . . 0.0 112.211 176.683 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 86.7 mt-30 -67.87 -40.21 83.61 Favored 'General case' 0 CA--C 1.534 0.348 0 O-C-N 121.662 -0.648 . . . . 0.0 111.271 179.373 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 17.6 ttmm -59.65 -40.87 89.16 Favored 'General case' 0 N--CA 1.471 0.595 0 O-C-N 121.469 -0.769 . . . . 0.0 110.687 174.359 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 51.5 mt -69.73 -41.54 79.99 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 CA-C-O 117.865 -1.065 . . . . 0.0 111.638 176.969 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 35.9 mt -64.0 -43.08 97.53 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.943 0 CA-C-N 121.144 1.793 . . . . 0.0 110.04 177.598 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -58.12 -49.62 76.35 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.605 1.162 . . . . 0.0 110.688 177.381 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -62.77 -52.93 61.28 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 124.776 1.23 . . . . 0.0 112.834 175.78 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -59.06 -30.99 68.47 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-N 119.154 0.888 . . . . 0.0 112.729 -179.838 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.416 ' CE1' HG22 ' A' ' 55' ' ' ILE . 1.3 t80 -67.73 -57.31 6.56 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 123.35 0.66 . . . . 0.0 110.644 176.871 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 89.0 mt -64.15 -33.63 63.65 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 C-N-CA 126.212 1.805 . . . . 0.0 111.352 179.686 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -71.42 -27.24 63.16 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.016 0.926 . . . . 0.0 112.544 177.097 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -88.19 -37.61 15.98 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.085 0.954 . . . . 0.0 112.533 176.151 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.5 m -109.9 -4.79 10.9 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.223 0 N-CA-C 114.488 1.292 . . . . 0.0 114.488 -174.087 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 83.13 25.8 47.03 Favored Glycine 0 N--CA 1.471 1.004 0 C-N-CA 125.028 1.299 . . . . 0.0 115.049 162.203 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 57.6 6.65 0.45 Allowed 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 127.511 2.325 . . . . 0.0 115.175 -172.061 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 27.2 mt-30 -102.17 -15.34 16.71 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 125.55 1.54 . . . . 0.0 113.181 -172.637 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 42.4 m-80 -126.49 5.68 6.89 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.167 0.987 . . . . 0.0 113.569 -172.543 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.416 HG22 ' CE1' ' A' ' 46' ' ' TYR . 15.1 pt -79.35 152.45 4.8 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.555 0 O-C-N 121.903 -0.498 . . . . 0.0 111.309 173.978 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -139.52 144.99 38.15 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 124.55 1.14 . . . . 0.0 109.592 178.915 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -61.94 -23.16 66.19 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 119.193 0.906 . . . . 0.0 112.59 -179.255 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 2.0 mp -70.29 -55.01 16.04 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.232 0 C-N-CA 125.336 1.454 . . . . 0.0 109.091 172.662 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 91.2 m -68.92 -43.32 75.41 Favored 'General case' 0 N--CA 1.464 0.274 0 O-C-N 121.535 -0.728 . . . . 0.0 110.385 -176.895 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 13.7 tp -60.8 -34.87 75.17 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 125.665 1.586 . . . . 0.0 112.241 173.43 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.486 ' HA ' HG13 ' A' ' 66' ' ' ILE . 4.4 t -57.11 -28.82 62.99 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 124.092 0.957 . . . . 0.0 112.685 169.806 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 8.7 mptt -105.56 -23.24 12.82 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.853 1.261 . . . . 0.0 113.789 -174.949 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 58.6 mmtt -66.46 -33.69 76.26 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 124.533 1.133 . . . . 0.0 111.458 175.316 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.0 mp -119.07 5.82 11.31 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 124.831 1.252 . . . . 0.0 114.364 -175.85 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 19.1 m-80 57.84 58.12 3.82 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 126.262 1.825 . . . . 0.0 113.221 -178.733 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.486 HG13 ' HA ' ' A' ' 61' ' ' SER . 3.4 pt -134.89 168.26 23.97 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 C-N-CA 126.072 1.749 . . . . 0.0 112.49 -170.082 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 30.5 p -69.57 151.72 45.63 Favored 'General case' 0 N--CA 1.47 0.525 0 O-C-N 121.382 -0.824 . . . . 0.0 111.405 174.918 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 91.7 t -61.09 -27.06 40.92 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.861 0 C-N-CA 123.095 0.558 . . . . 0.0 111.054 171.211 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -75.6 -41.92 53.24 Favored 'General case' 0 C--O 1.235 0.323 0 O-C-N 120.96 -1.088 . . . . 0.0 110.155 -176.839 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.25 -32.01 49.47 Favored 'General case' 0 C--N 1.346 0.416 0 CA-C-N 118.311 0.505 . . . . 0.0 111.627 179.626 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -63.86 -46.75 83.59 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.797 1.239 . . . . 0.0 112.194 171.502 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 39.4 ttmt -67.94 -29.46 68.53 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 124.3 1.04 . . . . 0.0 111.334 -178.861 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -55.35 -38.94 69.44 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 122.806 0.442 . . . . 0.0 112.071 176.393 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 35.2 m-85 -65.52 -45.57 82.98 Favored 'General case' 0 C--O 1.224 -0.264 0 C-N-CA 124.699 1.2 . . . . 0.0 111.398 175.664 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 61.6 mt -65.18 -30.59 50.75 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.592 0 C-N-CA 124.115 0.966 . . . . 0.0 110.79 -178.611 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt -79.2 -36.82 39.6 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 124.713 1.205 . . . . 0.0 113.144 179.018 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 6.3 p30 -90.9 -44.85 9.12 Favored 'General case' 0 C--N 1.345 0.387 0 CA-C-N 120.019 1.282 . . . . 0.0 111.737 179.682 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 38.7 m -97.07 93.04 6.35 Favored 'General case' 0 C--O 1.231 0.115 0 C-N-CA 123.032 0.533 . . . . 0.0 110.787 179.43 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -140.77 -54.8 0.5 Allowed 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 113.481 0.919 . . . . 0.0 113.481 -179.419 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 1.6 mpp_? -76.66 -12.84 60.06 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 124.315 1.046 . . . . 0.0 113.249 176.329 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 26.9 tp -70.31 -36.08 74.07 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.893 1.277 . . . . 0.0 112.641 176.54 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -73.22 139.42 26.86 Favored Glycine 0 CA--C 1.533 1.196 0 N-CA-C 111.577 -0.609 . . . . 0.0 111.577 175.983 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 11.3 mmm-85 -120.22 146.35 46.13 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 124.332 1.053 . . . . 0.0 112.121 -171.625 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 10.8 t -66.79 106.44 1.86 Allowed 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 125.149 1.38 . . . . 0.0 111.345 177.997 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 41.8 m-80 -131.91 111.47 11.59 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 125.436 1.494 . . . . 0.0 109.55 178.977 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 10.3 m120 -144.85 158.95 43.61 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.048 1.339 . . . . 0.0 112.244 -174.785 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 10.7 mp -88.79 163.8 15.53 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 125.53 1.532 . . . . 0.0 110.889 174.647 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 19.3 ptmt -126.13 13.08 7.77 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 126.764 2.026 . . . . 0.0 112.998 -172.014 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 15.2 t -147.3 123.1 10.6 Favored 'General case' 0 C--O 1.233 0.204 0 C-N-CA 125.758 1.623 . . . . 0.0 109.431 173.665 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -133.63 -6.31 1.35 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 C-N-CA 125.757 1.623 . . . . 0.0 111.904 177.419 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 69.23 19.16 73.87 Favored Glycine 0 CA--C 1.533 1.177 0 C-N-CA 124.679 1.133 . . . . 0.0 113.698 -165.571 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -130.55 -27.49 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.302 0 N-CA-C 114.866 1.432 . . . . 0.0 114.866 -173.766 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 17.4 tp -73.49 50.2 0.31 Allowed 'General case' 0 CA--C 1.551 0.985 0 CA-C-N 113.937 -1.483 . . . . 0.0 111.293 166.885 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 18.3 mt-30 -92.25 -9.93 40.34 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 128.091 2.556 . . . . 0.0 114.42 -170.804 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -79.12 108.32 12.53 Favored 'General case' 0 CA--C 1.544 0.726 0 O-C-N 121.101 -0.999 . . . . 0.0 111.225 178.14 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -149.4 71.37 1.11 Allowed 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 124.658 1.183 . . . . 0.0 110.912 -179.784 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 28.0 t -139.7 80.69 0.35 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 124.836 1.254 . . . . 0.0 110.1 177.519 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 47.5 t -163.23 -76.86 0.04 OUTLIER 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 123.935 0.894 . . . . 0.0 112.329 169.375 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 55.5 p -88.74 -29.14 20.04 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 125.028 1.331 . . . . 0.0 113.321 -176.744 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 43.9 mtt -126.61 142.41 51.55 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 126.465 1.906 . . . . 0.0 109.752 167.809 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -157.86 90.78 1.09 Allowed 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.839 1.655 . . . . 0.0 107.823 172.829 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -146.33 157.78 43.82 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 124.3 1.04 . . . . 0.0 113.273 -171.858 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -92.19 71.38 5.36 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 125.907 1.683 . . . . 0.0 111.776 -174.894 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 7.5 t -134.27 166.15 23.47 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 124.773 1.229 . . . . 0.0 112.662 177.348 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 28.1 ttt -133.38 93.57 3.18 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 126.45 1.9 . . . . 0.0 109.885 -179.662 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER 58.44 24.64 12.01 Favored 'General case' 0 N--CA 1.485 1.313 0 N-CA-C 115.149 1.537 . . . . 0.0 115.149 173.515 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 1.3 t-105 . . . . . 0 C--O 1.253 1.263 0 C-N-CA 126.598 1.959 . . . . 0.0 113.106 -179.574 . . . . . . . . 0 0 . 1 . 030 nuclear build full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.503 0 N-CA-C 111.452 -0.659 . . . . 0.0 111.452 . . . . . . . . . 0 0 . 1 . 030 nuclear build full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 63.1 p -86.15 -13.8 46.02 Favored 'General case' 0 N--CA 1.477 0.9 0 N-CA-C 115.15 1.537 . . . . 0.0 115.15 -174.085 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 48.5 t-80 -72.98 135.41 44.98 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 124.061 0.945 . . . . 0.0 112.82 -176.524 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 59.1 tpp -155.11 137.67 15.1 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 125.67 1.588 . . . . 0.0 110.697 -179.377 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -149.87 127.69 11.77 Favored 'General case' 0 CA--C 1.542 0.64 0 N-CA-C 113.077 0.769 . . . . 0.0 113.077 171.564 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 39.2 m -154.1 71.64 0.86 Allowed 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 126.349 1.86 . . . . 0.0 110.43 -172.415 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.2 ttt -137.66 30.65 2.57 Favored 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 124.429 1.092 . . . . 0.0 113.388 -170.539 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 8.6 t0 -101.85 123.01 45.37 Favored Pre-proline 0 CA--C 1.551 1.012 0 C-N-CA 124.471 1.109 . . . . 0.0 112.156 -176.614 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 69.1 Cg_endo -82.67 -3.42 11.27 Favored 'Trans proline' 0 C--N 1.352 0.725 0 C-N-CA 123.501 2.8 . . . . 0.0 115.147 179.437 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 81.8 mt -108.24 43.58 1.21 Allowed 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.799 1.64 . . . . 0.0 112.314 -175.793 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -104.81 0.5 28.17 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 115.013 1.486 . . . . 0.0 115.013 178.633 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -120.52 -57.72 1.89 Allowed 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 124.408 1.083 . . . . 0.0 113.489 -166.751 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.1 pp -129.71 15.87 2.44 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 C-N-CA 126.249 1.819 . . . . 0.0 112.76 -172.188 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 16.9 tt -38.88 120.66 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 C-N-CA 125.825 1.65 . . . . 0.0 113.369 178.027 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 1.9 m120 -165.01 108.1 0.85 Allowed 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.584 1.154 . . . . 0.0 109.685 179.372 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 23.3 t0 -166.44 81.91 0.26 Allowed 'General case' 0 N--CA 1.466 0.353 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 -178.82 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 46.1 mm 53.0 63.21 0.21 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.831 0 CA-C-O 123.169 1.461 . . . . 0.0 111.096 -170.463 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 1.3 mmmt -150.99 -39.39 0.13 Allowed 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 124.781 1.233 . . . . 0.0 113.968 179.595 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 50.8 tttm 43.04 61.29 2.19 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 126.606 1.962 . . . . 0.0 113.205 -177.762 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -123.04 133.56 54.33 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.699 1.2 . . . . 0.0 111.15 -178.144 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -153.35 169.81 22.2 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 125.032 1.333 . . . . 0.0 111.769 176.805 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 -146.91 147.46 30.81 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.6 1.16 . . . . 0.0 111.478 -179.655 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 33.1 m-20 -100.21 96.99 7.84 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 124.526 1.131 . . . . 0.0 111.052 -179.624 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 23.3 t -119.68 105.45 11.19 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 124.808 1.243 . . . . 0.0 110.982 178.676 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 63.13 37.03 94.25 Favored Glycine 0 N--CA 1.472 1.097 0 C-N-CA 124.889 1.233 . . . . 0.0 115.491 175.604 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 47.0 t -80.05 147.37 6.58 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 C-N-CA 125.006 1.323 . . . . 0.0 111.035 -177.833 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 35.2 m -48.82 149.6 1.74 Allowed 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 125.72 1.608 . . . . 0.0 113.696 168.976 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -142.66 34.07 1.43 Allowed 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.895 1.678 . . . . 0.0 114.171 -171.187 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -113.62 96.33 40.07 Favored Pre-proline 0 CA--C 1.551 0.983 0 C-N-CA 124.822 1.249 . . . . 0.0 111.89 -174.316 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_endo -79.42 -19.74 10.07 Favored 'Trans proline' 0 CA--C 1.542 0.878 0 C-N-CA 123.215 2.61 . . . . 0.0 113.346 178.81 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 6.3 tp -143.09 -158.23 0.85 Allowed 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 127.104 2.162 . . . . 0.0 108.758 -177.961 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 3.2 t -77.0 42.91 0.33 Allowed 'General case' 0 N--CA 1.479 0.992 0 O-C-N 120.761 -1.212 . . . . 0.0 113.205 175.356 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 7.8 p -159.0 141.14 10.05 Favored Pre-proline 0 CA--C 1.543 0.682 0 C-N-CA 126.398 1.879 . . . . 0.0 110.484 -176.097 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_endo -78.09 65.96 8.32 Favored 'Trans proline' 0 CA--C 1.548 1.184 0 C-N-CA 123.958 3.105 . . . . 0.0 111.358 174.061 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 30.3 tptt 64.27 124.58 0.02 OUTLIER Pre-proline 0 CA--C 1.554 1.099 0 C-N-CA 129.447 3.099 . . . . 0.0 114.137 -172.933 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -80.72 116.52 3.2 Favored 'Trans proline' 0 C--N 1.351 0.71 0 C-N-CA 122.558 2.172 . . . . 0.0 112.279 -179.838 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 10.1 mtpm? -55.07 141.87 32.73 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 124.371 1.068 . . . . 0.0 113.349 -172.073 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -143.59 132.57 22.84 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 126.411 1.884 . . . . 0.0 109.976 -174.809 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 33.4 mp0 -131.65 70.16 1.47 Allowed 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 125.312 1.445 . . . . 0.0 111.308 -178.345 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -109.58 73.18 0.83 Allowed 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.61 1.164 . . . . 0.0 113.357 -170.774 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 86.9 mt -138.97 148.23 43.23 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 126.282 1.833 . . . . 0.0 111.294 178.841 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 26.8 m -72.04 169.51 15.84 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 124.32 1.048 . . . . 0.0 110.871 169.889 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -57.33 -43.54 83.44 Favored 'General case' 0 CA--C 1.545 0.773 0 O-C-N 120.427 -1.421 . . . . 0.0 113.324 -173.46 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 12.6 tt0 -74.69 -43.3 55.87 Favored 'General case' 0 N--CA 1.472 0.661 0 O-C-N 121.129 -0.982 . . . . 0.0 111.696 176.856 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 11.7 mm-40 -53.46 -45.32 69.48 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.0 1.32 . . . . 0.0 111.449 174.521 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 41.0 ttmt -60.45 -38.12 83.12 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 125.31 1.444 . . . . 0.0 111.761 176.889 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 49.9 mt -76.16 -35.81 29.17 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 CA-C-O 118.075 -0.964 . . . . 0.0 111.93 178.565 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 48.8 mt -60.51 -40.97 86.01 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.035 0 CA-C-N 120.766 1.621 . . . . 0.0 109.825 172.752 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.454 HD22 HD11 ' A' ' 60' ' ' LEU . 0.4 OUTLIER -59.45 -52.4 65.75 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.177 0.991 . . . . 0.0 110.649 175.0 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -65.36 -49.27 70.0 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 124.419 1.088 . . . . 0.0 113.42 -177.662 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 18.8 mm-40 -62.46 -25.05 67.78 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 123.941 0.896 . . . . 0.0 113.065 -179.297 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -71.87 -54.82 8.88 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 123.367 0.667 . . . . 0.0 110.999 175.883 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 52.7 mt -59.35 -36.17 62.4 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 C-N-CA 125.134 1.374 . . . . 0.0 111.262 174.202 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -67.84 -20.86 65.2 Favored 'General case' 0 CA--C 1.546 0.791 0 N-CA-C 113.266 0.839 . . . . 0.0 113.266 176.771 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -96.41 -29.72 13.78 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.882 1.273 . . . . 0.0 113.228 178.358 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 5.3 m -123.19 -22.79 2.77 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.993 0 CA-C-N 119.791 1.178 . . . . 0.0 114.068 -173.815 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 89.92 143.51 10.43 Favored Glycine 0 CA--C 1.534 1.251 0 C-N-CA 125.531 1.539 . . . . 0.0 113.082 -172.017 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 30.6 tp -59.89 -17.19 35.12 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 126.116 1.766 . . . . 0.0 114.932 -173.377 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 37.6 mt-30 -89.55 -18.99 25.55 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 126.474 1.91 . . . . 0.0 112.923 179.753 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 57.9 m-80 -108.67 -9.11 15.3 Favored 'General case' 0 N--CA 1.472 0.648 0 N-CA-C 114.35 1.241 . . . . 0.0 114.35 -173.748 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 30.5 pt -65.62 159.49 4.14 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.471 0 C-N-CA 123.787 0.835 . . . . 0.0 111.134 162.396 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -132.43 143.14 49.6 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 125.494 1.518 . . . . 0.0 109.904 175.612 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -59.44 -26.65 65.38 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 123.826 0.851 . . . . 0.0 112.219 174.679 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 27.7 mm -66.07 -44.33 92.01 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.495 0 C-N-CA 125.286 1.434 . . . . 0.0 111.686 175.36 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 56.2 m -83.4 -38.85 21.4 Favored 'General case' 0 C--O 1.222 -0.364 0 C-N-CA 123.175 0.59 . . . . 0.0 109.461 -178.515 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.454 HD11 HD22 ' A' ' 43' ' ' LEU . 14.3 tp -62.64 -37.82 87.84 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 125.0 1.32 . . . . 0.0 111.538 175.651 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.462 ' HA ' HG13 ' A' ' 66' ' ' ILE . 53.1 p -61.26 -25.76 67.3 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 113.2 0.815 . . . . 0.0 113.2 171.747 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -99.38 -28.29 13.35 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 125.092 1.357 . . . . 0.0 114.234 -177.196 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 51.9 mmtt -64.65 -36.47 84.36 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 125.806 1.642 . . . . 0.0 111.506 175.701 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.0 mp -115.31 3.64 14.26 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 125.408 1.483 . . . . 0.0 114.054 -174.0 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 42.3 m-80 56.13 61.13 2.87 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 126.347 1.859 . . . . 0.0 113.291 -179.171 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.462 HG13 ' HA ' ' A' ' 61' ' ' SER . 0.9 OUTLIER -134.82 178.11 5.9 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.715 0 C-N-CA 127.64 2.376 . . . . 0.0 111.226 -171.979 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.3 p -80.54 159.97 25.33 Favored 'General case' 0 N--CA 1.48 1.044 0 O-C-N 120.82 -1.175 . . . . 0.0 111.656 173.175 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 84.3 t -62.3 -29.13 45.98 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 C-N-CA 123.384 0.674 . . . . 0.0 111.303 172.943 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -81.28 -36.87 29.32 Favored 'General case' 0 N--CA 1.468 0.458 0 O-C-N 120.917 -1.114 . . . . 0.0 110.433 -179.436 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 9.7 tmtt? -64.08 -45.26 89.51 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 125.129 1.372 . . . . 0.0 110.702 175.922 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -60.0 -49.69 76.67 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 125.877 1.671 . . . . 0.0 113.008 170.335 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 34.7 ttmt -71.44 -23.14 61.79 Favored 'General case' 0 N--CA 1.466 0.332 0 O-C-N 121.003 -1.061 . . . . 0.0 111.876 -174.353 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -52.9 -40.34 63.44 Favored 'General case' 0 CA--C 1.546 0.796 0 CA-C-N 118.211 0.459 . . . . 0.0 111.324 172.039 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 27.8 m-85 -68.78 -40.72 79.52 Favored 'General case' 0 C--O 1.224 -0.238 0 C-N-CA 123.781 0.832 . . . . 0.0 111.486 179.5 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 61.2 mt -69.71 -26.85 31.53 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.676 0 C-N-CA 125.471 1.509 . . . . 0.0 111.121 179.666 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 71.2 mmtt -82.03 -32.0 30.69 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 125.016 1.326 . . . . 0.0 112.78 172.843 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 38.6 m-20 -82.11 -45.79 14.72 Favored 'General case' 0 C--O 1.232 0.161 0 C-N-CA 124.42 1.088 . . . . 0.0 111.082 -177.522 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 7.9 t -118.25 125.71 50.67 Favored 'General case' 0 N--CA 1.464 0.234 0 N-CA-C 113.225 0.824 . . . . 0.0 113.225 169.656 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 7.5 t-20 -148.87 -44.42 0.15 Allowed 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 114.046 1.128 . . . . 0.0 114.046 -170.264 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 1.3 mpp_? -115.14 18.72 16.11 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 126.005 1.722 . . . . 0.0 112.696 174.547 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 7.2 tt -127.71 -55.12 1.32 Allowed 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 124.8 1.24 . . . . 0.0 112.988 -173.817 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 55.4 -122.29 25.86 Favored Glycine 0 CA--C 1.535 1.313 0 N-CA-C 114.867 0.707 . . . . 0.0 114.867 178.571 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 13.0 mmt180 -132.19 163.94 27.44 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 126.464 1.906 . . . . 0.0 111.523 174.063 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 5.0 t -84.45 16.04 3.35 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 126.699 2.0 . . . . 0.0 114.672 -175.517 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 16.1 m120 -80.28 22.91 0.51 Allowed 'General case' 0 CA--C 1.55 0.962 0 O-C-N 120.059 -1.651 . . . . 0.0 114.681 -169.945 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 6.9 p-10 -106.0 11.12 31.96 Favored 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 126.18 1.792 . . . . 0.0 114.305 -173.956 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -125.94 22.63 7.35 Favored 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 125.004 1.322 . . . . 0.0 114.236 -166.409 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.23 -11.92 27.17 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 124.302 1.041 . . . . 0.0 113.583 178.234 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 15.0 t -153.37 121.97 6.34 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 125.161 1.384 . . . . 0.0 110.205 175.745 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -143.44 6.68 0.34 Allowed 'Isoleucine or valine' 0 CA--C 1.549 0.929 0 C-N-CA 125.294 1.438 . . . . 0.0 113.554 -175.525 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 77.26 -8.35 32.74 Favored Glycine 0 N--CA 1.476 1.312 0 O-C-N 120.74 -1.225 . . . . 0.0 114.899 -168.573 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 4.5 mp 53.69 84.64 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.638 0 C-N-CA 127.221 2.208 . . . . 0.0 110.088 -170.057 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 41.9 tp -58.5 92.36 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 126.295 1.838 . . . . 0.0 112.773 -168.951 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 88.2 mt-30 -138.65 -59.34 0.61 Allowed 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 124.919 1.288 . . . . 0.0 112.548 -179.108 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 63.5 mm-40 -144.77 162.15 37.46 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 125.495 1.518 . . . . 0.0 112.247 -175.364 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -123.09 101.53 7.46 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 125.308 1.443 . . . . 0.0 110.244 174.219 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 8.5 p -149.94 131.54 5.34 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 C-N-CA 124.982 1.313 . . . . 0.0 110.874 177.814 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 45.4 t -162.8 -64.93 0.05 OUTLIER 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 124.135 0.974 . . . . 0.0 112.247 173.697 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 11.1 t -89.31 -27.84 20.26 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 124.09 0.956 . . . . 0.0 113.336 -175.303 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 65.5 mtt -130.89 134.66 46.98 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 125.67 1.588 . . . . 0.0 110.259 173.359 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -136.5 5.26 2.93 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 125.449 1.5 . . . . 0.0 113.924 -175.364 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -114.64 159.49 20.42 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.871 1.669 . . . . 0.0 113.003 -174.595 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 9.5 mtpm? -112.17 108.2 17.38 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 125.739 1.616 . . . . 0.0 110.309 179.666 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 6.8 t -149.58 61.44 1.01 Allowed 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 124.851 1.26 . . . . 0.0 111.107 -178.106 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 55.6 mtt -132.54 164.89 25.62 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 125.891 1.676 . . . . 0.0 112.016 179.59 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 10.0 t -124.81 159.23 31.47 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 125.304 1.442 . . . . 0.0 112.626 179.206 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 1.5 m-90 . . . . . 0 C--O 1.253 1.28 0 C-N-CA 126.812 2.045 . . . . 0.0 111.944 -179.016 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 64.6 ttp . . . . . 0 N--CA 1.471 0.606 0 CA-C-O 120.837 0.351 . . . . 0.0 111.247 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -141.24 159.17 62.25 Favored Pre-proline 0 CA--C 1.547 0.861 0 C-N-CA 126.181 1.792 . . . . 0.0 111.098 178.167 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -71.17 -13.07 30.91 Favored 'Trans proline' 0 C--N 1.35 0.658 0 C-N-CA 122.777 2.318 . . . . 0.0 114.624 176.556 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 97.8 mt -107.64 45.96 0.97 Allowed 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 126.186 1.795 . . . . 0.0 112.918 -173.414 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 37.3 m-20 -105.49 -0.57 25.8 Favored 'General case' 0 N--CA 1.48 1.036 0 N-CA-C 114.67 1.359 . . . . 0.0 114.67 173.421 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -126.92 -58.8 1.29 Allowed 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 124.165 0.986 . . . . 0.0 113.625 -164.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.6 pp -109.19 5.37 9.24 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.786 0 C-N-CA 125.767 1.627 . . . . 0.0 113.227 -175.947 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 14.1 tt -45.57 -45.62 4.39 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.085 0 N-CA-C 115.398 1.629 . . . . 0.0 115.398 -170.638 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -144.74 22.86 1.6 Allowed 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 124.874 1.27 . . . . 0.0 112.892 -168.407 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -83.05 12.72 4.68 Favored 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 115.526 1.676 . . . . 0.0 115.526 -161.441 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 12.9 tt -146.23 26.51 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.913 0 C-N-CA 125.538 1.535 . . . . 0.0 113.7 -178.715 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 87.6 tttt . . . . . 0 N--CA 1.476 0.871 0 N-CA-C 114.195 1.183 . . . . 0.0 114.195 177.936 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 65.0 mt . . . . . 0 CA--C 1.541 0.618 0 N-CA-C 112.17 0.433 . . . . 0.0 112.17 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 18.8 t -73.21 168.4 19.2 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 123.579 0.752 . . . . 0.0 110.642 170.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -57.76 -46.94 83.84 Favored 'General case' 0 N--CA 1.475 0.791 0 O-C-N 120.49 -1.381 . . . . 0.0 112.657 -175.465 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 10.4 tt0 -70.79 -42.42 70.36 Favored 'General case' 0 N--CA 1.47 0.529 0 O-C-N 121.5 -0.75 . . . . 0.0 111.105 177.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 31.1 mm-40 -57.37 -45.71 84.13 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.952 0.901 . . . . 0.0 111.095 176.297 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 41.3 ttmt -61.49 -40.59 95.12 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 124.514 1.126 . . . . 0.0 111.292 177.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 56.4 mt -66.85 -40.42 85.81 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 CA-C-O 118.103 -0.951 . . . . 0.0 111.327 175.261 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 42.7 mt -63.51 -45.29 98.18 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.98 0 CA-C-N 120.828 1.649 . . . . 0.0 110.468 177.343 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -58.75 -48.91 79.57 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.359 1.064 . . . . 0.0 110.917 176.328 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -67.21 -52.1 45.3 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.97 1.308 . . . . 0.0 112.978 -179.19 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.9 mm-40 -60.84 -27.65 68.24 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-N 119.104 0.866 . . . . 0.0 112.793 -179.247 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -68.04 -58.15 4.96 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 123.392 0.677 . . . . 0.0 110.967 175.061 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 79.7 mt -62.6 -34.11 63.36 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.453 0 C-N-CA 126.649 1.979 . . . . 0.0 111.447 178.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -70.39 -25.86 63.44 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.105 0.962 . . . . 0.0 112.791 176.808 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -89.75 -39.11 13.35 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.26 1.024 . . . . 0.0 112.214 175.954 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.3 m -111.12 -5.2 11.21 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.147 0 N-CA-C 114.541 1.312 . . . . 0.0 114.541 -172.02 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 86.98 26.13 32.4 Favored Glycine 0 N--CA 1.473 1.117 0 C-N-CA 124.641 1.115 . . . . 0.0 115.737 159.508 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 55.9 10.98 0.63 Allowed 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 127.42 2.288 . . . . 0.0 115.18 -175.013 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 5.2 pt20 -124.06 -3.99 8.02 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 125.338 1.455 . . . . 0.0 113.573 -170.453 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 61.9 m-80 -122.01 0.4 9.66 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.09 1.356 . . . . 0.0 113.034 174.377 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 18.8 pt -76.86 154.52 5.63 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 C-N-CA 123.219 0.608 . . . . 0.0 111.597 176.364 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -139.16 145.05 38.89 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 125.045 1.338 . . . . 0.0 109.59 179.417 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -62.01 -27.58 68.97 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 118.875 0.761 . . . . 0.0 112.049 179.35 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -65.26 -49.94 76.15 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.432 0 C-N-CA 125.241 1.416 . . . . 0.0 109.888 175.179 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 76.5 m -78.49 -43.0 28.1 Favored 'General case' 0 C--O 1.222 -0.394 0 C-N-CA 123.685 0.794 . . . . 0.0 109.967 -175.04 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 24.2 tp -61.13 -34.35 74.85 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 124.962 1.305 . . . . 0.0 112.045 174.085 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.471 ' HA ' HG13 ' A' ' 66' ' ' ILE . 47.0 t -56.05 -31.51 63.23 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.149 0.98 . . . . 0.0 113.179 168.368 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -101.93 -19.06 15.4 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 125.254 1.422 . . . . 0.0 114.441 -175.565 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 68.8 mmtt -66.89 -40.35 87.74 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 124.386 1.074 . . . . 0.0 110.5 171.551 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.7 mp -106.74 -2.4 21.6 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.254 1.422 . . . . 0.0 114.438 -175.159 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 50.6 m-80 54.79 49.05 18.77 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 125.521 1.528 . . . . 0.0 112.457 -172.947 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.471 HG13 ' HA ' ' A' ' 61' ' ' SER . 15.3 pt -107.05 -162.01 0.15 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.662 0 C-N-CA 126.419 1.887 . . . . 0.0 110.994 -179.309 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 47.0 p -97.02 159.75 14.73 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 124.508 1.123 . . . . 0.0 111.316 167.125 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 93.5 t -62.06 -23.78 32.63 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.876 0 O-C-N 121.574 -0.704 . . . . 0.0 111.21 169.559 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 13.7 mp0 -81.43 -32.24 32.77 Favored 'General case' 0 CA--C 1.531 0.236 0 O-C-N 120.689 -1.257 . . . . 0.0 110.298 -176.654 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 41.0 mttm -66.79 -52.99 37.6 Favored 'General case' 0 C--N 1.346 0.43 0 CA-C-N 118.634 0.652 . . . . 0.0 110.256 165.044 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -57.8 -41.5 82.3 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 124.052 0.941 . . . . 0.0 112.362 -172.393 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt -73.36 -27.65 61.61 Favored 'General case' 0 N--CA 1.463 0.184 0 C-N-CA 125.489 1.516 . . . . 0.0 111.976 179.347 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -60.74 -45.37 94.57 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 118.067 0.394 . . . . 0.0 111.571 176.929 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 66.2 m-85 -59.96 -44.98 94.08 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 124.875 1.27 . . . . 0.0 111.046 179.153 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 95.3 mt -64.39 -29.58 47.75 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.709 0 C-N-CA 124.459 1.104 . . . . 0.0 111.308 -178.572 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 50.0 mmtt -83.21 -36.57 24.53 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 125.472 1.509 . . . . 0.0 113.509 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 5.7 p30 . . . . . 0 N--CA 1.466 0.341 0 CA-C-N 119.976 1.262 . . . . 0.0 112.004 -179.915 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 . . . . . 0 N--CA 1.475 0.783 0 N-CA-C 112.404 0.52 . . . . 0.0 112.404 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 55.79 48.13 18.88 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 125.951 1.701 . . . . 0.0 114.885 -179.128 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 20.8 t -131.52 135.89 58.36 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 C-N-CA 124.929 1.292 . . . . 0.0 111.434 178.221 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 50.1 m 52.72 31.96 11.24 Favored 'General case' 0 N--CA 1.483 1.184 0 N-CA-C 116.018 1.859 . . . . 0.0 116.018 170.053 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 32.3 t -149.54 -46.44 0.14 Allowed 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 124.354 1.062 . . . . 0.0 112.614 178.812 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 62.5 mtt -127.02 51.94 1.83 Allowed 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 125.414 1.486 . . . . 0.0 111.163 179.741 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -77.96 50.87 0.91 Allowed 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 125.9 1.68 . . . . 0.0 112.488 -178.485 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -135.87 166.11 24.06 Favored 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 125.989 1.716 . . . . 0.0 112.943 -172.852 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 65.2 pttt . . . . . 0 N--CA 1.476 0.855 0 C-N-CA 125.902 1.681 . . . . 0.0 112.589 176.297 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 58.6 ttm . . . . . 0 CA--C 1.538 0.495 0 N-CA-C 109.954 -0.387 . . . . 0.0 109.954 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 -136.68 153.58 75.93 Favored Pre-proline 0 CA--C 1.547 0.857 0 C-N-CA 125.049 1.34 . . . . 0.0 112.05 179.019 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 96.1 Cg_endo -79.56 -0.68 10.9 Favored 'Trans proline' 0 C--N 1.35 0.651 0 C-N-CA 123.581 2.854 . . . . 0.0 114.909 -178.718 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 89.1 mt -112.27 42.57 1.77 Allowed 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.899 1.68 . . . . 0.0 112.535 -174.584 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -112.6 0.8 15.54 Favored 'General case' 0 N--CA 1.478 0.969 0 N-CA-C 114.652 1.353 . . . . 0.0 114.652 175.761 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -117.4 -55.67 2.29 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 124.311 1.044 . . . . 0.0 113.175 -168.453 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -130.07 17.7 2.26 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.767 0 C-N-CA 126.138 1.775 . . . . 0.0 112.928 -175.301 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 9.9 tt -46.25 125.62 1.54 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 C-N-CA 124.461 1.105 . . . . 0.0 112.282 177.304 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -145.99 5.86 1.01 Allowed 'General case' 0 CA--C 1.545 0.759 0 N-CA-C 113.83 1.048 . . . . 0.0 113.83 -179.467 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -83.19 10.23 8.81 Favored 'General case' 0 CA--C 1.547 0.831 0 N-CA-C 114.553 1.316 . . . . 0.0 114.553 -172.55 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 7.1 tp -143.64 28.39 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.775 0 C-N-CA 126.607 1.963 . . . . 0.0 112.434 -177.416 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 88.8 tttt . . . . . 0 N--CA 1.472 0.668 0 N-CA-C 114.523 1.305 . . . . 0.0 114.523 -178.438 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 27.3 mt . . . . . 0 CA--C 1.541 0.627 0 CA-C-O 120.755 0.312 . . . . 0.0 111.032 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 19.2 t -72.0 170.52 13.66 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.29 0.636 . . . . 0.0 110.417 167.341 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -58.95 -47.37 85.32 Favored 'General case' 0 N--CA 1.473 0.678 0 O-C-N 120.479 -1.388 . . . . 0.0 112.404 -175.9 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 12.0 tt0 -70.06 -41.27 74.38 Favored 'General case' 0 N--CA 1.471 0.575 0 O-C-N 121.494 -0.754 . . . . 0.0 111.256 178.454 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 38.4 mm-40 -58.55 -44.23 89.57 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.831 1.252 . . . . 0.0 111.301 175.45 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 19.7 ttmm -63.14 -41.89 99.37 Favored 'General case' 0 N--CA 1.471 0.604 0 O-C-N 121.056 -1.028 . . . . 0.0 111.065 175.106 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 57.3 mt -67.61 -40.86 84.93 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 CA-C-O 117.713 -1.137 . . . . 0.0 111.879 178.583 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 34.8 mt -63.82 -43.89 98.02 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 CA-C-N 121.384 1.902 . . . . 0.0 109.954 176.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -59.39 -45.95 90.05 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.651 1.18 . . . . 0.0 110.91 177.214 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -66.45 -51.59 55.26 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.949 1.3 . . . . 0.0 112.984 176.55 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -58.18 -31.34 67.2 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 119.289 0.949 . . . . 0.0 112.752 179.716 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -66.5 -56.36 11.27 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 118.516 0.598 . . . . 0.0 110.748 177.492 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 84.1 mt -63.32 -33.26 60.12 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.417 0 C-N-CA 126.758 2.023 . . . . 0.0 111.478 177.72 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -71.54 -27.72 63.37 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 123.873 0.869 . . . . 0.0 112.552 176.825 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -87.54 -39.72 14.9 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.317 1.047 . . . . 0.0 112.206 176.47 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.4 m -108.27 -4.16 10.4 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.161 0 N-CA-C 114.221 1.193 . . . . 0.0 114.221 -173.854 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 84.47 23.03 52.41 Favored Glycine 0 N--CA 1.471 1.01 0 C-N-CA 125.134 1.35 . . . . 0.0 115.345 160.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 58.33 5.0 0.37 Allowed 'General case' 0 CA--C 1.554 1.126 0 C-N-CA 127.382 2.273 . . . . 0.0 115.104 -171.028 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 29.1 mt-30 -101.5 -16.22 16.87 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 125.66 1.584 . . . . 0.0 112.857 -172.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 42.3 m-80 -125.88 5.74 7.33 Favored 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 113.804 1.038 . . . . 0.0 113.804 -172.789 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 21.1 pt -77.61 154.09 5.36 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 O-C-N 121.776 -0.578 . . . . 0.0 111.781 174.678 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -140.02 142.74 36.21 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 124.777 1.231 . . . . 0.0 109.427 177.999 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -59.47 -26.3 65.12 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 119.252 0.933 . . . . 0.0 112.597 -179.121 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.9 mp -69.71 -42.31 80.25 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 C-N-CA 126.101 1.76 . . . . 0.0 110.864 175.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 95.9 m -80.9 -42.31 21.61 Favored 'General case' 0 C--O 1.224 -0.288 0 C-N-CA 123.472 0.709 . . . . 0.0 109.777 -179.133 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 14.5 tp -61.97 -37.96 86.73 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 125.978 1.711 . . . . 0.0 111.523 175.324 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.446 ' HA ' HG13 ' A' ' 66' ' ' ILE . 57.3 p -62.28 -23.81 66.93 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 113.363 0.875 . . . . 0.0 113.363 172.119 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 66.5 mttm -101.72 -28.48 12.45 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 125.221 1.409 . . . . 0.0 114.278 -176.432 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 10.7 mmtm -63.13 -33.23 75.02 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 125.396 1.479 . . . . 0.0 111.846 174.548 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.9 mt -118.75 0.81 11.52 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 126.531 1.932 . . . . 0.0 113.011 -169.497 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 42.5 m-80 53.69 59.07 4.56 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 126.222 1.809 . . . . 0.0 113.028 -178.288 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.446 HG13 ' HA ' ' A' ' 61' ' ' SER . 0.8 OUTLIER -131.47 175.39 11.35 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.717 0 C-N-CA 126.93 2.092 . . . . 0.0 111.693 -172.277 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -74.6 154.84 38.38 Favored 'General case' 0 N--CA 1.473 0.706 0 O-C-N 121.408 -0.807 . . . . 0.0 111.144 172.748 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 69.3 t -64.89 -27.65 42.94 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 C-N-CA 123.816 0.846 . . . . 0.0 111.565 171.406 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -79.69 -29.77 40.88 Favored 'General case' 0 N--CA 1.466 0.366 0 O-C-N 121.086 -1.008 . . . . 0.0 110.822 179.768 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 4.7 ttmm -72.82 -46.21 54.31 Favored 'General case' 0 C--N 1.341 0.201 0 C-N-CA 124.225 1.01 . . . . 0.0 110.717 171.619 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -60.49 -49.04 79.14 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 125.059 1.344 . . . . 0.0 112.621 178.355 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 18.3 ptmt -69.43 -27.03 64.91 Favored 'General case' 0 N--CA 1.469 0.475 0 O-C-N 121.165 -0.96 . . . . 0.0 111.471 -177.463 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -57.16 -36.3 70.59 Favored 'General case' 0 CA--C 1.549 0.909 0 CA-C-N 118.152 0.433 . . . . 0.0 112.135 177.539 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 29.5 m-85 -68.2 -45.17 74.1 Favored 'General case' 0 C--O 1.225 -0.19 0 C-N-CA 125.084 1.353 . . . . 0.0 110.744 175.659 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 56.1 mt -65.55 -33.6 64.73 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.562 0 C-N-CA 124.47 1.108 . . . . 0.0 111.145 -179.702 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 72.6 mmtt -75.49 -38.25 59.65 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 124.205 1.002 . . . . 0.0 112.609 -178.033 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 6.7 p30 . . . . . 0 C--N 1.344 0.341 0 CA-C-N 119.514 1.052 . . . . 0.0 110.703 176.471 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 . . . . . 0 CA--C 1.543 0.696 0 N-CA-C 112.528 0.566 . . . . 0.0 112.528 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -82.73 60.28 5.2 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 125.78 1.632 . . . . 0.0 112.72 -174.304 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 88.8 t -137.64 148.24 25.81 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 C-N-CA 125.838 1.655 . . . . 0.0 110.524 -178.792 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 10.7 t 65.44 -54.65 0.34 Allowed 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 128.061 2.544 . . . . 0.0 115.735 179.03 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 50.0 m -65.56 -33.08 75.07 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 124.159 0.984 . . . . 0.0 112.316 176.629 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 22.4 mmt -138.6 143.67 39.45 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 126.759 2.024 . . . . 0.0 109.419 165.003 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 15.1 tt0 -146.55 3.37 0.86 Allowed 'General case' 0 CA--C 1.551 1.001 0 N-CA-C 113.573 0.953 . . . . 0.0 113.573 -179.332 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -81.96 153.24 26.36 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 124.767 1.227 . . . . 0.0 113.044 -177.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 75.8 mmtt . . . . . 0 N--CA 1.483 1.183 0 C-N-CA 125.816 1.646 . . . . 0.0 113.99 179.551 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 52.0 ttm . . . . . 0 N--CA 1.469 0.523 0 N-CA-C 109.98 -0.378 . . . . 0.0 109.98 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -152.17 138.49 11.85 Favored Pre-proline 0 CA--C 1.551 1.002 0 C-N-CA 124.645 1.178 . . . . 0.0 111.749 -173.42 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 81.6 Cg_endo -82.8 -2.57 10.95 Favored 'Trans proline' 0 C--N 1.352 0.732 0 C-N-CA 123.287 2.658 . . . . 0.0 115.919 -176.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 67.3 mt -109.54 38.99 2.19 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 125.366 1.466 . . . . 0.0 113.227 -174.066 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -104.68 -0.49 27.44 Favored 'General case' 0 N--CA 1.48 1.035 0 N-CA-C 115.387 1.625 . . . . 0.0 115.387 175.454 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -115.68 -56.28 2.35 Favored 'General case' 0 N--CA 1.484 1.231 0 N-CA-C 113.598 0.962 . . . . 0.0 113.598 -167.534 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.9 pp -129.3 12.68 2.59 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.896 0 C-N-CA 126.005 1.722 . . . . 0.0 112.963 -171.599 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 12.9 tt -40.95 123.84 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.947 0 C-N-CA 125.646 1.579 . . . . 0.0 113.902 -177.419 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -153.67 120.85 5.76 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.452 1.501 . . . . 0.0 108.787 172.473 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 30.1 t0 -161.96 70.7 0.33 Allowed 'General case' 0 N--CA 1.469 0.51 0 CA-C-O 122.352 1.072 . . . . 0.0 109.148 -178.81 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 54.7 mt 53.41 63.01 0.21 Allowed 'Isoleucine or valine' 0 CA--C 1.548 0.867 0 C-N-CA 125.699 1.6 . . . . 0.0 110.414 -169.922 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 4.0 tmmm? . . . . . 0 N--CA 1.478 0.944 0 C-N-CA 124.882 1.273 . . . . 0.0 112.325 176.245 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 70.5 mt . . . . . 0 CA--C 1.537 0.447 0 N-CA-C 112.705 0.631 . . . . 0.0 112.705 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 28.1 m -73.43 166.94 22.28 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 124.2 1.0 . . . . 0.0 110.332 170.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -54.37 -43.63 71.52 Favored 'General case' 0 N--CA 1.474 0.765 0 O-C-N 121.132 -0.98 . . . . 0.0 113.052 -175.246 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 8.3 pt20 -75.06 -35.46 61.85 Favored 'General case' 0 N--CA 1.471 0.621 0 O-C-N 121.472 -0.767 . . . . 0.0 112.532 176.603 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 15.6 mm-40 -66.73 -41.09 88.44 Favored 'General case' 0 CA--C 1.537 0.445 0 O-C-N 121.686 -0.634 . . . . 0.0 110.487 179.789 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 15.3 ttmm -59.5 -41.68 90.46 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 123.867 0.867 . . . . 0.0 111.114 174.116 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 56.8 mt -68.41 -39.5 80.89 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.656 0 CA-C-O 117.856 -1.069 . . . . 0.0 111.388 176.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 27.5 mt -66.58 -42.42 89.91 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.976 0 CA-C-N 121.254 1.843 . . . . 0.0 110.629 178.003 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -55.47 -48.57 74.33 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 124.092 0.957 . . . . 0.0 110.017 175.004 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -67.55 -52.28 40.67 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.763 1.225 . . . . 0.0 113.659 178.649 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 52.8 mt-10 -60.15 -29.06 68.41 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-N 119.077 0.853 . . . . 0.0 112.889 -179.048 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -69.11 -54.04 17.08 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 118.613 0.642 . . . . 0.0 111.216 177.149 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 46.5 mt -61.01 -33.92 57.77 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.537 0 C-N-CA 125.281 1.432 . . . . 0.0 111.342 174.281 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -70.21 -22.83 62.88 Favored 'General case' 0 CA--C 1.546 0.816 0 O-C-N 121.211 -0.931 . . . . 0.0 113.064 175.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -93.03 -32.78 14.37 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.794 1.237 . . . . 0.0 112.916 178.644 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 4.7 m -121.9 -19.09 4.61 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.953 0 CA-C-N 119.595 1.089 . . . . 0.0 113.832 -174.006 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 86.18 142.19 6.59 Favored Glycine 0 CA--C 1.532 1.154 0 C-N-CA 125.247 1.404 . . . . 0.0 112.7 -171.787 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 46.4 tp -57.84 -19.75 31.19 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 125.484 1.514 . . . . 0.0 114.406 -177.432 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 35.9 mt-30 -80.75 -17.01 52.36 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 126.911 2.084 . . . . 0.0 113.033 -179.884 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 68.9 m-80 -115.81 -8.68 11.96 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 114.837 1.421 . . . . 0.0 114.837 -173.402 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 20.9 pt -68.21 156.8 6.75 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.546 0 C-N-CA 123.388 0.675 . . . . 0.0 111.736 169.871 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -131.25 149.61 52.5 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 124.269 1.027 . . . . 0.0 111.175 177.028 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -64.3 -27.07 68.78 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 123.645 0.778 . . . . 0.0 111.939 178.442 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -66.57 -50.21 68.5 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.399 0 C-N-CA 124.6 1.16 . . . . 0.0 109.13 173.882 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 82.9 m -73.01 -43.2 62.41 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 123.373 0.669 . . . . 0.0 110.868 -176.743 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 20.2 tp -63.95 -34.92 79.07 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.14 1.376 . . . . 0.0 111.862 176.101 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.508 ' HA ' HG13 ' A' ' 66' ' ' ILE . 25.7 t -55.8 -30.21 60.98 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 124.836 1.255 . . . . 0.0 112.727 169.629 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 11.8 mptt -100.52 -28.7 12.76 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 125.373 1.469 . . . . 0.0 113.51 -175.531 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 15.9 mmtm -64.46 -38.13 89.96 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.932 1.293 . . . . 0.0 111.373 177.868 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.3 mp -111.37 7.72 21.03 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 125.013 1.325 . . . . 0.0 113.823 -178.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 17.0 t30 55.01 57.01 5.96 Favored 'General case' 0 CA--C 1.552 1.052 0 CA-C-O 122.393 1.092 . . . . 0.0 111.605 177.185 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.508 HG13 ' HA ' ' A' ' 61' ' ' SER . 3.4 pt -127.57 -168.8 0.58 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.772 0 C-N-CA 126.617 1.967 . . . . 0.0 110.424 -173.627 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 41.7 p -89.25 160.63 16.83 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 123.935 0.894 . . . . 0.0 111.594 171.446 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 64.7 t -64.5 -23.67 33.92 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.944 0 O-C-N 121.658 -0.651 . . . . 0.0 111.209 168.406 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 26.3 mm-40 -78.61 -35.06 46.19 Favored 'General case' 0 N--CA 1.464 0.267 0 O-C-N 120.815 -1.178 . . . . 0.0 110.387 -177.481 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 35.2 mttm -65.05 -54.18 34.18 Favored 'General case' 0 C--N 1.346 0.432 0 CA-C-N 118.446 0.566 . . . . 0.0 110.587 166.836 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -56.75 -45.19 82.18 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.931 1.292 . . . . 0.0 112.311 -173.022 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 22.5 ttmm -68.65 -32.34 72.11 Favored 'General case' 0 CA--C 1.519 -0.228 0 C-N-CA 124.537 1.135 . . . . 0.0 111.203 178.459 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -63.34 -37.97 89.33 Favored 'General case' 0 CA--C 1.546 0.806 0 CA-C-O 118.793 -0.622 . . . . 0.0 112.578 179.575 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 79.5 m-85 -62.9 -42.91 99.95 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.52 1.128 . . . . 0.0 110.749 174.648 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 87.4 mt -71.03 -22.66 22.91 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.755 0 C-N-CA 125.057 1.343 . . . . 0.0 111.24 179.36 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 75.7 tttt -89.65 -32.96 16.83 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 125.572 1.549 . . . . 0.0 112.721 -177.885 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 8.9 p30 . . . . . 0 N--CA 1.467 0.384 0 CA-C-N 118.938 0.79 . . . . 0.0 111.617 170.918 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 22.1 mm-40 . . . . . 0 N--CA 1.477 0.887 0 N-CA-C 113.051 0.76 . . . . 0.0 113.051 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . 0.256 35.9 mt-10 52.65 38.96 27.41 Favored 'General case' 0 N--CA 1.48 1.062 0 N-CA-C 116.868 2.173 . . . . 0.0 116.868 172.139 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 33.1 t -81.7 146.82 6.74 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.327 0 C-N-CA 124.841 1.257 . . . . 0.0 111.671 -176.253 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 50.8 m 57.44 26.63 12.82 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 126.694 1.997 . . . . 0.0 115.252 177.721 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 23.2 t -149.65 -41.82 0.14 Allowed 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.559 1.144 . . . . 0.0 112.79 176.337 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 30.3 tpp -123.95 37.32 4.43 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 125.298 1.439 . . . . 0.0 111.889 -179.536 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -76.54 75.23 3.26 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 125.339 1.455 . . . . 0.0 111.504 -176.584 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -144.44 162.86 35.45 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 126.342 1.857 . . . . 0.0 111.979 -178.187 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 67.3 mttm . . . . . 0 N--CA 1.478 0.941 0 C-N-CA 125.643 1.577 . . . . 0.0 111.53 178.292 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.8 ttt . . . . . 0 N--CA 1.47 0.555 0 CA-C-O 120.532 0.206 . . . . 0.0 111.018 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 -141.24 147.02 45.29 Favored Pre-proline 0 CA--C 1.549 0.916 0 C-N-CA 125.241 1.417 . . . . 0.0 112.277 -175.955 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_endo -79.79 -22.42 7.66 Favored 'Trans proline' 0 C--N 1.35 0.641 0 C-N-CA 123.303 2.669 . . . . 0.0 115.199 -175.762 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 96.9 mt -113.17 42.43 1.92 Allowed 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.981 1.713 . . . . 0.0 112.084 -173.566 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -109.13 0.28 19.73 Favored 'General case' 0 N--CA 1.474 0.728 0 N-CA-C 114.661 1.356 . . . . 0.0 114.661 -177.927 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -126.26 -56.1 1.43 Allowed 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 124.574 1.149 . . . . 0.0 113.423 -164.308 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.9 pp -124.39 13.05 4.78 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 C-N-CA 126.223 1.809 . . . . 0.0 112.772 -173.478 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 11.4 tt -44.23 109.87 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.48 1.068 0 C-N-CA 125.693 1.597 . . . . 0.0 113.345 -177.602 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -150.95 14.95 0.73 Allowed 'General case' 0 N--CA 1.476 0.84 0 N-CA-C 115.173 1.546 . . . . 0.0 115.173 -177.373 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -86.3 8.84 19.77 Favored 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 115.15 1.537 . . . . 0.0 115.15 -170.346 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 6.8 tp -143.45 22.35 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.96 0 C-N-CA 125.547 1.539 . . . . 0.0 114.26 -173.153 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 50.1 mtmt . . . . . 0 N--CA 1.476 0.853 0 N-CA-C 114.508 1.299 . . . . 0.0 114.508 179.333 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.8 mt . . . . . 0 CA--C 1.543 0.681 0 N-CA-C 110.517 -0.179 . . . . 0.0 110.517 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 26.0 p -68.98 169.76 11.1 Favored 'General case' 0 N--CA 1.478 0.969 0 O-C-N 121.82 -0.55 . . . . 0.0 111.159 167.713 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -56.85 -44.36 82.05 Favored 'General case' 0 N--CA 1.473 0.71 0 O-C-N 120.909 -1.12 . . . . 0.0 111.766 176.377 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 9.3 tt0 -70.89 -44.91 65.32 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 123.587 0.755 . . . . 0.0 111.44 177.53 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 90.6 mt-30 -63.79 -37.19 86.43 Favored 'General case' 0 CA--C 1.534 0.363 0 O-C-N 121.722 -0.612 . . . . 0.0 111.777 179.433 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 23.6 ttmm -62.21 -43.5 98.68 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 123.805 0.842 . . . . 0.0 111.105 174.053 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 51.5 mt -65.24 -44.81 95.05 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 CA-C-N 119.021 0.828 . . . . 0.0 111.176 176.722 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 49.3 mt -64.81 -45.26 95.56 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 CA-C-N 120.095 1.316 . . . . 0.0 110.352 -179.711 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -57.09 -49.03 77.13 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 124.783 1.233 . . . . 0.0 110.357 176.838 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -65.94 -52.62 48.2 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 124.436 1.094 . . . . 0.0 112.601 179.116 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 18.7 mm-40 -60.96 -26.04 67.26 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 119.161 0.891 . . . . 0.0 113.089 -179.375 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.493 ' CE2' HG22 ' A' ' 55' ' ' ILE . 1.6 t80 -70.99 -59.12 2.96 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 123.979 0.912 . . . . 0.0 111.228 175.075 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 54.2 mt -60.12 -34.48 57.0 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 C-N-CA 126.229 1.812 . . . . 0.0 111.984 177.051 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -69.68 -24.82 63.65 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 123.953 0.901 . . . . 0.0 112.775 176.899 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -92.87 -29.41 15.95 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.497 1.119 . . . . 0.0 113.184 179.182 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 5.1 m -123.74 -22.82 2.6 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.981 0 N-CA-C 114.202 1.186 . . . . 0.0 114.202 -174.597 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 86.86 144.34 8.39 Favored Glycine 0 CA--C 1.534 1.275 0 C-N-CA 125.183 1.373 . . . . 0.0 113.373 -172.851 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -69.41 -5.37 23.2 Favored 'General case' 0 N--CA 1.478 0.967 0 N-CA-C 114.706 1.372 . . . . 0.0 114.706 -166.588 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 3.0 pm0 -101.54 -6.06 24.38 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 125.415 1.486 . . . . 0.0 114.087 173.63 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 76.4 m-20 -107.5 -12.08 15.36 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 124.57 1.148 . . . . 0.0 113.759 175.935 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . 0.493 HG22 ' CE2' ' A' ' 46' ' ' TYR . 40.5 pt -68.07 157.49 6.28 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 C-N-CA 123.949 0.899 . . . . 0.0 111.27 164.691 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.3 p -124.54 144.24 50.24 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 125.002 1.321 . . . . 0.0 110.292 174.299 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -61.81 -30.77 71.05 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 124.182 0.993 . . . . 0.0 111.103 175.892 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -61.42 -58.33 8.06 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.256 0 C-N-CA 124.772 1.229 . . . . 0.0 108.565 174.811 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 46.7 m -69.91 -41.35 74.81 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 123.255 0.622 . . . . 0.0 110.649 -174.413 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 24.4 tp -60.94 -36.38 79.21 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 123.631 0.772 . . . . 0.0 112.032 174.197 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.468 ' HA ' HG13 ' A' ' 66' ' ' ILE . 10.8 p -62.21 -19.63 63.34 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 113.859 1.059 . . . . 0.0 113.859 173.667 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -105.21 -25.19 12.56 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 125.244 1.418 . . . . 0.0 114.665 176.299 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 22.1 mmtt -62.35 -35.8 80.24 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-N 119.778 1.172 . . . . 0.0 110.951 172.404 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 85.8 mt -113.8 -1.33 13.94 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 125.92 1.688 . . . . 0.0 114.029 -171.324 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 32.2 m-80 56.7 61.51 2.62 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 126.066 1.746 . . . . 0.0 113.386 -177.089 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.468 HG13 ' HA ' ' A' ' 61' ' ' SER . 0.5 OUTLIER -135.97 176.64 7.84 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.907 0 C-N-CA 126.486 1.915 . . . . 0.0 112.118 -171.0 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -71.22 154.19 41.86 Favored 'General case' 0 N--CA 1.476 0.829 0 O-C-N 121.307 -0.871 . . . . 0.0 111.535 173.007 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 86.3 t -65.13 -24.47 35.38 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 C-N-CA 124.084 0.954 . . . . 0.0 111.839 175.35 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 75.4 mm-40 -85.97 -35.36 20.47 Favored 'General case' 0 N--CA 1.469 0.484 0 O-C-N 120.907 -1.12 . . . . 0.0 110.67 176.942 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 45.3 tttt -65.01 -42.52 94.36 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 123.521 0.728 . . . . 0.0 111.117 177.904 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -58.56 -40.31 82.73 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 125.095 1.358 . . . . 0.0 112.296 170.617 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 23.0 ttpt -70.0 -32.17 70.22 Favored 'General case' 0 C--O 1.224 -0.261 0 C-N-CA 124.672 1.189 . . . . 0.0 111.29 -178.943 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -57.53 -37.69 73.48 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 123.168 0.587 . . . . 0.0 112.511 179.921 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 63.5 m-85 -66.25 -44.26 84.2 Favored 'General case' 0 N--CA 1.464 0.227 0 C-N-CA 125.088 1.355 . . . . 0.0 110.424 178.151 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 74.6 mt -64.62 -45.86 94.19 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.437 0 C-N-CA 124.751 1.22 . . . . 0.0 109.51 178.371 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 22.7 mmmt -65.72 -32.47 74.04 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 125.449 1.5 . . . . 0.0 112.712 -175.746 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 6.5 p30 . . . . . 0 CA--C 1.538 0.485 0 CA-C-N 119.259 0.936 . . . . 0.0 111.763 176.539 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 63.2 mm-40 . . . . . 0 N--CA 1.477 0.877 0 N-CA-C 113.165 0.802 . . . . 0.0 113.165 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 42.6 59.44 2.76 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 127.082 2.153 . . . . 0.0 115.09 175.46 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 12.3 t -77.23 61.04 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 C-N-CA 126.385 1.874 . . . . 0.0 112.277 -172.017 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 27.5 t -165.39 -42.73 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 125.375 1.47 . . . . 0.0 112.112 176.809 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 46.3 m -126.01 -22.71 4.07 Favored 'General case' 0 N--CA 1.479 0.999 0 N-CA-C 115.055 1.502 . . . . 0.0 115.055 -173.066 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 60.9 mtt -137.53 40.16 2.42 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 124.798 1.239 . . . . 0.0 111.72 -176.244 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 28.5 tt0 -77.2 70.39 3.59 Favored 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 126.168 1.787 . . . . 0.0 112.001 -176.202 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -143.84 149.78 37.48 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.153 1.381 . . . . 0.0 112.706 -178.922 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 67.2 mttm . . . . . 0 N--CA 1.483 1.189 0 N-CA-C 114.943 1.461 . . . . 0.0 114.943 -179.936 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 95.2 mtp . . . . . 0 N--CA 1.474 0.741 0 N-CA-C 110.815 -0.069 . . . . 0.0 110.815 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 17.6 m-20 -143.3 119.77 6.64 Favored Pre-proline 0 CA--C 1.549 0.924 0 C-N-CA 124.813 1.245 . . . . 0.0 111.405 178.252 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_endo -84.47 -12.1 7.92 Favored 'Trans proline' 0 C--N 1.351 0.661 0 C-N-CA 123.417 2.745 . . . . 0.0 115.173 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -107.9 29.66 7.06 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 125.549 1.539 . . . . 0.0 114.387 -166.601 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -104.66 -6.72 20.17 Favored 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 116.149 1.907 . . . . 0.0 116.149 -173.124 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.14 -28.55 1.71 Allowed 'General case' 0 N--CA 1.481 1.088 0 N-CA-C 117.059 2.244 . . . . 0.0 117.059 -169.482 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.3 pp -134.63 14.14 1.18 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.338 0 C-N-CA 125.545 1.538 . . . . 0.0 113.682 -178.036 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -56.1 114.02 0.59 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.848 0 C-N-CA 124.987 1.315 . . . . 0.0 111.792 -173.213 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -146.91 0.26 0.73 Allowed 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 113.862 1.06 . . . . 0.0 113.862 179.692 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -81.37 2.85 26.58 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 115.372 1.619 . . . . 0.0 115.372 -163.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 13.1 tt -145.31 24.71 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 C-N-CA 125.907 1.683 . . . . 0.0 113.637 -176.804 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 41.4 ttmt . . . . . 0 N--CA 1.472 0.671 0 C-N-CA 123.835 0.854 . . . . 0.0 113.125 174.158 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 5.0 mt . . . . . 0 CA--C 1.542 0.644 0 N-CA-C 110.136 -0.32 . . . . 0.0 110.136 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 73.4 m -72.95 164.02 27.29 Favored 'General case' 0 N--CA 1.479 1.009 0 O-C-N 121.869 -0.519 . . . . 0.0 110.514 170.162 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -55.42 -44.06 75.89 Favored 'General case' 0 N--CA 1.48 1.027 0 O-C-N 120.674 -1.266 . . . . 0.0 113.347 -172.832 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 6.1 pt20 -74.67 -36.75 62.81 Favored 'General case' 0 N--CA 1.47 0.565 0 O-C-N 121.482 -0.761 . . . . 0.0 112.486 174.953 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 89.7 mt-30 -63.81 -38.7 92.07 Favored 'General case' 0 N--CA 1.466 0.353 0 O-C-N 121.609 -0.682 . . . . 0.0 111.329 177.963 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 40.8 ttmt -61.91 -42.44 99.09 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 124.29 1.036 . . . . 0.0 111.063 176.763 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 44.5 mt -69.34 -42.44 81.23 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 CA-C-O 118.378 -0.82 . . . . 0.0 111.064 176.868 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 45.6 mt -63.6 -45.5 97.42 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.002 0 CA-C-N 120.278 1.399 . . . . 0.0 110.069 178.32 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -58.51 -48.65 80.11 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 125.301 1.44 . . . . 0.0 110.753 178.099 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -64.05 -52.63 58.51 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 124.461 1.104 . . . . 0.0 112.822 176.156 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.6 mm-40 -60.48 -32.15 71.14 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 118.964 0.802 . . . . 0.0 112.52 -179.456 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.5 t80 -65.71 -55.86 15.12 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 118.716 0.689 . . . . 0.0 110.642 176.939 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 66.6 mt -64.21 -34.59 69.97 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.251 0 C-N-CA 126.786 2.035 . . . . 0.0 111.739 179.205 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -68.82 -38.64 80.0 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 123.486 0.714 . . . . 0.0 111.336 175.705 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -77.42 -38.55 49.45 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.506 0.722 . . . . 0.0 112.548 179.525 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.3 m -108.64 -6.14 10.86 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.162 0 N-CA-C 114.25 1.204 . . . . 0.0 114.25 -174.206 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 86.75 26.02 33.42 Favored Glycine 0 N--CA 1.473 1.161 0 C-N-CA 124.775 1.179 . . . . 0.0 115.316 161.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 54.49 11.22 0.4 Allowed 'General case' 0 CA--C 1.554 1.115 0 C-N-CA 127.602 2.361 . . . . 0.0 115.32 -173.118 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 4.7 pt20 -121.47 -2.34 9.48 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 125.237 1.415 . . . . 0.0 113.546 -170.956 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 53.8 m-80 -125.59 2.73 7.58 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.03 1.332 . . . . 0.0 113.21 174.753 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 18.1 pt -75.16 152.19 6.55 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 CA-C-N 118.443 0.565 . . . . 0.0 111.459 175.214 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -138.81 145.06 39.64 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 124.327 1.051 . . . . 0.0 109.724 178.481 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -60.6 -26.66 67.14 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 119.259 0.936 . . . . 0.0 112.38 -179.296 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -70.27 -41.35 78.67 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.463 0 C-N-CA 126.086 1.754 . . . . 0.0 110.745 175.869 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 73.7 m -81.14 -44.57 17.71 Favored 'General case' 0 C--O 1.222 -0.365 0 O-C-N 121.81 -0.556 . . . . 0.0 109.53 -178.591 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 14.2 tp -61.15 -37.25 82.18 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.76 1.624 . . . . 0.0 111.682 176.214 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.446 ' HA ' HG13 ' A' ' 66' ' ' ILE . 59.7 p -61.42 -24.04 66.25 Favored 'General case' 0 N--CA 1.477 0.879 0 N-CA-C 113.488 0.922 . . . . 0.0 113.488 171.645 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -104.04 -26.54 12.56 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 125.489 1.515 . . . . 0.0 114.236 -175.149 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 60.0 mmtt -64.66 -35.04 79.75 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 125.336 1.454 . . . . 0.0 111.48 173.305 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 6.9 mt -116.39 -2.07 12.15 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 126.274 1.83 . . . . 0.0 112.908 -166.702 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 26.4 m-80 56.11 61.75 2.63 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 126.744 2.018 . . . . 0.0 113.282 -176.547 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.446 HG13 ' HA ' ' A' ' 61' ' ' SER . 0.6 OUTLIER -134.11 176.3 9.21 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 C-N-CA 126.875 2.07 . . . . 0.0 111.441 -173.137 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.4 p -78.72 158.78 28.22 Favored 'General case' 0 N--CA 1.479 1.007 0 O-C-N 121.069 -1.019 . . . . 0.0 111.231 172.943 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 92.0 t -63.88 -28.56 45.2 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.045 0 O-C-N 121.509 -0.744 . . . . 0.0 111.416 172.863 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -78.74 -38.76 38.01 Favored 'General case' 0 N--CA 1.469 0.497 0 O-C-N 120.923 -1.11 . . . . 0.0 109.722 -177.644 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 5.0 tmtm? -66.54 -47.28 73.38 Favored 'General case' 0 N--CA 1.463 0.213 0 C-N-CA 125.737 1.615 . . . . 0.0 110.615 175.245 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -58.24 -47.71 82.68 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.072 1.349 . . . . 0.0 112.9 172.514 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 35.0 ttmt -69.54 -25.35 63.97 Favored 'General case' 0 N--CA 1.464 0.252 0 O-C-N 120.993 -1.067 . . . . 0.0 111.473 -176.866 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -55.21 -41.44 72.04 Favored 'General case' 0 CA--C 1.545 0.753 0 CA-C-N 118.097 0.408 . . . . 0.0 111.576 173.886 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 53.4 m-85 -65.18 -45.61 84.18 Favored 'General case' 0 C--O 1.221 -0.408 0 C-N-CA 124.68 1.192 . . . . 0.0 111.03 176.089 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 65.3 mt -65.27 -24.87 35.94 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.7 0 C-N-CA 124.128 0.971 . . . . 0.0 111.363 -178.706 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 72.8 mmtt -87.57 -24.87 23.88 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 125.404 1.482 . . . . 0.0 114.547 179.637 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 10.6 p30 . . . . . 0 N--CA 1.47 0.537 0 CA-C-N 120.463 1.483 . . . . 0.0 112.103 169.087 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 . . . . . 0 CA--C 1.543 0.694 0 CA-C-O 120.977 0.418 . . . . 0.0 111.706 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -135.3 113.7 11.52 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 124.844 1.258 . . . . 0.0 110.43 -179.017 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 7.7 t -142.64 151.46 17.81 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 C-N-CA 125.621 1.568 . . . . 0.0 109.95 -174.301 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 38.4 t -138.13 -64.06 0.54 Allowed 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 124.1 0.96 . . . . 0.0 112.456 176.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 15.8 t -65.85 -31.94 73.18 Favored 'General case' 0 N--CA 1.478 0.96 0 O-C-N 121.455 -0.778 . . . . 0.0 113.009 -177.948 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 98.4 mmm -107.25 18.43 21.66 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.891 1.676 . . . . 0.0 113.106 179.003 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 24.3 tt0 -79.79 53.46 1.64 Allowed 'General case' 0 CA--C 1.553 1.063 0 C-N-CA 124.757 1.223 . . . . 0.0 112.373 -176.144 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 56.32 -179.4 0.04 OUTLIER 'General case' 0 CA--C 1.552 1.05 0 C-N-CA 127.0 2.12 . . . . 0.0 114.713 -170.867 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.477 0.924 0 C-N-CA 125.757 1.623 . . . . 0.0 112.081 177.495 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 95.8 mtp . . . . . 0 N--CA 1.474 0.726 0 CA-C-O 120.983 0.421 . . . . 0.0 110.151 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 -142.51 149.41 50.76 Favored Pre-proline 0 CA--C 1.549 0.905 0 C-N-CA 124.772 1.229 . . . . 0.0 112.422 -174.241 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -78.48 -2.93 12.92 Favored 'Trans proline' 0 C--N 1.353 0.766 0 C-N-CA 124.05 3.167 . . . . 0.0 114.61 178.048 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 94.7 mt -107.86 44.16 1.13 Allowed 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 126.218 1.807 . . . . 0.0 111.526 179.787 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -101.56 -19.04 15.65 Favored 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 114.648 1.351 . . . . 0.0 114.648 176.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.7 -32.37 5.18 Favored 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 115.94 1.83 . . . . 0.0 115.94 -166.267 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.2 pp -132.88 12.06 1.5 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.237 0 C-N-CA 125.011 1.324 . . . . 0.0 113.979 -176.957 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 14.9 tt -51.44 125.79 5.59 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 C-N-CA 124.805 1.242 . . . . 0.0 112.773 -173.717 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -146.52 -1.71 0.7 Allowed 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 114.154 1.168 . . . . 0.0 114.154 -179.399 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -88.06 9.98 20.69 Favored 'General case' 0 CA--C 1.544 0.715 0 N-CA-C 114.754 1.39 . . . . 0.0 114.754 -169.34 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 14.2 tt -144.08 23.2 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 C-N-CA 126.428 1.891 . . . . 0.0 113.065 -175.181 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 38.1 ttpt . . . . . 0 N--CA 1.471 0.603 0 N-CA-C 115.108 1.521 . . . . 0.0 115.108 -173.287 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.1 mt . . . . . 0 CA--C 1.545 0.766 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 71.1 m -73.38 165.13 25.63 Favored 'General case' 0 N--CA 1.48 1.059 0 O-C-N 121.883 -0.511 . . . . 0.0 110.644 169.879 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -55.77 -43.48 76.79 Favored 'General case' 0 N--CA 1.48 1.058 0 O-C-N 120.588 -1.32 . . . . 0.0 113.382 -174.586 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 12.7 tt0 -73.64 -41.44 62.75 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 123.374 0.67 . . . . 0.0 111.464 175.111 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 85.8 mt-30 -62.78 -37.89 88.47 Favored 'General case' 0 CA--C 1.535 0.37 0 O-C-N 121.648 -0.658 . . . . 0.0 111.967 179.334 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 19.8 ttmm -59.4 -41.47 89.5 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 124.355 1.062 . . . . 0.0 110.978 174.348 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 43.3 mt -70.01 -42.37 79.5 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.561 0 CA-C-O 118.234 -0.889 . . . . 0.0 111.099 177.715 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 42.6 mt -64.71 -43.88 96.56 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.891 0 CA-C-N 120.467 1.485 . . . . 0.0 110.35 177.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -57.24 -49.18 76.85 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.955 1.302 . . . . 0.0 110.254 177.386 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -65.45 -52.22 54.66 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 124.256 1.022 . . . . 0.0 112.854 177.272 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.0 mm-40 -60.58 -27.56 67.8 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 119.165 0.893 . . . . 0.0 113.038 -178.91 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.452 ' CE2' HG22 ' A' ' 55' ' ' ILE . 1.6 t80 -70.89 -57.4 4.63 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 123.714 0.806 . . . . 0.0 111.153 176.186 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 75.6 mt -60.3 -34.26 56.81 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.49 0 C-N-CA 126.657 1.983 . . . . 0.0 111.338 176.744 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -70.69 -24.42 62.67 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 124.12 0.968 . . . . 0.0 113.111 176.032 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -91.25 -32.41 15.76 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.396 1.078 . . . . 0.0 112.621 178.375 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 5.3 m -121.0 -19.81 4.66 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.981 0 N-CA-C 113.992 1.108 . . . . 0.0 113.992 -173.3 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 83.58 141.47 4.58 Favored Glycine 0 CA--C 1.531 1.085 0 C-N-CA 125.034 1.302 . . . . 0.0 112.205 -171.092 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -65.06 -12.82 54.87 Favored 'General case' 0 N--CA 1.477 0.921 0 CA-C-O 122.986 1.374 . . . . 0.0 113.859 -172.611 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 35.3 mt-30 -78.98 -15.78 57.81 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 126.01 1.724 . . . . 0.0 112.976 175.229 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 60.6 m-80 -116.22 -6.16 11.86 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 114.713 1.375 . . . . 0.0 114.713 -173.061 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . 0.452 HG22 ' CE2' ' A' ' 46' ' ' TYR . 15.5 pt -72.82 160.72 5.2 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 C-N-CA 123.753 0.821 . . . . 0.0 111.644 167.988 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -133.38 146.89 51.67 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 125.025 1.33 . . . . 0.0 110.577 176.004 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -63.05 -28.22 69.94 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.806 0.843 . . . . 0.0 112.135 177.672 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -64.04 -48.8 84.35 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.513 0 C-N-CA 125.275 1.43 . . . . 0.0 109.689 174.574 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 99.3 m -77.68 -40.02 42.91 Favored 'General case' 0 C--O 1.224 -0.277 0 C-N-CA 123.77 0.828 . . . . 0.0 110.721 -176.765 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 17.3 tp -63.44 -37.07 85.89 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.632 1.173 . . . . 0.0 111.774 173.611 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.442 ' HA ' HG13 ' A' ' 66' ' ' ILE . 40.1 t -55.2 -29.56 58.17 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.849 1.259 . . . . 0.0 112.753 169.341 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 59.5 mttm -95.41 -36.33 11.39 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 125.007 1.323 . . . . 0.0 113.569 -178.036 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 10.3 mmtm -61.94 -35.66 79.1 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 125.486 1.514 . . . . 0.0 112.193 -178.856 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.2 mp -115.53 6.67 14.72 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 114.113 1.153 . . . . 0.0 114.113 -176.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 13.9 m-80 57.21 59.11 3.53 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 126.431 1.893 . . . . 0.0 113.214 -179.327 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.442 HG13 ' HA ' ' A' ' 61' ' ' SER . 0.9 OUTLIER -125.67 -168.06 0.53 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.789 0 C-N-CA 126.755 2.022 . . . . 0.0 110.982 -172.427 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.5 p -96.35 160.11 14.59 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.311 1.044 . . . . 0.0 110.85 171.052 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 63.9 t -63.66 -28.75 45.63 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.893 0 O-C-N 121.748 -0.595 . . . . 0.0 111.417 173.801 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 44.4 mm-40 -78.55 -39.57 37.39 Favored 'General case' 0 N--CA 1.468 0.431 0 O-C-N 121.046 -1.034 . . . . 0.0 110.123 -179.16 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 5.4 tmtm? -64.38 -47.19 80.18 Favored 'General case' 0 N--CA 1.463 0.181 0 C-N-CA 125.245 1.418 . . . . 0.0 110.604 176.271 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -58.68 -48.14 82.11 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 125.687 1.595 . . . . 0.0 113.233 172.264 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 20.0 ttmm -68.34 -27.64 66.45 Favored 'General case' 0 N--CA 1.466 0.348 0 O-C-N 120.941 -1.1 . . . . 0.0 111.251 -177.928 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -56.96 -38.75 73.4 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 122.898 0.479 . . . . 0.0 112.152 176.403 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 68.1 m-85 -64.42 -45.43 87.61 Favored 'General case' 0 N--CA 1.464 0.272 0 C-N-CA 125.215 1.406 . . . . 0.0 110.956 175.091 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 81.5 mt -69.53 -26.81 31.92 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.649 0 C-N-CA 125.205 1.402 . . . . 0.0 111.468 -177.319 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 53.9 mtmt -79.56 -37.64 35.94 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.595 1.158 . . . . 0.0 113.21 177.168 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 5.9 p30 . . . . . 0 C--N 1.342 0.275 0 CA-C-N 119.431 1.014 . . . . 0.0 111.915 177.642 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 . . . . . 0 CA--C 1.548 0.872 0 CA-C-O 120.915 0.388 . . . . 0.0 111.608 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -108.03 109.61 21.1 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 124.885 1.274 . . . . 0.0 111.563 -176.643 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 53.4 t -127.86 91.41 1.7 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 C-N-CA 125.671 1.589 . . . . 0.0 109.099 174.939 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 38.0 t -169.77 -36.54 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 124.777 1.231 . . . . 0.0 111.949 176.658 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 28.1 t -139.82 130.22 25.46 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 125.142 1.377 . . . . 0.0 111.247 177.211 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 76.3 mtm 51.64 46.06 27.13 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 126.438 1.895 . . . . 0.0 113.835 173.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -85.51 4.92 33.64 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 126.328 1.851 . . . . 0.0 114.431 -177.809 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -74.3 163.22 28.07 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 125.529 1.532 . . . . 0.0 114.078 -177.333 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 62.3 mtpt . . . . . 0 N--CA 1.479 0.989 0 C-N-CA 126.344 1.858 . . . . 0.0 112.041 177.202 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 52.0 tpp . . . . . 0 N--CA 1.474 0.743 0 CA-C-O 121.87 0.843 . . . . 0.0 111.073 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -136.61 149.67 67.95 Favored Pre-proline 0 CA--C 1.547 0.861 0 C-N-CA 125.282 1.433 . . . . 0.0 112.023 -176.428 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_endo -81.84 -12.22 11.02 Favored 'Trans proline' 0 C--N 1.351 0.669 0 C-N-CA 123.297 2.665 . . . . 0.0 114.827 178.326 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 89.0 mt -101.01 47.01 0.92 Allowed 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.748 1.619 . . . . 0.0 113.285 -170.248 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 -105.51 -3.1 22.83 Favored 'General case' 0 N--CA 1.479 1.017 0 N-CA-C 114.795 1.406 . . . . 0.0 114.795 172.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -130.54 -57.32 1.06 Allowed 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 124.339 1.055 . . . . 0.0 113.356 -165.773 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.9 pp -109.1 12.16 8.82 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 C-N-CA 125.923 1.689 . . . . 0.0 112.837 -176.617 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 15.7 tt -46.96 130.09 3.33 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.777 0 C-N-CA 124.817 1.247 . . . . 0.0 112.314 176.113 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -148.79 49.33 1.0 Allowed 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.533 1.133 . . . . 0.0 111.756 -170.895 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 -106.06 11.12 31.84 Favored 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 114.005 1.113 . . . . 0.0 114.005 -175.303 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 7.2 tp -148.98 32.57 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.919 0 C-N-CA 125.589 1.556 . . . . 0.0 113.458 -172.96 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 3.1 tmtm? . . . . . 0 N--CA 1.474 0.768 0 C-N-CA 123.854 0.861 . . . . 0.0 113.042 -179.449 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.2 mt . . . . . 0 CA--C 1.545 0.775 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 22.8 t -71.48 164.71 25.29 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 123.006 0.523 . . . . 0.0 110.805 170.655 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -56.74 -44.53 81.78 Favored 'General case' 0 N--CA 1.477 0.906 0 O-C-N 120.388 -1.445 . . . . 0.0 113.155 -174.04 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 7.5 pt20 -76.64 -34.72 58.3 Favored 'General case' 0 N--CA 1.47 0.568 0 O-C-N 121.626 -0.671 . . . . 0.0 112.251 174.59 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 89.2 mt-30 -66.0 -39.44 90.3 Favored 'General case' 0 CA--C 1.53 0.207 0 O-C-N 121.693 -0.629 . . . . 0.0 111.535 -179.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 40.8 ttmt -59.6 -42.27 92.23 Favored 'General case' 0 N--CA 1.464 0.248 0 C-N-CA 124.749 1.22 . . . . 0.0 110.621 176.034 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 48.0 mt -68.56 -42.3 83.46 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.481 0 CA-C-O 118.256 -0.878 . . . . 0.0 111.06 177.286 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 40.2 mt -64.47 -44.36 96.97 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 CA-C-N 120.601 1.546 . . . . 0.0 110.335 178.668 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -60.61 -48.78 80.27 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 125.114 1.366 . . . . 0.0 111.128 177.366 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -64.27 -51.36 63.96 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 124.794 1.237 . . . . 0.0 112.49 177.27 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 17.0 mm-40 -61.17 -28.82 69.4 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-N 118.991 0.814 . . . . 0.0 112.545 179.246 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -65.3 -58.55 5.65 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-N 118.944 0.793 . . . . 0.0 110.47 174.434 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.3 mt -62.37 -35.58 70.28 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.363 0 C-N-CA 126.796 2.038 . . . . 0.0 111.796 179.394 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -72.08 -28.04 63.05 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.021 0.928 . . . . 0.0 112.389 178.551 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -86.71 -38.08 17.32 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.146 0.978 . . . . 0.0 112.555 175.429 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.5 m -108.5 -7.06 10.95 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.15 0 N-CA-C 114.664 1.357 . . . . 0.0 114.664 -173.197 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 86.21 27.77 29.84 Favored Glycine 0 CA--C 1.531 1.09 0 C-N-CA 124.732 1.158 . . . . 0.0 115.336 162.488 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 55.38 14.18 1.06 Allowed 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 127.224 2.21 . . . . 0.0 114.895 -176.165 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 5.1 pt20 -124.12 -6.94 7.73 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 125.147 1.379 . . . . 0.0 113.969 -170.449 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 57.2 m-80 -118.74 0.53 11.47 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 124.766 1.226 . . . . 0.0 113.264 174.414 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 23.0 pt -75.96 152.37 6.15 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 C-N-CA 123.271 0.628 . . . . 0.0 112.012 177.519 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -141.48 146.53 36.57 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 125.524 1.529 . . . . 0.0 109.354 176.442 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -62.94 -28.23 69.93 Favored 'General case' 0 C--O 1.222 -0.36 0 C-N-CA 123.743 0.817 . . . . 0.0 112.025 178.455 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -63.55 -43.38 98.25 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.471 0 C-N-CA 125.193 1.397 . . . . 0.0 109.864 174.15 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 81.9 m -83.53 -43.0 16.2 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 123.867 0.867 . . . . 0.0 110.296 -174.18 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 6.2 mt -59.13 -37.19 76.65 Favored 'General case' 0 CA--C 1.539 0.532 0 O-C-N 121.447 -0.783 . . . . 0.0 111.977 169.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.482 ' HA ' HG13 ' A' ' 66' ' ' ILE . 28.7 t -52.31 -33.82 44.09 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 124.055 0.942 . . . . 0.0 111.938 173.179 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -99.2 -29.53 12.78 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 124.729 1.212 . . . . 0.0 113.986 -174.774 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 18.7 mmmt -62.49 -29.13 70.32 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 125.108 1.363 . . . . 0.0 112.817 177.593 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.9 mp -127.34 14.62 7.18 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 124.865 1.266 . . . . 0.0 113.901 -177.51 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . 0.278 8.1 p30 47.12 51.18 13.36 Favored 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 126.211 1.805 . . . . 0.0 113.712 -176.257 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.482 HG13 ' HA ' ' A' ' 61' ' ' SER . 2.7 pt -110.46 -174.88 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 C-N-CA 126.905 2.082 . . . . 0.0 111.253 -177.168 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -84.96 158.55 20.49 Favored 'General case' 0 N--CA 1.477 0.912 0 O-C-N 121.227 -0.92 . . . . 0.0 110.999 170.881 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 95.5 t -63.67 -31.05 51.56 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 O-C-N 121.809 -0.557 . . . . 0.0 111.199 170.901 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -74.94 -35.31 62.16 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 119.783 1.174 . . . . 0.0 110.367 178.511 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 22.2 tttt -65.56 -48.9 70.83 Favored 'General case' 0 C--N 1.342 0.257 0 C-N-CA 123.279 0.631 . . . . 0.0 110.833 175.489 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -58.28 -41.46 84.42 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.917 1.687 . . . . 0.0 113.087 175.942 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 37.2 ttmt -74.13 -30.4 62.28 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 125.472 1.509 . . . . 0.0 111.6 -178.714 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -56.54 -42.92 79.31 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 122.85 0.46 . . . . 0.0 111.772 177.242 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 53.5 m-85 -64.53 -42.57 95.66 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 125.006 1.323 . . . . 0.0 111.004 178.495 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 74.0 mt -65.56 -38.98 83.69 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.477 0 C-N-CA 124.05 0.94 . . . . 0.0 110.672 178.817 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 71.3 mmtt -72.6 -40.72 66.32 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 124.761 1.224 . . . . 0.0 112.969 -177.403 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 4.7 p30 . . . . . 0 CA--C 1.532 0.284 0 CA-C-N 118.636 0.653 . . . . 0.0 111.208 -178.949 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 . . . . . 0 CA--C 1.544 0.731 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -146.23 31.47 1.01 Allowed 'General case' 0 N--CA 1.479 0.984 0 N-CA-C 115.503 1.668 . . . . 0.0 115.503 -166.593 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 52.6 t -135.65 117.9 21.43 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 C-N-CA 123.684 0.794 . . . . 0.0 111.937 -175.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 37.8 t -160.54 -72.69 0.07 Allowed 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 123.931 0.892 . . . . 0.0 112.618 176.605 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 25.5 m -73.0 -21.63 60.8 Favored 'General case' 0 N--CA 1.48 1.058 0 N-CA-C 113.806 1.039 . . . . 0.0 113.806 -176.422 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -132.61 136.62 46.64 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 125.957 1.703 . . . . 0.0 110.109 168.257 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -147.47 100.83 3.3 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.791 1.636 . . . . 0.0 108.463 175.814 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -137.59 149.91 47.03 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.757 1.223 . . . . 0.0 112.15 179.569 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 67.4 mttm . . . . . 0 N--CA 1.475 0.812 0 C-N-CA 125.694 1.598 . . . . 0.0 109.732 175.52 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 10.4 tpt . . . . . 0 CA--C 1.543 0.707 0 CA-C-O 121.039 0.447 . . . . 0.0 110.852 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 48.2 m-20 -95.84 148.87 35.24 Favored Pre-proline 0 CA--C 1.549 0.911 0 C-N-CA 124.329 1.051 . . . . 0.0 113.097 -179.745 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 65.4 Cg_endo -84.39 -5.97 10.1 Favored 'Trans proline' 0 C--N 1.351 0.703 0 C-N-CA 123.872 3.048 . . . . 0.0 114.516 174.58 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 97.8 mt -97.72 44.66 1.04 Allowed 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.153 1.381 . . . . 0.0 113.437 -172.414 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -111.33 -1.67 15.94 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 124.729 1.212 . . . . 0.0 114.235 171.298 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.67 -56.21 1.14 Allowed 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 124.489 1.116 . . . . 0.0 113.191 -165.211 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.7 pp -110.74 10.04 8.67 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.784 0 C-N-CA 125.848 1.659 . . . . 0.0 112.914 -178.134 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 13.3 tt -50.32 133.73 10.24 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 C-N-CA 124.189 0.996 . . . . 0.0 112.392 176.424 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 6.5 t30 -140.17 12.39 2.4 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 124.99 1.316 . . . . 0.0 113.195 -176.732 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -79.57 10.17 4.2 Favored 'General case' 0 CA--C 1.546 0.805 0 N-CA-C 115.029 1.492 . . . . 0.0 115.029 -169.468 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 13.9 tt -139.68 20.57 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 C-N-CA 127.247 2.219 . . . . 0.0 112.579 176.672 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 1.5 tmtp? . . . . . 0 N--CA 1.472 0.65 0 C-N-CA 124.367 1.067 . . . . 0.0 113.603 -176.112 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 2.1 mt . . . . . 0 CA--C 1.543 0.71 0 N-CA-C 110.085 -0.339 . . . . 0.0 110.085 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 15.5 m -72.18 166.66 21.93 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.397 0.679 . . . . 0.0 111.707 176.257 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -57.04 -36.44 70.49 Favored 'General case' 0 N--CA 1.477 0.887 0 N-CA-C 113.951 1.093 . . . . 0.0 113.951 -172.697 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 11.3 tt0 -87.23 -40.9 14.13 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 123.857 0.863 . . . . 0.0 112.253 173.7 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 24.7 mm-40 -53.75 -44.3 69.86 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 124.322 1.049 . . . . 0.0 111.475 176.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 13.7 ptmt -66.0 -32.67 74.29 Favored 'General case' 0 N--CA 1.469 0.507 0 O-C-N 121.561 -0.712 . . . . 0.0 111.926 -179.262 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 49.3 mt -72.82 -43.71 59.93 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 CA-C-N 119.124 0.874 . . . . 0.0 110.864 175.907 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 50.2 mt -60.47 -43.36 94.03 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.978 0 CA-C-N 119.706 1.139 . . . . 0.0 110.362 176.737 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -61.6 -48.54 80.47 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 124.966 1.306 . . . . 0.0 110.958 175.278 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -67.47 -48.84 65.99 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 124.081 0.952 . . . . 0.0 113.033 -178.218 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -61.79 -23.68 66.36 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.707 0.803 . . . . 0.0 113.061 -179.032 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -73.09 -58.72 3.11 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 123.971 0.909 . . . . 0.0 111.141 174.564 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 67.6 mt -57.96 -35.41 51.88 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 C-N-CA 126.869 2.068 . . . . 0.0 111.476 176.267 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -70.21 -22.56 62.91 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 124.256 1.022 . . . . 0.0 113.317 176.644 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -93.72 -31.86 14.26 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.689 1.196 . . . . 0.0 112.719 178.22 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 6.3 m -121.72 -20.65 4.01 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 N-CA-C 113.971 1.101 . . . . 0.0 113.971 -172.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 84.42 142.89 5.69 Favored Glycine 0 CA--C 1.531 1.059 0 C-N-CA 125.047 1.308 . . . . 0.0 112.24 -171.341 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -67.22 -5.89 15.81 Favored 'General case' 0 N--CA 1.479 0.999 0 CA-C-O 122.688 1.232 . . . . 0.0 114.24 -171.207 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 38.8 mt-30 -90.3 -16.25 29.63 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 126.476 1.91 . . . . 0.0 112.753 176.512 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 58.5 m-80 -111.06 -6.03 14.7 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.831 1.252 . . . . 0.0 114.119 -176.336 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 15.5 pt -73.3 161.26 4.97 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 C-N-CA 124.07 0.948 . . . . 0.0 111.42 166.189 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.1 p -131.75 145.49 51.64 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 125.162 1.385 . . . . 0.0 110.495 175.953 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -61.65 -29.88 70.35 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 123.976 0.91 . . . . 0.0 111.844 177.748 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -63.0 -49.07 85.02 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.499 0 C-N-CA 125.316 1.446 . . . . 0.0 109.977 175.261 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 58.5 m -78.48 -42.98 28.2 Favored 'General case' 0 C--O 1.222 -0.357 0 C-N-CA 123.711 0.804 . . . . 0.0 109.854 -175.275 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 20.2 tp -61.5 -36.43 80.5 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.435 1.094 . . . . 0.0 112.17 174.874 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.476 ' HA ' HG13 ' A' ' 66' ' ' ILE . 38.4 t -54.03 -30.72 48.85 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 124.765 1.226 . . . . 0.0 112.725 169.041 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -102.21 -23.98 13.96 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.435 1.494 . . . . 0.0 114.373 -174.724 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 69.9 mmtt -61.5 -39.4 90.84 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 124.582 1.153 . . . . 0.0 110.993 170.429 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 9.2 mt -115.03 4.34 14.68 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 126.666 1.986 . . . . 0.0 113.209 -166.665 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . 0.292 7.4 p30 46.29 57.95 4.92 Favored 'General case' 0 CA--C 1.55 0.943 0 C-N-CA 126.803 2.041 . . . . 0.0 114.085 -175.266 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.476 HG13 ' HA ' ' A' ' 61' ' ' SER . 0.9 OUTLIER -120.83 -168.23 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 C-N-CA 127.386 2.274 . . . . 0.0 111.359 -175.756 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -88.68 156.88 18.75 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.131 0.972 . . . . 0.0 110.867 169.5 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 87.6 t -62.6 -31.58 52.53 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 123.209 0.604 . . . . 0.0 111.345 173.27 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 10.7 mp0 -79.53 -34.41 41.12 Favored 'General case' 0 CA--C 1.532 0.27 0 O-C-N 120.744 -1.222 . . . . 0.0 110.037 -178.317 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 12.2 tmtt? -68.67 -41.82 78.74 Favored 'General case' 0 C--N 1.343 0.304 0 C-N-CA 123.375 0.67 . . . . 0.0 111.306 177.239 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -58.71 -43.53 90.12 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.39 1.476 . . . . 0.0 112.661 169.188 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 37.6 ttpt -69.26 -27.52 65.51 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 125.004 1.322 . . . . 0.0 111.951 -179.346 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -61.47 -34.36 75.32 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 123.321 0.648 . . . . 0.0 112.462 177.661 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 55.9 m-85 -67.18 -45.71 76.13 Favored 'General case' 0 N--CA 1.466 0.348 0 C-N-CA 124.369 1.067 . . . . 0.0 110.528 171.057 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 73.9 mt -65.17 -24.84 36.04 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.834 0 O-C-N 121.135 -0.978 . . . . 0.0 111.675 -179.859 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.42 ' HA ' ' HE3' ' A' ' 76' ' ' LYS . 0.0 OUTLIER -81.78 -37.51 27.04 Favored 'General case' 0 N--CA 1.472 0.655 0 O-C-N 120.248 -1.533 . . . . 0.0 113.291 175.983 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 3.7 p30 . . . . . 0 N--CA 1.467 0.401 0 CA-C-N 119.807 1.185 . . . . 0.0 112.509 -176.776 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 . . . . . 0 CA--C 1.543 0.697 0 N-CA-C 112.726 0.639 . . . . 0.0 112.726 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -99.4 105.56 17.53 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 124.595 1.158 . . . . 0.0 110.493 177.397 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 57.3 t -133.9 100.62 3.42 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.574 0 C-N-CA 125.199 1.4 . . . . 0.0 109.526 174.134 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 43.1 t -166.54 -73.1 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.428 1.091 . . . . 0.0 111.834 171.779 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 18.1 t -84.94 -32.69 22.94 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 124.095 0.958 . . . . 0.0 112.838 -176.502 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -126.06 125.46 42.65 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 125.836 1.654 . . . . 0.0 110.274 175.807 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -152.64 105.91 3.03 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 125.653 1.581 . . . . 0.0 108.254 173.47 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -144.78 -41.49 0.25 Allowed 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 116.009 1.855 . . . . 0.0 116.009 179.388 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 46.8 mmtm . . . . . 0 N--CA 1.484 1.249 0 C-N-CA 126.611 1.964 . . . . 0.0 113.204 -173.443 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.473 0.678 0 CA-C-O 120.731 0.3 . . . . 0.0 110.635 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 58.7 m-20 38.11 55.61 4.47 Favored Pre-proline 0 CA--C 1.555 1.154 0 C-N-CA 127.721 2.409 . . . . 0.0 115.183 -177.711 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_endo -80.42 -7.5 13.82 Favored 'Trans proline' 0 C--N 1.351 0.683 0 C-N-CA 123.034 2.489 . . . . 0.0 114.907 -170.53 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -133.65 23.62 3.99 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 125.307 1.443 . . . . 0.0 114.594 -173.633 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -111.27 0.3 16.67 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 114.59 1.33 . . . . 0.0 114.59 -168.92 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -136.69 -30.13 0.91 Allowed 'General case' 0 N--CA 1.477 0.886 0 N-CA-C 116.442 2.016 . . . . 0.0 116.442 -164.726 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.2 pp -136.93 11.78 0.83 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.29 0 C-N-CA 125.427 1.491 . . . . 0.0 113.848 -177.833 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 19.0 tt -45.89 107.39 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.926 0 C-N-CA 126.246 1.818 . . . . 0.0 114.654 -163.596 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 21.7 t-20 -161.58 104.48 1.23 Allowed 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 125.683 1.593 . . . . 0.0 110.537 175.793 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -149.4 9.56 0.74 Allowed 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 114.477 1.288 . . . . 0.0 114.477 175.786 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 12.7 tt -151.06 27.65 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.164 0 C-N-CA 124.548 1.139 . . . . 0.0 113.83 -169.827 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 58.1 tttp . . . . . 0 N--CA 1.473 0.715 0 C-N-CA 124.353 1.061 . . . . 0.0 113.362 -177.467 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.2 mp . . . . . 0 CA--C 1.544 0.715 0 CA-C-O 120.689 0.281 . . . . 0.0 110.909 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 19.3 t -70.04 165.4 21.95 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 122.781 0.432 . . . . 0.0 110.472 170.547 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -56.45 -46.09 80.5 Favored 'General case' 0 N--CA 1.476 0.84 0 O-C-N 120.388 -1.445 . . . . 0.0 112.933 -173.188 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 9.2 tt0 -72.93 -43.0 62.9 Favored 'General case' 0 CA--C 1.539 0.523 0 O-C-N 121.41 -0.806 . . . . 0.0 111.418 177.686 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 36.7 mm-40 -55.1 -44.44 74.94 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.659 1.184 . . . . 0.0 111.233 175.664 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 42.0 ttmt -62.95 -44.0 97.26 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 125.171 1.388 . . . . 0.0 111.58 177.53 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 54.0 mt -65.95 -41.97 90.9 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 CA-C-N 119.12 0.873 . . . . 0.0 111.134 178.031 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 37.9 mt -66.67 -42.26 89.38 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.885 0 CA-C-N 120.291 1.405 . . . . 0.0 110.512 179.001 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -60.11 -47.26 86.64 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.033 0.933 . . . . 0.0 110.898 175.614 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -68.01 -49.85 59.08 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 124.819 1.248 . . . . 0.0 112.217 -179.931 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -64.27 -23.49 67.32 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 119.209 0.913 . . . . 0.0 112.976 -176.953 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -71.31 -59.68 2.64 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.388 1.075 . . . . 0.0 110.792 173.226 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 62.9 mt -62.5 -34.68 66.09 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.256 0 C-N-CA 127.417 2.287 . . . . 0.0 111.953 -179.625 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -68.58 -33.46 74.1 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 123.784 0.834 . . . . 0.0 111.989 176.933 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -85.36 -38.18 19.04 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.696 0.799 . . . . 0.0 112.3 179.068 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.0 m -108.39 -5.45 10.68 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.126 0 N-CA-C 114.013 1.116 . . . . 0.0 114.013 -173.909 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 87.79 24.63 34.83 Favored Glycine 0 N--CA 1.472 1.09 0 C-N-CA 125.047 1.308 . . . . 0.0 115.73 159.639 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 56.23 10.67 0.66 Allowed 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 127.146 2.178 . . . . 0.0 114.848 -174.014 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 5.2 pt20 -124.87 -5.91 7.41 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 125.564 1.546 . . . . 0.0 113.573 -169.873 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 59.4 m-80 -121.38 2.33 10.24 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.34 1.456 . . . . 0.0 112.577 173.294 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 23.2 pt -74.97 154.19 6.44 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.583 0 C-N-CA 123.048 0.539 . . . . 0.0 111.147 173.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -136.77 142.58 42.99 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 124.972 1.309 . . . . 0.0 109.177 177.465 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -61.57 -26.88 68.24 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 118.958 0.799 . . . . 0.0 112.494 -179.766 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -65.36 -47.69 86.06 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.559 0 C-N-CA 125.313 1.445 . . . . 0.0 109.989 174.3 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 72.5 m -77.75 -43.11 31.84 Favored 'General case' 0 C--O 1.221 -0.402 0 N-CA-C 109.411 -0.589 . . . . 0.0 109.411 -176.814 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 16.5 tp -60.71 -37.55 82.07 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 125.105 1.362 . . . . 0.0 112.155 175.143 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.458 ' HA ' HG13 ' A' ' 66' ' ' ILE . 24.3 p -63.11 -20.39 65.32 Favored 'General case' 0 N--CA 1.475 0.797 0 N-CA-C 113.567 0.951 . . . . 0.0 113.567 172.095 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 24.0 mtpp -106.89 -23.36 12.39 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 126.108 1.763 . . . . 0.0 114.474 -176.127 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 65.7 mmtt -66.48 -35.27 79.86 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 125.33 1.452 . . . . 0.0 111.125 170.381 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 14.3 mt -117.65 1.47 12.22 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 126.917 2.087 . . . . 0.0 113.099 -168.621 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 18.6 t30 55.08 61.99 2.7 Favored 'General case' 0 CA--C 1.553 1.066 0 C-N-CA 124.701 1.2 . . . . 0.0 112.296 176.655 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.458 HG13 ' HA ' ' A' ' 61' ' ' SER . 0.6 OUTLIER -137.91 178.08 4.81 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.782 0 C-N-CA 127.304 2.241 . . . . 0.0 111.302 -171.378 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 2.6 p -78.09 157.55 29.47 Favored 'General case' 0 N--CA 1.48 1.045 0 O-C-N 120.98 -1.075 . . . . 0.0 111.447 171.806 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 99.3 t -63.38 -29.67 47.84 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 C-N-CA 123.264 0.626 . . . . 0.0 111.365 173.54 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -78.89 -38.72 36.86 Favored 'General case' 0 N--CA 1.468 0.452 0 O-C-N 120.988 -1.07 . . . . 0.0 110.078 -177.794 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 4.1 tmtm? -66.27 -44.91 82.29 Favored 'General case' 0 C--N 1.339 0.137 0 C-N-CA 124.808 1.243 . . . . 0.0 110.856 176.399 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -59.21 -48.8 80.28 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 124.863 1.265 . . . . 0.0 112.738 171.195 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 36.6 ttmt -69.32 -27.42 65.36 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 124.403 1.081 . . . . 0.0 111.4 -175.225 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -53.01 -43.83 66.82 Favored 'General case' 0 CA--C 1.543 0.705 0 CA-C-N 118.154 0.434 . . . . 0.0 111.459 174.227 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 24.8 m-85 -63.05 -42.0 99.61 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 123.432 0.693 . . . . 0.0 111.458 177.944 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 13.7 mt -66.59 -26.26 37.0 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.651 0 C-N-CA 124.477 1.111 . . . . 0.0 110.996 177.859 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 68.9 mmtt -83.33 -25.63 31.3 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 125.774 1.629 . . . . 0.0 114.711 178.249 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 25.7 p30 . . . . . 0 N--CA 1.475 0.823 0 CA-C-N 120.131 1.332 . . . . 0.0 113.513 -178.521 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 . . . . . 0 N--CA 1.474 0.739 0 N-CA-C 112.976 0.732 . . . . 0.0 112.976 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -134.01 110.29 9.56 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 125.115 1.366 . . . . 0.0 110.354 174.275 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 48.6 t -141.69 127.24 18.32 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 C-N-CA 125.038 1.335 . . . . 0.0 110.229 178.291 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 9.7 t -98.94 83.38 2.9 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 124.792 1.237 . . . . 0.0 111.355 175.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 49.2 m 48.87 73.65 0.22 Allowed 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 126.456 1.902 . . . . 0.0 114.569 173.918 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 20.4 mmt 56.35 56.19 5.96 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 125.244 1.417 . . . . 0.0 112.296 -173.066 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 75.0 tt0 -72.42 96.3 1.88 Allowed 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 125.558 1.543 . . . . 0.0 110.284 174.106 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -139.49 159.47 42.1 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 125.309 1.444 . . . . 0.0 112.382 -174.838 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 14.0 mmmm . . . . . 0 N--CA 1.475 0.791 0 C-N-CA 125.65 1.58 . . . . 0.0 110.826 -177.446 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 76.6 mtm . . . . . 0 N--CA 1.47 0.565 0 CA-C-O 120.555 0.217 . . . . 0.0 110.535 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -147.12 136.47 11.64 Favored Pre-proline 0 CA--C 1.552 1.032 0 C-N-CA 124.897 1.279 . . . . 0.0 111.838 -176.596 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -81.49 -7.91 12.66 Favored 'Trans proline' 0 C--N 1.352 0.714 0 C-N-CA 123.388 2.725 . . . . 0.0 115.688 -177.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 83.3 mt -102.2 39.21 1.52 Allowed 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.303 1.441 . . . . 0.0 113.276 -173.994 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 12.6 m-20 -101.93 -3.16 28.29 Favored 'General case' 0 N--CA 1.478 0.962 0 N-CA-C 114.705 1.372 . . . . 0.0 114.705 168.335 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.74 -58.61 1.23 Allowed 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 124.297 1.039 . . . . 0.0 113.445 -164.82 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.8 pp -107.33 9.1 9.42 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 C-N-CA 125.495 1.518 . . . . 0.0 112.906 -177.748 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 10.5 tt -52.42 126.44 8.15 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.727 0 C-N-CA 123.825 0.85 . . . . 0.0 112.13 177.151 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -146.93 -1.25 0.68 Allowed 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 124.386 1.075 . . . . 0.0 113.497 -178.279 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -88.63 12.41 14.78 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 114.818 1.414 . . . . 0.0 114.818 -162.297 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 7.1 tp -143.89 21.95 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 125.62 1.568 . . . . 0.0 113.891 -171.337 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 29.4 mtpp . . . . . 0 N--CA 1.479 1.005 0 N-CA-C 115.396 1.628 . . . . 0.0 115.396 -179.974 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 5.2 mt . . . . . 0 CA--C 1.543 0.694 0 N-CA-C 110.397 -0.223 . . . . 0.0 110.397 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 19.8 t -71.77 166.96 20.93 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 122.759 0.424 . . . . 0.0 110.388 167.271 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -57.0 -45.88 82.71 Favored 'General case' 0 N--CA 1.475 0.796 0 O-C-N 120.571 -1.331 . . . . 0.0 112.589 -175.213 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 10.2 tt0 -72.51 -42.42 64.83 Favored 'General case' 0 N--CA 1.469 0.517 0 O-C-N 121.528 -0.732 . . . . 0.0 111.341 177.416 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 34.7 mm-40 -57.03 -43.11 81.57 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 124.082 0.953 . . . . 0.0 111.109 176.782 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 21.8 ttmm -61.65 -43.0 99.68 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.626 1.17 . . . . 0.0 111.288 177.12 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 49.7 mt -67.37 -40.4 84.65 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 CA-C-O 118.197 -0.906 . . . . 0.0 111.097 177.601 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 35.0 mt -65.46 -44.19 94.33 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.956 0 CA-C-N 120.652 1.569 . . . . 0.0 110.721 177.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -56.56 -48.35 77.54 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.27 1.028 . . . . 0.0 110.544 174.589 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -66.97 -51.9 49.42 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.454 1.101 . . . . 0.0 112.926 -179.7 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -59.12 -27.26 65.44 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 119.25 0.932 . . . . 0.0 113.118 179.849 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -70.95 -58.74 3.28 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 123.415 0.686 . . . . 0.0 111.26 176.469 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 55.5 mt -59.24 -34.54 54.12 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.61 0 C-N-CA 126.26 1.824 . . . . 0.0 111.314 176.481 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -70.19 -22.44 62.94 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 124.209 1.003 . . . . 0.0 113.256 176.146 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -96.14 -29.91 13.81 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.591 1.157 . . . . 0.0 113.097 178.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 7.8 m -121.96 -19.13 4.57 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.002 0 N-CA-C 114.121 1.156 . . . . 0.0 114.121 -175.487 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 82.36 142.06 4.04 Favored Glycine 0 CA--C 1.532 1.146 0 C-N-CA 124.77 1.176 . . . . 0.0 112.199 -171.171 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -65.76 -12.1 51.19 Favored 'General case' 0 N--CA 1.479 0.99 0 O-C-N 121.059 -1.259 . . . . 0.0 113.898 -171.709 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 35.9 mt-30 -77.68 -16.85 58.22 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 126.257 1.823 . . . . 0.0 112.969 174.94 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 67.0 m-80 -114.37 -6.5 12.92 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 114.642 1.349 . . . . 0.0 114.642 -173.058 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 13.8 pt -74.93 159.63 5.45 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.656 0 C-N-CA 124.09 0.956 . . . . 0.0 111.869 170.097 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.4 p -135.16 145.07 47.43 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 125.248 1.419 . . . . 0.0 110.142 175.284 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -60.47 -30.2 69.53 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 124.044 0.938 . . . . 0.0 112.176 179.041 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -61.95 -42.32 94.31 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.513 0 C-N-CA 125.352 1.461 . . . . 0.0 110.264 175.105 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 86.8 m -88.1 -40.84 13.47 Favored 'General case' 0 C--O 1.223 -0.336 0 C-N-CA 125.152 1.381 . . . . 0.0 109.699 -172.351 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 24.7 tp -60.57 -36.97 79.79 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.915 1.286 . . . . 0.0 111.543 170.994 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.501 ' HA ' HG13 ' A' ' 66' ' ' ILE . 40.8 t -53.99 -34.09 58.85 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 124.865 1.266 . . . . 0.0 113.154 168.927 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -97.52 -27.05 14.6 Favored 'General case' 0 C--N 1.329 -0.326 0 C-N-CA 124.578 1.151 . . . . 0.0 113.743 -174.205 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 19.8 mttp -69.36 -33.4 73.02 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 124.219 1.007 . . . . 0.0 112.448 174.374 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 4.5 mp -108.02 -0.85 21.0 Favored 'General case' 0 CA--C 1.541 0.596 0 N-CA-C 114.385 1.254 . . . . 0.0 114.385 -178.641 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 33.8 m-80 54.92 43.91 29.16 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 125.336 1.455 . . . . 0.0 112.587 -173.58 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.501 HG13 ' HA ' ' A' ' 61' ' ' SER . 9.9 pt -103.16 -171.89 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.674 0 C-N-CA 126.218 1.807 . . . . 0.0 111.246 -178.644 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 43.9 p -85.62 159.44 19.85 Favored 'General case' 0 N--CA 1.471 0.625 0 O-C-N 121.473 -0.767 . . . . 0.0 111.057 165.711 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 58.0 t -60.6 -27.31 40.18 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.978 0 O-C-N 121.407 -0.808 . . . . 0.0 111.398 169.943 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 4.9 tm-20 -80.57 -40.78 25.23 Favored 'General case' 0 CA--C 1.531 0.249 0 O-C-N 120.609 -1.307 . . . . 0.0 110.168 -173.86 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . 0.367 0.0 OUTLIER -86.94 7.79 25.94 Favored 'General case' 0 C--N 1.348 0.502 0 N-CA-C 113.175 0.806 . . . . 0.0 113.175 173.589 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -94.61 -45.12 7.52 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.827 1.251 . . . . 0.0 111.557 158.071 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt -74.47 -27.86 60.77 Favored 'General case' 0 CA--C 1.519 -0.234 0 C-N-CA 124.86 1.264 . . . . 0.0 111.84 -172.927 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 31.2 p-10 -56.21 -37.85 70.21 Favored 'General case' 0 CA--C 1.545 0.765 0 N-CA-C 112.906 0.706 . . . . 0.0 112.906 175.813 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 28.7 m-85 -65.86 -48.97 69.79 Favored 'General case' 0 C--O 1.222 -0.372 0 C-N-CA 126.791 2.036 . . . . 0.0 109.889 176.449 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 76.7 mt -64.2 -38.72 83.23 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 C-N-CA 123.859 0.864 . . . . 0.0 110.374 -179.619 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 28.4 mmtm -63.41 -31.41 72.55 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 125.668 1.587 . . . . 0.0 113.448 177.509 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 8.9 p30 . . . . . 0 CA--C 1.539 0.553 0 CA-C-N 119.817 1.19 . . . . 0.0 112.463 174.98 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 . . . . . 0 N--CA 1.48 1.026 0 N-CA-C 113.722 1.008 . . . . 0.0 113.722 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -103.51 53.05 0.76 Allowed 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 125.648 1.579 . . . . 0.0 113.084 -169.19 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 59.5 t -139.1 140.72 37.72 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 C-N-CA 125.502 1.521 . . . . 0.0 110.491 -179.825 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 21.9 t -130.41 -62.8 0.91 Allowed 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 124.461 1.104 . . . . 0.0 113.157 178.185 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 75.0 m -138.7 102.28 4.54 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 124.5 1.12 . . . . 0.0 111.429 -176.764 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 69.4 mtm 51.37 31.06 6.7 Favored 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 125.869 1.668 . . . . 0.0 113.933 -177.457 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -96.69 -2.29 44.84 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.242 1.417 . . . . 0.0 113.244 -168.093 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -75.27 160.12 30.72 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.246 1.419 . . . . 0.0 112.893 178.758 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 44.7 mmtm . . . . . 0 N--CA 1.475 0.805 0 C-N-CA 125.171 1.388 . . . . 0.0 110.431 173.314 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 62.7 mtt . . . . . 0 N--CA 1.473 0.676 0 N-CA-C 110.111 -0.329 . . . . 0.0 110.111 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -132.91 57.4 27.92 Favored Pre-proline 0 CA--C 1.555 1.169 0 C-N-CA 124.54 1.136 . . . . 0.0 113.432 -174.909 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_endo -78.12 -4.92 14.78 Favored 'Trans proline' 0 C--N 1.353 0.803 0 C-N-CA 123.391 2.727 . . . . 0.0 115.285 -176.105 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -132.77 35.68 3.56 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.839 1.656 . . . . 0.0 114.018 -175.022 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -104.6 -1.21 26.76 Favored 'General case' 0 N--CA 1.478 0.945 0 N-CA-C 114.547 1.314 . . . . 0.0 114.547 176.302 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -130.07 -58.56 1.07 Allowed 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 124.369 1.068 . . . . 0.0 113.515 -164.124 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.8 pp -107.77 10.2 9.17 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.786 0 C-N-CA 125.631 1.572 . . . . 0.0 113.033 -178.07 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 17.7 tt -47.97 125.5 2.32 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 C-N-CA 124.775 1.23 . . . . 0.0 113.18 179.507 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 21.3 t30 -147.43 0.34 0.68 Allowed 'General case' 0 CA--C 1.543 0.693 0 N-CA-C 114.511 1.3 . . . . 0.0 114.511 -179.788 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -85.31 10.85 11.43 Favored 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 115.02 1.489 . . . . 0.0 115.02 -167.792 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 16.0 tt -144.19 34.59 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 C-N-CA 126.543 1.937 . . . . 0.0 112.049 -177.612 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 33.3 ttmt . . . . . 0 N--CA 1.471 0.578 0 N-CA-C 114.522 1.304 . . . . 0.0 114.522 -173.817 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 5.9 mt . . . . . 0 CA--C 1.542 0.643 0 CA-C-O 120.725 0.298 . . . . 0.0 111.607 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 22.7 t -72.16 166.28 22.67 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 123.31 0.644 . . . . 0.0 110.545 167.074 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -55.57 -43.71 76.19 Favored 'General case' 0 N--CA 1.476 0.831 0 O-C-N 120.83 -1.169 . . . . 0.0 112.495 -177.809 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 13.1 tt0 -73.49 -41.76 62.71 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 123.561 0.744 . . . . 0.0 111.315 176.22 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 84.4 mt-30 -63.07 -38.35 90.84 Favored 'General case' 0 N--CA 1.466 0.335 0 O-C-N 121.698 -0.626 . . . . 0.0 111.94 179.58 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 20.9 ttmm -59.3 -42.19 90.74 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 123.975 0.91 . . . . 0.0 110.748 174.171 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 46.2 mt -69.61 -42.12 80.45 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 CA-C-O 118.036 -0.983 . . . . 0.0 111.361 178.129 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 40.4 mt -64.47 -43.84 96.95 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 CA-C-N 120.644 1.565 . . . . 0.0 110.174 177.997 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -57.98 -47.51 82.76 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.886 1.275 . . . . 0.0 110.336 177.281 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -67.22 -52.19 44.14 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.645 1.178 . . . . 0.0 113.429 177.574 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.7 mm-40 -61.18 -26.42 67.7 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-N 119.1 0.864 . . . . 0.0 113.101 -177.947 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.476 ' CE2' HG22 ' A' ' 55' ' ' ILE . 1.6 t80 -71.93 -55.71 6.99 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 123.981 0.912 . . . . 0.0 111.21 175.492 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 55.8 mt -58.5 -35.82 56.31 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.589 0 C-N-CA 125.387 1.475 . . . . 0.0 111.168 174.436 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -68.02 -20.78 65.03 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 124.104 0.962 . . . . 0.0 113.326 177.078 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -96.33 -28.15 14.62 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.812 1.245 . . . . 0.0 113.231 178.437 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 9.2 m -126.36 -21.61 2.16 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 N-CA-C 114.376 1.25 . . . . 0.0 114.376 -174.038 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 88.84 141.69 8.17 Favored Glycine 0 CA--C 1.534 1.242 0 C-N-CA 125.633 1.587 . . . . 0.0 112.788 -172.205 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 62.5 tp -60.74 -16.58 41.45 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 125.497 1.519 . . . . 0.0 114.561 -175.395 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -82.83 -18.68 39.56 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.763 1.625 . . . . 0.0 113.079 177.095 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 63.6 m-20 -114.58 -7.69 12.77 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 114.651 1.352 . . . . 0.0 114.651 -170.066 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . 0.476 HG22 ' CE2' ' A' ' 46' ' ' TYR . 26.6 pt -67.32 158.52 5.41 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.42 0 C-N-CA 123.675 0.79 . . . . 0.0 111.265 167.099 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -126.01 146.22 49.98 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 125.086 1.354 . . . . 0.0 111.444 174.916 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -61.68 -27.46 68.7 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.025 0.93 . . . . 0.0 111.975 172.927 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 29.9 mm -63.85 -52.58 55.09 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.444 0 C-N-CA 124.797 1.239 . . . . 0.0 110.567 174.556 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 54.1 m -75.18 -39.33 60.32 Favored 'General case' 0 C--O 1.223 -0.334 0 C-N-CA 123.264 0.625 . . . . 0.0 110.088 -177.749 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 18.1 tp -63.18 -37.04 85.66 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.437 1.095 . . . . 0.0 111.854 175.402 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.444 ' HA ' HG13 ' A' ' 66' ' ' ILE . 44.1 t -53.87 -32.57 53.64 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.951 1.3 . . . . 0.0 112.25 169.411 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -96.98 -31.89 12.3 Favored 'General case' 0 CA--C 1.534 0.351 0 N-CA-C 113.881 1.067 . . . . 0.0 113.881 -176.015 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 47.6 mmtt -60.17 -39.54 86.79 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 125.703 1.601 . . . . 0.0 111.839 178.407 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.3 mp -114.07 15.7 18.3 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 124.753 1.221 . . . . 0.0 113.631 -177.374 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . 0.278 7.5 p30 46.56 55.5 7.52 Favored 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 126.536 1.934 . . . . 0.0 114.037 -177.706 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.444 HG13 ' HA ' ' A' ' 61' ' ' SER . 1.8 pt -119.4 -165.5 0.37 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.761 0 C-N-CA 127.156 2.182 . . . . 0.0 110.958 -174.249 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 5.7 p -98.64 160.38 14.31 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 124.661 1.184 . . . . 0.0 110.901 171.583 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 71.4 t -62.72 -29.66 47.53 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 C-N-CA 123.085 0.554 . . . . 0.0 110.952 173.68 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 58.4 mp0 -77.28 -39.91 46.41 Favored 'General case' 0 CA--C 1.53 0.195 0 O-C-N 121.017 -1.052 . . . . 0.0 109.928 -178.685 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 10.8 tmtt? -66.92 -44.38 80.83 Favored 'General case' 0 C--N 1.341 0.236 0 C-N-CA 124.952 1.301 . . . . 0.0 110.941 178.866 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -58.98 -50.24 74.84 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 126.064 1.746 . . . . 0.0 113.357 170.204 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 21.2 ttmm -69.01 -25.33 64.44 Favored 'General case' 0 N--CA 1.468 0.46 0 O-C-N 120.839 -1.163 . . . . 0.0 111.327 -177.333 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -59.04 -31.7 69.08 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 123.529 0.731 . . . . 0.0 112.608 174.065 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 58.6 m-85 -69.78 -50.21 45.42 Favored 'General case' 0 C--O 1.221 -0.438 0 C-N-CA 124.527 1.131 . . . . 0.0 110.538 170.199 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 84.5 mt -64.15 -25.24 37.61 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.839 0 C-N-CA 124.201 1.0 . . . . 0.0 111.73 -175.589 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 69.0 mmtt -81.54 -25.36 35.94 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 125.461 1.504 . . . . 0.0 114.408 177.741 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 8.6 p30 . . . . . 0 N--CA 1.47 0.55 0 CA-C-N 119.994 1.27 . . . . 0.0 111.958 170.136 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 . . . . . 0 N--CA 1.477 0.893 0 CA-C-O 121.611 0.72 . . . . 0.0 111.852 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -145.91 115.96 7.39 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.463 1.105 . . . . 0.0 110.888 179.449 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 59.9 t -141.12 132.02 27.47 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 C-N-CA 125.199 1.4 . . . . 0.0 110.55 179.027 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 55.1 m -96.77 -50.39 4.69 Favored 'General case' 0 N--CA 1.48 1.06 0 N-CA-C 113.463 0.912 . . . . 0.0 113.463 179.732 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 35.8 t -159.73 -50.38 0.05 Allowed 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 124.708 1.203 . . . . 0.0 112.332 179.982 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 6.0 tpt -121.09 15.74 11.55 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 125.165 1.386 . . . . 0.0 113.068 -174.3 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -83.31 48.75 1.44 Allowed 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 124.867 1.267 . . . . 0.0 112.4 -174.254 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -142.41 155.02 45.08 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.737 1.615 . . . . 0.0 112.268 -175.813 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 4.7 mmpt? . . . . . 0 N--CA 1.474 0.77 0 C-N-CA 124.542 1.137 . . . . 0.0 111.934 178.911 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.7 mpt? . . . . . 0 N--CA 1.469 0.484 0 N-CA-C 110.068 -0.345 . . . . 0.0 110.068 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 44.1 m-20 43.9 63.27 8.42 Favored Pre-proline 0 CA--C 1.555 1.162 0 C-N-CA 126.5 1.92 . . . . 0.0 114.778 176.798 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_endo -72.6 -1.78 10.82 Favored 'Trans proline' 0 C--N 1.351 0.664 0 C-N-CA 123.762 2.975 . . . . 0.0 115.266 -175.714 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 88.7 mt -106.82 38.94 1.96 Allowed 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.902 1.681 . . . . 0.0 112.671 -178.983 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -110.53 1.48 18.19 Favored 'General case' 0 N--CA 1.478 0.959 0 N-CA-C 114.574 1.324 . . . . 0.0 114.574 178.589 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.23 -56.74 1.89 Allowed 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 124.632 1.173 . . . . 0.0 113.269 -165.851 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.0 pp -129.13 13.86 2.66 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.862 0 C-N-CA 126.163 1.785 . . . . 0.0 112.9 -173.523 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 10.7 tt -41.77 126.44 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.02 0 C-N-CA 125.423 1.489 . . . . 0.0 113.402 179.322 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -145.0 16.84 1.57 Allowed 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.816 1.247 . . . . 0.0 112.942 179.981 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -82.95 11.21 6.42 Favored 'General case' 0 CA--C 1.545 0.771 0 N-CA-C 114.534 1.309 . . . . 0.0 114.534 -171.737 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 14.0 tt -141.46 24.38 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 126.473 1.909 . . . . 0.0 113.145 -176.503 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 88.9 tttt . . . . . 0 N--CA 1.473 0.686 0 C-N-CA 124.285 1.034 . . . . 0.0 113.567 179.043 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.5 mt . . . . . 0 CA--C 1.544 0.741 0 N-CA-C 110.497 -0.186 . . . . 0.0 110.497 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 19.0 t -72.1 168.33 18.37 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.088 0.555 . . . . 0.0 110.406 167.298 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -58.65 -45.62 88.92 Favored 'General case' 0 N--CA 1.473 0.695 0 O-C-N 120.25 -1.531 . . . . 0.0 112.607 -174.577 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 9.9 tt0 -71.78 -41.87 67.82 Favored 'General case' 0 N--CA 1.47 0.558 0 O-C-N 121.195 -0.941 . . . . 0.0 111.367 177.344 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 30.6 mm-40 -57.04 -45.32 83.27 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 123.959 0.903 . . . . 0.0 110.72 175.873 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt -60.75 -41.56 95.65 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 124.726 1.21 . . . . 0.0 111.3 178.277 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 51.5 mt -67.54 -41.85 86.26 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 CA-C-O 117.937 -1.03 . . . . 0.0 111.447 177.177 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 36.5 mt -63.8 -44.42 98.21 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 CA-C-N 120.832 1.651 . . . . 0.0 110.072 177.969 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -59.42 -49.21 78.69 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.711 1.204 . . . . 0.0 111.024 177.745 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -64.36 -52.18 59.64 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 124.982 1.313 . . . . 0.0 112.456 177.674 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -60.75 -27.44 67.95 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-N 119.362 0.983 . . . . 0.0 113.027 -179.572 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -69.05 -58.34 4.23 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 123.433 0.693 . . . . 0.0 110.784 174.962 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 90.8 mt -63.71 -32.68 57.85 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.471 0 C-N-CA 127.016 2.126 . . . . 0.0 111.641 179.572 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -71.48 -25.54 62.31 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.111 0.965 . . . . 0.0 112.713 175.93 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -90.64 -37.75 13.56 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.188 0.995 . . . . 0.0 112.622 176.233 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.5 m -109.98 -3.41 10.5 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.215 0 N-CA-C 114.371 1.249 . . . . 0.0 114.371 -175.039 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 88.03 10.14 69.6 Favored Glycine 0 N--CA 1.472 1.081 0 C-N-CA 126.096 1.808 . . . . 0.0 116.133 160.974 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 64.36 4.06 2.05 Favored 'General case' 0 CA--C 1.554 1.116 0 C-N-CA 127.756 2.422 . . . . 0.0 114.677 -164.53 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -85.98 -26.12 25.64 Favored 'General case' 0 N--CA 1.48 1.028 0 O-C-N 120.626 -1.296 . . . . 0.0 113.304 179.631 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 45.6 m-80 -122.63 2.95 9.58 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 113.976 1.102 . . . . 0.0 113.976 -164.85 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 20.5 pt -75.05 155.65 6.26 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.551 0 C-N-CA 123.024 0.53 . . . . 0.0 111.352 174.685 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -139.03 142.18 38.26 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 124.765 1.226 . . . . 0.0 109.304 177.486 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -61.11 -26.51 67.72 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 119.088 0.858 . . . . 0.0 112.439 -179.166 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.9 mp -64.76 -50.88 73.33 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.472 0 C-N-CA 125.555 1.542 . . . . 0.0 109.831 173.778 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 81.1 m -76.3 -41.02 50.0 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 123.849 0.86 . . . . 0.0 110.764 -176.566 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 16.3 tp -61.85 -38.46 88.29 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 125.619 1.568 . . . . 0.0 111.766 174.189 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.466 ' HA ' HG13 ' A' ' 66' ' ' ILE . 39.8 t -56.95 -28.72 62.47 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 124.921 1.288 . . . . 0.0 112.794 170.298 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -100.56 -29.07 12.55 Favored 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 124.789 1.236 . . . . 0.0 114.25 -176.196 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 9.1 mmtm -63.28 -33.61 75.89 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 125.197 1.399 . . . . 0.0 111.715 175.102 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.4 mp -114.43 4.12 15.2 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 125.472 1.509 . . . . 0.0 114.039 -176.584 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 49.2 m-80 53.51 56.66 7.02 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 126.01 1.724 . . . . 0.0 113.366 -179.232 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.466 HG13 ' HA ' ' A' ' 61' ' ' SER . 1.2 pt -125.2 -166.67 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.764 0 C-N-CA 126.885 2.074 . . . . 0.0 110.974 -171.829 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 62.2 p -94.15 155.66 16.96 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 124.514 1.126 . . . . 0.0 111.251 169.915 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 60.6 t -63.93 -24.77 36.58 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 O-C-N 121.628 -0.67 . . . . 0.0 111.086 171.865 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 15.6 mp0 -79.72 -30.33 40.93 Favored 'General case' 0 C--O 1.233 0.209 0 C-N-CA 125.148 1.379 . . . . 0.0 111.124 -174.695 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.16 -32.81 16.48 Favored 'General case' 0 C--N 1.344 0.368 0 CA-C-N 118.156 0.435 . . . . 0.0 111.738 173.978 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -62.14 -46.77 87.5 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 124.239 1.015 . . . . 0.0 111.9 173.149 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 19.9 ptmt -69.0 -24.77 64.26 Favored 'General case' 0 N--CA 1.468 0.449 0 O-C-N 121.296 -0.877 . . . . 0.0 112.121 -176.766 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -60.93 -39.76 90.67 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 120.342 -0.543 . . . . 0.0 110.445 179.247 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 26.4 m-85 -61.48 -38.88 88.88 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 124.609 1.164 . . . . 0.0 112.301 179.752 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 7.3 mt -73.4 -18.11 17.83 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.847 0 C-N-CA 125.852 1.661 . . . . 0.0 111.941 -178.951 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 61.8 tttt -103.52 -33.93 8.86 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 125.678 1.591 . . . . 0.0 110.776 -177.599 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 81.6 m-20 . . . . . 0 CA--C 1.531 0.228 0 C-N-CA 126.72 2.008 . . . . 0.0 109.838 175.799 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 . . . . . 0 CA--C 1.545 0.787 0 CA-C-O 120.964 0.411 . . . . 0.0 111.872 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -145.87 139.86 26.61 Favored 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 125.323 1.449 . . . . 0.0 111.355 175.068 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 95.9 t -138.15 135.13 44.85 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 C-N-CA 126.133 1.773 . . . . 0.0 110.306 179.453 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 19.2 t -154.73 -42.96 0.09 Allowed 'General case' 0 N--CA 1.47 0.529 0 N-CA-C 113.841 1.052 . . . . 0.0 113.841 177.513 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 23.1 p -151.3 117.29 5.54 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-O 122.181 0.991 . . . . 0.0 113.418 -176.187 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 57.9 mtt 54.74 40.97 32.22 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 126.061 1.745 . . . . 0.0 112.983 173.713 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -84.0 3.42 34.45 Favored 'General case' 0 CA--C 1.547 0.828 0 N-CA-C 115.298 1.592 . . . . 0.0 115.298 -163.162 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -133.47 155.37 49.66 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 125.587 1.555 . . . . 0.0 113.167 -174.562 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 33.5 mmtp . . . . . 0 N--CA 1.483 1.178 0 C-N-CA 126.451 1.9 . . . . 0.0 113.515 -176.898 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 58.5 ttm . . . . . 0 CA--C 1.537 0.481 0 CA-C-O 120.667 0.27 . . . . 0.0 110.66 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 25.4 m-20 -127.16 97.62 31.57 Favored Pre-proline 0 CA--C 1.547 0.839 0 C-N-CA 124.922 1.289 . . . . 0.0 111.008 176.217 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 64.8 Cg_endo -83.03 6.87 5.54 Favored 'Trans proline' 0 CA--C 1.539 0.756 0 C-N-CA 123.79 2.993 . . . . 0.0 114.219 179.325 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 92.2 mt -115.55 29.72 7.82 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 125.368 1.467 . . . . 0.0 113.716 -172.734 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -98.02 -1.1 43.36 Favored 'General case' 0 N--CA 1.479 1.024 0 N-CA-C 114.087 1.144 . . . . 0.0 114.087 170.897 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 13.7 ptmt -103.86 -35.38 8.19 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 125.78 1.632 . . . . 0.0 114.78 -171.004 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.3 pp -144.44 -42.12 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.008 0 C-N-CA 125.845 1.658 . . . . 0.0 113.643 -174.324 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . 0.31 10.6 tt 38.27 35.29 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.437 0 N-CA-C 116.283 1.957 . . . . 0.0 116.283 -177.52 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 3.2 t30 55.91 29.07 13.52 Favored 'General case' 0 CA--C 1.552 1.023 0 C-N-CA 125.688 1.595 . . . . 0.0 114.279 -177.744 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 3.2 p-10 -81.2 9.61 6.65 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 116.781 2.141 . . . . 0.0 116.781 -166.11 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 7.1 tp -141.76 18.86 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.835 0 C-N-CA 125.779 1.632 . . . . 0.0 113.733 -175.704 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 13.9 tmtt? . . . . . 0 N--CA 1.475 0.781 0 N-CA-C 115.15 1.537 . . . . 0.0 115.15 -175.753 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 34.5 mt . . . . . 0 CA--C 1.541 0.618 0 CA-C-O 120.73 0.3 . . . . 0.0 111.147 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 29.7 t -69.68 163.28 25.97 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 123.138 0.575 . . . . 0.0 110.735 168.459 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 7.1 tm-20 -53.86 -42.78 68.92 Favored 'General case' 0 N--CA 1.474 0.741 0 O-C-N 120.874 -1.141 . . . . 0.0 112.82 -179.268 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 7.9 pt20 -78.23 -34.62 49.11 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 112.359 0.503 . . . . 0.0 112.359 175.958 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 91.0 mt-30 -68.12 -37.17 80.83 Favored 'General case' 0 CA--C 1.535 0.37 0 O-C-N 121.501 -0.75 . . . . 0.0 111.578 179.517 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 40.1 ttmt -59.3 -39.52 83.28 Favored 'General case' 0 N--CA 1.47 0.568 0 O-C-N 121.272 -0.893 . . . . 0.0 111.209 172.961 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 45.2 mt -72.77 -40.64 61.33 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 CA-C-O 118.262 -0.875 . . . . 0.0 111.296 176.841 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 39.2 mt -64.4 -42.06 94.18 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 CA-C-N 120.644 1.565 . . . . 0.0 110.526 177.8 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -56.38 -52.74 63.5 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 124.336 1.054 . . . . 0.0 109.952 173.903 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -64.64 -50.68 66.13 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 123.687 0.795 . . . . 0.0 113.003 -178.816 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 18.7 mm-40 -62.35 -22.07 65.81 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 113.525 0.935 . . . . 0.0 113.525 -178.423 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.415 ' CE1' HG22 ' A' ' 55' ' ' ILE . 1.7 t80 -71.55 -60.68 2.1 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 119.038 0.836 . . . . 0.0 110.742 173.376 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 16.2 mt -63.42 -32.45 56.63 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.496 0 C-N-CA 125.939 1.695 . . . . 0.0 111.688 179.847 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -70.26 -21.56 62.96 Favored 'General case' 0 CA--C 1.545 0.754 0 O-C-N 121.255 -0.903 . . . . 0.0 113.066 175.655 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -94.19 -34.77 12.78 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.358 1.063 . . . . 0.0 112.654 177.751 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 11.7 m -116.7 -18.77 6.79 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.066 0 N-CA-C 114.121 1.156 . . . . 0.0 114.121 -174.411 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 80.62 141.05 2.74 Favored Glycine 0 CA--C 1.53 1.001 0 C-N-CA 124.58 1.086 . . . . 0.0 111.649 -171.501 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.0 tt -64.05 -19.02 64.92 Favored 'General case' 0 N--CA 1.473 0.725 0 O-C-N 121.154 -1.203 . . . . 0.0 114.015 -169.029 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 36.8 mt-30 -66.18 -17.1 64.52 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 126.1 1.76 . . . . 0.0 113.324 174.9 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 69.3 m-80 -112.86 -5.93 13.83 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 114.703 1.372 . . . . 0.0 114.703 -174.145 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . 0.415 HG22 ' CE1' ' A' ' 46' ' ' TYR . 3.7 pt -79.72 162.8 3.72 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 C-N-CA 123.55 0.74 . . . . 0.0 112.48 173.117 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -130.83 147.06 52.44 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 124.931 1.292 . . . . 0.0 109.974 171.895 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -63.76 -25.04 68.01 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 121.429 -0.794 . . . . 0.0 112.029 174.387 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -66.42 -46.98 85.36 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.481 0 C-N-CA 125.455 1.502 . . . . 0.0 109.667 173.423 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 89.7 m -74.22 -43.53 56.75 Favored 'General case' 0 C--O 1.224 -0.27 0 C-N-CA 123.344 0.658 . . . . 0.0 110.151 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 18.7 tp -61.96 -36.04 80.24 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 124.491 1.117 . . . . 0.0 111.864 176.046 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.49 ' HA ' HG13 ' A' ' 66' ' ' ILE . 44.9 t -53.01 -33.25 50.84 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.621 1.168 . . . . 0.0 113.146 168.292 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -100.47 -22.65 14.95 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 125.087 1.355 . . . . 0.0 114.518 -175.584 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 63.9 mmtt -65.19 -38.25 89.91 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 124.709 1.204 . . . . 0.0 111.153 173.967 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.4 mp -111.62 -0.16 16.19 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 125.073 1.349 . . . . 0.0 114.335 -173.028 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 16.0 m-80 56.89 45.41 21.47 Favored 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 125.743 1.617 . . . . 0.0 112.615 -172.875 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.49 HG13 ' HA ' ' A' ' 61' ' ' SER . 10.5 pt -104.46 -166.83 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 C-N-CA 125.821 1.648 . . . . 0.0 111.227 -179.47 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 44.5 p -94.74 161.19 14.28 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 123.998 0.919 . . . . 0.0 110.889 166.767 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 82.5 t -61.85 -28.28 43.95 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 O-C-N 121.341 -0.849 . . . . 0.0 111.054 170.995 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -77.31 -40.21 45.11 Favored 'General case' 0 C--O 1.233 0.214 0 O-C-N 120.68 -1.262 . . . . 0.0 110.453 -175.913 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . 0.366 0.0 OUTLIER -91.59 8.37 37.0 Favored 'General case' 0 C--N 1.348 0.508 0 N-CA-C 113.722 1.008 . . . . 0.0 113.722 175.917 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -95.52 -44.37 7.55 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.467 1.507 . . . . 0.0 111.635 159.799 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 23.9 ttmm -74.15 -29.62 61.88 Favored 'General case' 0 CA--C 1.517 -0.29 0 C-N-CA 124.896 1.278 . . . . 0.0 111.465 -174.475 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 51.9 p-10 -55.53 -42.67 74.88 Favored 'General case' 0 CA--C 1.544 0.735 0 CA-C-O 118.631 -0.7 . . . . 0.0 111.905 176.649 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 20.9 m-85 -59.08 -44.01 91.86 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 125.718 1.607 . . . . 0.0 112.376 175.811 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 69.2 mt -68.44 -25.11 30.42 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.795 0 C-N-CA 124.984 1.314 . . . . 0.0 110.041 179.647 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 73.4 mmtt -93.56 -25.32 17.61 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 115.888 1.81 . . . . 0.0 115.888 -179.846 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 8.4 p30 . . . . . 0 N--CA 1.472 0.666 0 CA-C-N 120.682 1.583 . . . . 0.0 113.103 175.949 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 26.1 tt0 . . . . . 0 CA--C 1.546 0.821 0 N-CA-C 113.027 0.751 . . . . 0.0 113.027 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -106.54 98.06 7.78 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 125.071 1.349 . . . . 0.0 111.751 -174.275 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 8.7 m -135.0 31.81 0.79 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.649 0 C-N-CA 125.939 1.696 . . . . 0.0 113.365 -170.995 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 72.2 m -131.4 -62.19 0.89 Allowed 'General case' 0 N--CA 1.475 0.824 0 N-CA-C 113.524 0.935 . . . . 0.0 113.524 -163.07 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 55.7 p -78.87 -23.74 44.7 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 124.043 0.937 . . . . 0.0 112.963 175.27 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 77.1 mtm -134.69 140.49 46.02 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 126.817 2.047 . . . . 0.0 109.162 169.28 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 6.1 tt0 -145.46 24.31 1.41 Allowed 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 123.865 0.866 . . . . 0.0 112.642 -179.387 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -65.22 127.29 31.11 Favored 'General case' 0 CA--C 1.542 0.65 0 O-C-N 120.701 -1.25 . . . . 0.0 112.55 -173.941 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 47.5 mtmt . . . . . 0 N--CA 1.475 0.809 0 C-N-CA 126.491 1.916 . . . . 0.0 110.778 -177.701 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.4 ttp . . . . . 0 CA--C 1.549 0.909 0 N-CA-C 113.646 0.98 . . . . 0.0 113.646 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 20.6 m-20 -133.45 79.03 61.36 Favored Pre-proline 0 CA--C 1.549 0.916 0 C-N-CA 124.744 1.217 . . . . 0.0 112.227 -169.472 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo -80.95 -3.08 12.14 Favored 'Trans proline' 0 C--N 1.351 0.682 0 C-N-CA 123.88 3.053 . . . . 0.0 115.081 -177.74 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 97.7 mt -112.84 44.46 1.49 Allowed 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 125.938 1.695 . . . . 0.0 112.256 -175.312 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -116.28 1.75 13.14 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 125.08 1.352 . . . . 0.0 114.506 177.831 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.74 -56.0 2.23 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 124.627 1.171 . . . . 0.0 112.899 -167.458 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.0 pp -130.93 14.09 1.99 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 126.236 1.815 . . . . 0.0 112.82 -174.657 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 8.6 tt -43.82 123.46 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 C-N-CA 124.921 1.288 . . . . 0.0 112.537 178.693 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -146.69 10.15 1.05 Allowed 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 124.399 1.08 . . . . 0.0 113.401 179.82 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -81.41 6.39 14.66 Favored 'General case' 0 CA--C 1.546 0.794 0 N-CA-C 114.939 1.459 . . . . 0.0 114.939 -167.626 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 7.0 tp -146.1 23.05 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 C-N-CA 125.916 1.686 . . . . 0.0 113.609 -173.825 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 40.7 ttmt . . . . . 0 N--CA 1.473 0.723 0 N-CA-C 114.081 1.141 . . . . 0.0 114.081 178.802 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.8 mt . . . . . 0 CA--C 1.544 0.726 0 N-CA-C 110.055 -0.35 . . . . 0.0 110.055 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 30.1 t -68.81 163.55 23.93 Favored 'General case' 0 N--CA 1.477 0.911 0 O-C-N 121.81 -0.557 . . . . 0.0 110.636 166.882 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -57.93 -42.0 83.91 Favored 'General case' 0 N--CA 1.477 0.884 0 O-C-N 120.335 -1.478 . . . . 0.0 112.875 -176.595 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 6.9 pt20 -74.96 -35.79 62.09 Favored 'General case' 0 N--CA 1.47 0.544 0 O-C-N 121.71 -0.619 . . . . 0.0 112.323 173.9 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 93.4 mt-30 -66.07 -38.22 87.77 Favored 'General case' 0 CA--C 1.532 0.276 0 O-C-N 121.563 -0.711 . . . . 0.0 111.261 178.823 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 40.7 ttmt -58.83 -41.13 86.15 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 124.228 1.011 . . . . 0.0 111.066 174.941 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 39.4 mt -71.65 -42.44 71.32 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 CA-C-O 118.441 -0.79 . . . . 0.0 110.993 178.106 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 40.1 mt -63.65 -43.04 97.99 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.988 0 CA-C-N 120.282 1.401 . . . . 0.0 110.19 177.851 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -57.4 -51.39 69.6 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 125.043 1.337 . . . . 0.0 110.129 176.097 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -65.14 -46.66 80.03 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.367 1.067 . . . . 0.0 113.508 179.685 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 17.7 mm-40 -67.35 -25.22 65.88 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 123.931 0.892 . . . . 0.0 112.96 179.8 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.435 ' CE1' HG22 ' A' ' 55' ' ' ILE . 1.9 t80 -72.35 -51.51 20.28 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 118.811 0.732 . . . . 0.0 110.589 175.642 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 42.6 mt -61.51 -32.51 53.67 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.596 0 C-N-CA 124.789 1.236 . . . . 0.0 111.229 173.591 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -66.3 -24.08 66.49 Favored 'General case' 0 CA--C 1.546 0.802 0 O-C-N 121.091 -1.005 . . . . 0.0 113.288 173.953 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -92.43 -31.48 15.28 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.543 1.137 . . . . 0.0 112.828 179.4 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 6.4 m -127.57 -22.39 1.73 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.94 0 N-CA-C 114.209 1.189 . . . . 0.0 114.209 -172.137 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 88.67 148.16 16.39 Favored Glycine 0 CA--C 1.533 1.206 0 C-N-CA 125.422 1.486 . . . . 0.0 113.458 -172.455 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -57.23 -25.63 59.44 Favored 'General case' 0 N--CA 1.481 1.08 0 CA-C-O 123.569 1.652 . . . . 0.0 112.544 -176.833 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 7.2 pt20 -81.16 -13.32 58.75 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 126.738 2.015 . . . . 0.0 114.622 -179.7 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 76.0 m-20 -118.07 -11.93 10.12 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 114.759 1.392 . . . . 0.0 114.759 -177.894 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . 0.435 HG22 ' CE1' ' A' ' 46' ' ' TYR . 46.0 pt -64.21 152.61 8.21 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 CA-C-O 120.899 0.38 . . . . 0.0 110.678 163.418 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -130.15 143.53 50.84 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 124.452 1.101 . . . . 0.0 109.991 178.363 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -62.17 -24.77 67.38 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 118.931 0.787 . . . . 0.0 112.49 -179.65 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.9 mp -70.29 -42.11 78.73 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 C-N-CA 125.868 1.667 . . . . 0.0 110.747 174.629 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 88.8 m -79.09 -42.87 25.31 Favored 'General case' 0 C--N 1.33 -0.276 0 O-C-N 121.675 -0.64 . . . . 0.0 109.62 -179.411 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 17.3 tp -64.86 -35.97 82.83 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 125.701 1.6 . . . . 0.0 112.329 177.022 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.466 ' HA ' HG13 ' A' ' 66' ' ' ILE . 60.5 p -58.29 -26.47 63.05 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 118.995 0.816 . . . . 0.0 112.397 170.982 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -99.49 -30.1 12.35 Favored 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 124.794 1.238 . . . . 0.0 114.22 -178.913 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 11.1 mmtm -63.19 -34.44 77.63 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 125.077 1.351 . . . . 0.0 112.196 177.586 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.1 mp -118.06 8.78 12.53 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 124.981 1.312 . . . . 0.0 113.998 -177.585 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 14.2 t30 55.38 61.82 2.72 Favored 'General case' 0 CA--C 1.552 1.044 0 C-N-CA 125.091 1.357 . . . . 0.0 111.854 177.165 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.466 HG13 ' HA ' ' A' ' 61' ' ' SER . 1.6 pt -136.5 175.87 9.31 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 C-N-CA 126.428 1.891 . . . . 0.0 111.476 -171.148 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 32.4 p -74.99 160.27 30.76 Favored 'General case' 0 N--CA 1.472 0.639 0 O-C-N 120.964 -1.085 . . . . 0.0 111.073 171.987 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 90.6 t -66.61 -26.39 37.27 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.02 0 O-C-N 121.364 -0.835 . . . . 0.0 110.987 169.938 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -77.53 -30.79 52.98 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 124.822 1.249 . . . . 0.0 111.204 -176.916 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . 0.352 0.0 OUTLIER -102.49 18.01 22.23 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 125.254 1.422 . . . . 0.0 113.395 171.254 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -104.05 -43.82 5.17 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.134 1.374 . . . . 0.0 111.616 158.029 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 9.2 ptmm? -73.61 -24.66 60.08 Favored 'General case' 0 N--CA 1.472 0.629 0 O-C-N 120.877 -1.14 . . . . 0.0 112.478 -176.202 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 28.3 p-10 -54.15 -39.63 66.69 Favored 'General case' 0 CA--C 1.545 0.755 0 N-CA-C 113.246 0.832 . . . . 0.0 113.246 173.444 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 28.2 m-85 -69.68 -47.23 63.97 Favored 'General case' 0 C--O 1.226 -0.164 0 C-N-CA 126.902 2.081 . . . . 0.0 110.167 179.314 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 67.7 mt -65.25 -42.76 94.74 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.497 0 C-N-CA 123.974 0.91 . . . . 0.0 109.821 -179.355 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 2.7 tppp? -70.03 -31.54 69.24 Favored 'General case' 0 N--CA 1.467 0.419 0 O-C-N 120.809 -1.182 . . . . 0.0 112.533 -176.17 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 3.6 p30 . . . . . 0 CA--C 1.535 0.367 0 CA-C-N 119.202 0.91 . . . . 0.0 112.032 175.443 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 . . . . . 0 N--CA 1.473 0.711 0 CA-C-O 121.092 0.472 . . . . 0.0 111.393 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -135.52 122.87 21.82 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 124.94 1.296 . . . . 0.0 110.848 -179.004 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 67.9 t -133.94 127.82 52.45 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 C-N-CA 125.513 1.525 . . . . 0.0 109.933 176.835 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 44.2 t -161.29 -56.61 0.05 OUTLIER 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 123.978 0.911 . . . . 0.0 112.635 174.447 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 13.2 t -80.09 -29.6 39.08 Favored 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 113.553 0.945 . . . . 0.0 113.553 -174.517 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 13.3 ttt -135.34 115.08 12.84 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 125.283 1.433 . . . . 0.0 109.991 -178.875 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -117.76 -10.07 10.58 Favored 'General case' 0 N--CA 1.479 0.988 0 N-CA-C 113.89 1.071 . . . . 0.0 113.89 -169.291 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -87.42 124.65 33.64 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 124.866 1.266 . . . . 0.0 112.005 -178.043 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 59.4 mtmt . . . . . 0 N--CA 1.477 0.879 0 C-N-CA 126.098 1.759 . . . . 0.0 110.489 174.957 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.1 mtt . . . . . 0 N--CA 1.471 0.576 0 CA-C-O 120.519 0.2 . . . . 0.0 110.765 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 -135.88 148.44 65.1 Favored Pre-proline 0 CA--C 1.548 0.872 0 C-N-CA 125.11 1.364 . . . . 0.0 112.09 176.67 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -81.43 -7.85 12.72 Favored 'Trans proline' 0 CA--C 1.538 0.678 0 C-N-CA 123.643 2.895 . . . . 0.0 115.097 -177.0 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -130.94 31.4 4.48 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 125.787 1.635 . . . . 0.0 114.206 -174.194 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -101.29 -4.11 27.68 Favored 'General case' 0 N--CA 1.478 0.971 0 N-CA-C 114.67 1.359 . . . . 0.0 114.67 179.589 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -129.79 -57.63 1.11 Allowed 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 124.647 1.179 . . . . 0.0 113.424 -160.62 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.8 pp -107.05 9.5 9.39 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.761 0 C-N-CA 125.925 1.69 . . . . 0.0 112.869 -177.157 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 18.0 tt -48.61 114.4 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.841 0 C-N-CA 125.045 1.338 . . . . 0.0 113.791 -175.219 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 7.7 t30 -161.14 130.15 4.64 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 126.942 2.097 . . . . 0.0 108.586 171.652 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 29.2 t0 -150.42 47.87 0.89 Allowed 'General case' 0 N--CA 1.476 0.835 0 CA-C-O 122.556 1.17 . . . . 0.0 111.106 178.409 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 58.5 mt 48.69 96.7 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 C-N-CA 128.83 2.852 . . . . 0.0 112.539 -168.362 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.441 ' HA ' ' HE2' ' A' ' 12' ' ' LYS . 11.3 mmpt? . . . . . 0 N--CA 1.472 0.663 0 C-N-CA 125.136 1.374 . . . . 0.0 113.321 172.463 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 63.7 mt . . . . . 0 N--CA 1.472 0.637 0 N-CA-C 112.988 0.736 . . . . 0.0 112.988 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 67.4 m -76.33 165.0 25.48 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.73 0.812 . . . . 0.0 110.299 171.144 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -55.22 -45.91 75.95 Favored 'General case' 0 N--CA 1.48 1.027 0 O-C-N 120.746 -1.222 . . . . 0.0 113.185 -174.348 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 10.5 tt0 -67.69 -43.43 80.13 Favored 'General case' 0 N--CA 1.469 0.522 0 O-C-N 121.496 -0.752 . . . . 0.0 111.063 176.758 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 88.7 mt-30 -62.95 -41.48 99.52 Favored 'General case' 0 CA--C 1.536 0.412 0 O-C-N 121.916 -0.49 . . . . 0.0 111.819 178.935 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 22.6 ttmm -59.74 -40.98 89.89 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 124.27 1.028 . . . . 0.0 110.982 174.742 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 50.6 mt -67.38 -41.53 86.4 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 CA-C-O 118.077 -0.963 . . . . 0.0 111.474 175.583 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 45.6 mt -64.5 -44.91 96.95 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.904 0 CA-C-N 120.773 1.624 . . . . 0.0 110.29 178.074 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -58.29 -48.38 80.66 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.774 1.23 . . . . 0.0 110.587 177.434 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -63.56 -53.11 56.92 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.625 1.17 . . . . 0.0 112.599 176.529 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.3 mm-40 -60.01 -29.99 68.85 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-N 118.998 0.817 . . . . 0.0 112.822 -179.696 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.417 ' CE2' HG22 ' A' ' 55' ' ' ILE . 1.3 t80 -68.04 -56.95 7.02 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 118.806 0.73 . . . . 0.0 110.93 176.311 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 80.1 mt -64.98 -33.65 65.14 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.333 0 C-N-CA 126.526 1.931 . . . . 0.0 111.195 -179.323 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -72.25 -27.96 62.84 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.892 0.877 . . . . 0.0 112.568 176.309 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -85.53 -39.67 17.16 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 123.861 0.865 . . . . 0.0 112.503 176.337 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.9 m -105.21 -6.95 9.83 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.047 0 N-CA-C 113.654 0.983 . . . . 0.0 113.654 -175.497 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 81.48 33.23 28.72 Favored Glycine 0 N--CA 1.471 0.985 0 C-N-CA 124.263 0.935 . . . . 0.0 114.176 164.207 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 20.0 tp 60.86 -26.77 0.04 OUTLIER 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 129.945 3.298 . . . . 0.0 117.708 -174.148 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 29.5 mt-30 -77.27 -13.0 60.02 Favored 'General case' 0 C--N 1.32 -0.684 0 C-N-CA 126.922 2.089 . . . . 0.0 113.752 -169.277 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 60.5 m-80 -123.31 1.16 9.03 Favored 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 114.336 1.236 . . . . 0.0 114.336 -169.736 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . 0.417 HG22 ' CE2' ' A' ' 46' ' ' TYR . 18.3 pt -75.91 155.46 5.95 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 CA-C-O 121.072 0.463 . . . . 0.0 111.705 175.006 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -137.85 143.94 41.19 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 124.658 1.183 . . . . 0.0 110.018 178.794 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -61.33 -26.62 67.93 Favored 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 123.634 0.773 . . . . 0.0 112.316 -179.758 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -67.47 -51.21 54.37 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.327 0 C-N-CA 125.343 1.457 . . . . 0.0 109.631 174.538 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 83.6 m -73.81 -43.82 57.66 Favored 'General case' 0 C--N 1.33 -0.239 0 O-C-N 121.749 -0.594 . . . . 0.0 109.918 -176.719 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 17.2 tp -60.61 -35.09 75.29 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 125.53 1.532 . . . . 0.0 112.343 174.384 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.485 ' HA ' HG13 ' A' ' 66' ' ' ILE . 12.0 t -54.99 -30.43 59.3 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 124.975 1.31 . . . . 0.0 112.581 169.485 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 1.5 mptp? -105.19 -22.78 13.01 Favored 'General case' 0 N--CA 1.468 0.474 0 N-CA-C 114.491 1.293 . . . . 0.0 114.491 -176.464 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 68.4 mmtt -62.9 -34.57 77.69 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 119.797 1.18 . . . . 0.0 111.636 174.074 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.2 mp -120.92 13.65 11.44 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.923 1.289 . . . . 0.0 114.05 -176.401 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . 0.273 0.9 OUTLIER 48.2 53.68 11.4 Favored 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 126.614 1.965 . . . . 0.0 114.218 -177.14 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.485 HG13 ' HA ' ' A' ' 61' ' ' SER . 2.7 pt -117.42 -176.05 0.92 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 C-N-CA 126.781 2.032 . . . . 0.0 111.483 -174.626 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 36.8 p -83.94 156.76 22.19 Favored 'General case' 0 N--CA 1.474 0.734 0 O-C-N 121.214 -0.929 . . . . 0.0 111.084 170.791 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 66.7 t -62.27 -28.94 45.54 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 O-C-N 121.672 -0.643 . . . . 0.0 111.132 170.914 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -74.91 -42.71 57.24 Favored 'General case' 0 C--O 1.234 0.263 0 O-C-N 120.988 -1.07 . . . . 0.0 109.879 -176.597 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . 0.262 0.0 OUTLIER -77.69 -30.17 51.79 Favored 'General case' 0 C--N 1.344 0.348 0 CA-C-N 118.137 0.426 . . . . 0.0 111.88 -178.993 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -65.04 -47.32 77.81 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 124.678 1.191 . . . . 0.0 112.324 169.322 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 38.1 ttmt -68.1 -28.91 67.75 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 124.32 1.048 . . . . 0.0 111.492 -178.258 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -55.17 -36.54 65.96 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 123.494 0.718 . . . . 0.0 112.361 175.729 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 31.5 m-85 -69.54 -42.7 74.28 Favored 'General case' 0 C--O 1.223 -0.324 0 C-N-CA 125.569 1.548 . . . . 0.0 111.02 177.136 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 75.2 mt -68.45 -37.27 77.56 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.468 0 C-N-CA 124.173 0.989 . . . . 0.0 110.264 -178.626 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 88.5 mttt -65.19 -34.91 79.49 Favored 'General case' 0 N--CA 1.471 0.594 0 O-C-N 120.853 -1.154 . . . . 0.0 113.448 178.538 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 9.6 p30 . . . . . 0 N--CA 1.464 0.272 0 CA-C-N 119.315 0.961 . . . . 0.0 111.105 174.202 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 . . . . . 0 N--CA 1.473 0.708 0 CA-C-O 120.982 0.42 . . . . 0.0 111.72 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -121.43 74.25 1.1 Allowed 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 125.166 1.386 . . . . 0.0 110.692 -175.394 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 18.6 m -135.12 21.92 1.05 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.615 0 C-N-CA 125.588 1.555 . . . . 0.0 114.229 -170.76 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 22.9 t -146.45 -56.59 0.28 Allowed 'General case' 0 N--CA 1.476 0.831 0 N-CA-C 113.517 0.932 . . . . 0.0 113.517 -176.625 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 45.6 m -88.15 -40.27 13.87 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 123.261 0.624 . . . . 0.0 112.441 -175.509 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 1.8 mpt? -125.05 141.66 51.98 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 126.473 1.909 . . . . 0.0 108.827 169.75 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -148.04 94.49 2.34 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.752 1.221 . . . . 0.0 109.259 178.31 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -138.2 156.18 47.95 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.195 1.398 . . . . 0.0 112.304 -178.863 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 2.0 mmmp? . . . . . 0 N--CA 1.478 0.93 0 C-N-CA 125.996 1.718 . . . . 0.0 110.831 179.894 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 36.9 ttm . . . . . 0 CA--C 1.547 0.863 0 N-CA-C 112.926 0.713 . . . . 0.0 112.926 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 -84.76 147.81 49.76 Favored Pre-proline 0 CA--C 1.547 0.847 0 C-N-CA 124.628 1.171 . . . . 0.0 112.481 -179.141 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_endo -71.03 -19.18 30.44 Favored 'Trans proline' 0 C--N 1.35 0.655 0 C-N-CA 122.935 2.424 . . . . 0.0 114.963 -173.634 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.478 HD23 ' H ' ' A' ' 4' ' ' LEU . 2.6 pt? -112.63 25.68 11.24 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 126.828 2.051 . . . . 0.0 114.402 -172.353 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -103.01 0.52 32.22 Favored 'General case' 0 N--CA 1.477 0.876 0 N-CA-C 114.815 1.413 . . . . 0.0 114.815 -178.167 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -122.46 -55.36 1.84 Allowed 'General case' 0 N--CA 1.484 1.234 0 N-CA-C 113.894 1.072 . . . . 0.0 113.894 -165.168 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.0 pp -129.84 15.15 2.39 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 C-N-CA 125.652 1.581 . . . . 0.0 112.81 -171.784 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 14.2 tt -39.79 133.33 0.49 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.847 0 C-N-CA 126.407 1.883 . . . . 0.0 114.407 178.724 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 25.8 t30 -148.54 148.85 30.66 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 126.242 1.817 . . . . 0.0 110.732 170.63 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 20.2 m-20 -132.63 71.47 1.47 Allowed 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 125.389 1.475 . . . . 0.0 111.004 170.41 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . 0.34 6.7 tp 52.21 26.26 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.069 0 C-N-CA 128.262 2.625 . . . . 0.0 115.571 175.098 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.476 0.867 0 N-CA-C 114.818 1.414 . . . . 0.0 114.818 177.612 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 11.2 mt . . . . . 0 CA--C 1.54 0.593 0 N-CA-C 110.398 -0.223 . . . . 0.0 110.398 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 68.3 m -69.06 167.19 16.52 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.006 0.522 . . . . 0.0 110.47 171.158 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -56.26 -45.48 80.07 Favored 'General case' 0 N--CA 1.478 0.927 0 O-C-N 120.463 -1.398 . . . . 0.0 112.651 -176.327 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 10.3 tt0 -70.16 -44.25 69.18 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 123.527 0.731 . . . . 0.0 111.347 176.338 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 82.9 mt-30 -59.71 -41.66 91.3 Favored 'General case' 0 N--CA 1.468 0.453 0 O-C-N 121.805 -0.559 . . . . 0.0 111.693 178.16 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 3.4 ttmp? -62.34 -40.05 95.11 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 124.206 1.002 . . . . 0.0 111.215 177.542 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 52.4 mt -70.53 -39.46 76.18 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.558 0 CA-C-O 117.958 -1.02 . . . . 0.0 111.585 175.655 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 50.7 mt -62.87 -45.64 98.36 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.99 0 CA-C-N 120.942 1.701 . . . . 0.0 109.733 176.676 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -58.58 -49.44 77.45 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.829 1.251 . . . . 0.0 110.924 178.56 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -63.94 -52.21 60.8 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 124.784 1.234 . . . . 0.0 112.766 177.086 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -60.22 -30.36 69.34 Favored 'General case' 0 N--CA 1.472 0.625 0 CA-C-N 118.99 0.814 . . . . 0.0 112.724 179.867 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -67.02 -56.84 8.38 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 118.631 0.65 . . . . 0.0 110.605 176.659 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 87.1 mt -62.81 -34.14 64.14 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 C-N-CA 126.383 1.873 . . . . 0.0 111.287 178.126 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -70.91 -28.08 64.26 Favored 'General case' 0 CA--C 1.542 0.663 0 O-C-N 121.267 -0.896 . . . . 0.0 112.654 177.169 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -85.67 -40.26 16.37 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.127 0.971 . . . . 0.0 112.208 175.689 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.5 m -108.75 -5.04 10.73 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.159 0 N-CA-C 114.32 1.23 . . . . 0.0 114.32 -172.275 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 84.96 25.25 41.66 Favored Glycine 0 CA--C 1.529 0.96 0 C-N-CA 125.111 1.339 . . . . 0.0 115.263 161.318 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 58.01 6.64 0.51 Allowed 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 127.267 2.227 . . . . 0.0 115.155 -172.923 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 29.2 mt-30 -105.71 -18.01 14.21 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 125.856 1.663 . . . . 0.0 113.098 -172.139 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 47.0 m-80 -124.06 3.79 8.64 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 124.257 1.023 . . . . 0.0 113.542 -172.631 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 24.6 pt -74.36 154.31 6.68 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 CA-C-O 121.085 0.469 . . . . 0.0 111.116 172.666 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -138.85 142.65 38.63 Favored 'General case' 0 N--CA 1.466 0.375 0 C-N-CA 124.824 1.25 . . . . 0.0 109.525 178.68 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -61.01 -27.87 68.63 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 118.838 0.745 . . . . 0.0 112.274 -179.772 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -63.84 -49.29 82.58 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.466 0 C-N-CA 125.576 1.55 . . . . 0.0 109.922 174.626 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 83.9 m -78.98 -43.0 25.35 Favored 'General case' 0 C--O 1.223 -0.32 0 C-N-CA 123.806 0.842 . . . . 0.0 110.302 -175.904 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 14.0 tp -60.01 -36.75 77.89 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 125.078 1.351 . . . . 0.0 111.745 174.098 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.443 ' HA ' HG13 ' A' ' 66' ' ' ILE . 30.4 t -56.44 -31.41 63.93 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 124.839 1.255 . . . . 0.0 112.632 170.601 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -101.24 -26.36 13.67 Favored 'General case' 0 N--CA 1.467 0.39 0 N-CA-C 114.643 1.349 . . . . 0.0 114.643 -175.81 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 58.7 mmtt -64.41 -33.01 74.87 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 125.135 1.374 . . . . 0.0 111.577 175.387 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.7 mp -117.84 3.92 12.22 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.213 1.405 . . . . 0.0 114.353 -175.086 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 24.7 m-80 57.0 57.52 4.57 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 126.388 1.875 . . . . 0.0 113.415 -178.659 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.443 HG13 ' HA ' ' A' ' 61' ' ' SER . 1.2 pt -124.74 -163.99 0.38 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.849 0 C-N-CA 127.243 2.217 . . . . 0.0 110.554 -174.641 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 2.4 p -100.8 162.24 13.04 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 124.296 1.039 . . . . 0.0 111.126 170.284 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 69.2 t -61.65 -28.9 45.05 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 C-N-CA 123.545 0.738 . . . . 0.0 111.391 173.242 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -80.87 -38.17 28.59 Favored 'General case' 0 N--CA 1.471 0.613 0 O-C-N 120.893 -1.129 . . . . 0.0 110.394 -178.971 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 9.5 tmtt? -64.67 -45.5 86.45 Favored 'General case' 0 C--O 1.224 -0.237 0 C-N-CA 125.632 1.573 . . . . 0.0 110.518 176.961 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -60.34 -48.62 80.97 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 126.275 1.83 . . . . 0.0 113.444 170.71 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 36.5 ttmt -71.62 -23.03 61.64 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 124.227 1.011 . . . . 0.0 111.758 -174.417 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -52.02 -47.73 64.86 Favored 'General case' 0 CA--C 1.545 0.76 0 CA-C-N 118.137 0.426 . . . . 0.0 110.527 171.421 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 33.9 m-85 -64.6 -43.28 94.29 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 123.845 0.858 . . . . 0.0 111.982 179.776 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 55.8 mt -63.91 -25.38 38.04 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.629 0 C-N-CA 123.978 0.911 . . . . 0.0 111.099 179.15 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -91.06 -31.85 16.11 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 125.176 1.39 . . . . 0.0 114.686 179.724 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 23.5 p30 . . . . . 0 CA--C 1.54 0.57 0 CA-C-N 120.247 1.385 . . . . 0.0 114.224 -179.258 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 . . . . . 0 N--CA 1.473 0.676 0 CA-C-O 120.825 0.345 . . . . 0.0 111.276 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -144.64 96.8 2.93 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 124.833 1.253 . . . . 0.0 110.345 -175.535 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 71.7 t -136.59 137.99 46.99 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 C-N-CA 125.577 1.551 . . . . 0.0 110.683 -177.33 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 67.5 p -161.92 -66.26 0.05 Allowed 'General case' 0 N--CA 1.476 0.837 0 N-CA-C 113.609 0.966 . . . . 0.0 113.609 172.632 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 77.9 p -82.43 -23.54 34.77 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 124.977 1.311 . . . . 0.0 114.291 -173.157 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 93.1 mtp -133.5 130.93 39.21 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 126.023 1.729 . . . . 0.0 109.495 174.551 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -138.69 65.63 1.45 Allowed 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 125.074 1.35 . . . . 0.0 109.93 -174.683 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 53.4 -155.62 0.2 Allowed 'General case' 0 CA--C 1.555 1.147 0 C-N-CA 125.855 1.662 . . . . 0.0 113.886 -174.94 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 71.2 mmtt . . . . . 0 N--CA 1.478 0.973 0 C-N-CA 126.287 1.835 . . . . 0.0 111.947 177.851 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 21.0 ttt . . . . . 0 CA--C 1.55 0.972 0 CA-C-O 121.157 0.503 . . . . 0.0 112.298 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -120.82 98.39 47.81 Favored Pre-proline 0 CA--C 1.546 0.809 0 O-C-N 120.639 -1.288 . . . . 0.0 111.981 -168.796 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 95.5 Cg_endo -83.66 -8.59 10.31 Favored 'Trans proline' 0 C--N 1.351 0.665 0 C-N-CA 123.205 2.603 . . . . 0.0 114.699 178.145 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 94.3 mt -102.69 44.22 1.03 Allowed 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.626 1.57 . . . . 0.0 113.683 -170.582 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -106.91 -1.77 21.98 Favored 'General case' 0 N--CA 1.479 1.004 0 N-CA-C 114.907 1.447 . . . . 0.0 114.907 172.073 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -128.49 -56.46 1.23 Allowed 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 124.174 0.99 . . . . 0.0 113.363 -166.833 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.7 pp -109.54 9.07 8.96 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 C-N-CA 126.029 1.732 . . . . 0.0 112.888 -175.912 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 13.3 tt -49.85 120.31 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 124.223 1.009 . . . . 0.0 112.559 -179.252 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 53.85 21.48 2.79 Favored 'General case' 0 CA--C 1.55 0.965 0 C-N-CA 126.536 1.935 . . . . 0.0 115.244 179.937 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -86.32 13.83 7.5 Favored 'General case' 0 CA--C 1.547 0.832 0 N-CA-C 114.794 1.405 . . . . 0.0 114.794 -168.636 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 12.7 tt -143.69 21.35 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.879 0 C-N-CA 125.325 1.45 . . . . 0.0 114.201 -174.076 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 54.3 mtpt . . . . . 0 N--CA 1.479 0.979 0 N-CA-C 115.572 1.693 . . . . 0.0 115.572 178.895 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 8.1 mt . . . . . 0 CA--C 1.543 0.677 0 N-CA-C 110.224 -0.287 . . . . 0.0 110.224 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 22.8 t -70.93 164.46 25.39 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 122.93 0.492 . . . . 0.0 110.747 169.83 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -57.24 -44.17 83.58 Favored 'General case' 0 N--CA 1.476 0.836 0 O-C-N 120.531 -1.355 . . . . 0.0 112.965 -175.3 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 8.1 pt20 -75.9 -33.88 59.93 Favored 'General case' 0 N--CA 1.471 0.6 0 O-C-N 121.693 -0.63 . . . . 0.0 112.155 174.769 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 93.2 mt-30 -67.52 -39.5 85.11 Favored 'General case' 0 CA--C 1.532 0.264 0 O-C-N 121.662 -0.649 . . . . 0.0 111.52 -179.691 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 23.7 ttmm -59.36 -41.0 88.24 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 124.213 1.005 . . . . 0.0 110.81 174.682 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 46.2 mt -69.65 -42.2 80.38 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.656 0 CA-C-O 118.136 -0.935 . . . . 0.0 111.283 177.026 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 42.4 mt -63.86 -44.5 98.11 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.069 0 CA-C-N 120.702 1.592 . . . . 0.0 110.361 178.357 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -59.69 -47.52 85.33 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 125.033 1.333 . . . . 0.0 110.865 176.74 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -63.92 -51.83 62.67 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 124.634 1.173 . . . . 0.0 112.67 176.703 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -58.95 -31.62 68.87 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-N 119.261 0.937 . . . . 0.0 112.689 179.124 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -66.07 -57.41 7.78 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 118.621 0.646 . . . . 0.0 110.587 176.869 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 71.0 mt -62.7 -35.13 69.17 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.352 0 C-N-CA 127.199 2.2 . . . . 0.0 111.896 178.631 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -71.97 -29.03 63.83 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.023 0.929 . . . . 0.0 112.408 178.138 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -86.27 -38.76 17.22 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 123.988 0.915 . . . . 0.0 112.312 176.236 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.3 m -106.55 -5.91 10.19 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.191 0 N-CA-C 114.285 1.217 . . . . 0.0 114.285 -174.372 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 86.32 25.85 35.27 Favored Glycine 0 N--CA 1.472 1.085 0 C-N-CA 124.967 1.27 . . . . 0.0 115.306 161.594 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 54.3 14.24 0.74 Allowed 'General case' 0 CA--C 1.554 1.116 0 C-N-CA 127.381 2.272 . . . . 0.0 115.129 -173.538 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 5.2 pt20 -124.6 -3.17 7.84 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 124.854 1.262 . . . . 0.0 113.662 -171.589 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 50.4 m-80 -124.55 3.52 8.31 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 124.935 1.294 . . . . 0.0 113.411 174.419 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 33.0 pt -74.51 152.95 6.76 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.648 0 O-C-N 121.68 -0.638 . . . . 0.0 112.192 177.007 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -135.49 146.13 47.83 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 125.237 1.415 . . . . 0.0 109.864 174.522 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -65.0 -24.99 67.67 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.884 0.874 . . . . 0.0 112.125 177.397 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -68.02 -38.5 79.99 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.488 0 C-N-CA 125.905 1.682 . . . . 0.0 110.419 173.464 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 90.7 m -83.06 -43.67 16.04 Favored 'General case' 0 C--N 1.33 -0.25 0 O-C-N 121.661 -0.649 . . . . 0.0 109.668 -178.643 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 8.0 mt -60.44 -36.86 79.18 Favored 'General case' 0 N--CA 1.468 0.439 0 O-C-N 121.442 -0.786 . . . . 0.0 112.571 171.297 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.452 ' HA ' HG13 ' A' ' 66' ' ' ILE . 62.1 p -59.98 -24.69 64.64 Favored 'General case' 0 N--CA 1.477 0.921 0 CA-C-N 119.509 1.049 . . . . 0.0 112.669 175.938 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -103.13 -28.23 12.07 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 125.277 1.431 . . . . 0.0 114.246 -177.625 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 19.7 mmmt -64.31 -31.0 72.03 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.841 1.257 . . . . 0.0 112.775 176.889 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.3 mp -126.71 9.5 7.03 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 114.158 1.17 . . . . 0.0 114.158 -175.378 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 16.4 m-80 56.04 59.8 3.55 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 125.932 1.693 . . . . 0.0 113.222 -178.541 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.452 HG13 ' HA ' ' A' ' 61' ' ' SER . 1.1 pt -128.41 173.83 12.81 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 C-N-CA 126.747 2.019 . . . . 0.0 111.679 -173.986 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.2 p -77.17 158.16 30.53 Favored 'General case' 0 N--CA 1.477 0.905 0 O-C-N 120.998 -1.064 . . . . 0.0 111.054 173.931 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 87.6 t -63.69 -28.88 45.89 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.909 0 O-C-N 121.632 -0.667 . . . . 0.0 111.25 172.752 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -77.63 -37.83 49.27 Favored 'General case' 0 N--CA 1.47 0.551 0 O-C-N 120.711 -1.243 . . . . 0.0 110.19 -179.757 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 5.0 tmtm? -65.01 -48.52 73.62 Favored 'General case' 0 C--O 1.225 -0.227 0 C-N-CA 125.489 1.515 . . . . 0.0 110.402 176.423 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -59.61 -42.9 93.67 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 126.107 1.763 . . . . 0.0 113.213 172.808 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 36.3 ttmt -74.16 -29.37 61.75 Favored 'General case' 0 CA--C 1.516 -0.342 0 C-N-CA 124.477 1.111 . . . . 0.0 111.838 -175.958 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -50.5 -45.98 56.86 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 118.415 0.552 . . . . 0.0 110.405 176.837 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 35.6 m-85 -64.58 -39.17 93.25 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.75 0.82 . . . . 0.0 111.559 -176.453 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 20.2 mt -71.91 -28.07 29.23 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.623 0 C-N-CA 124.594 1.157 . . . . 0.0 110.955 -179.952 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 25.4 mmmt -76.98 -39.93 48.69 Favored 'General case' 0 N--CA 1.466 0.33 0 O-C-N 120.878 -1.138 . . . . 0.0 112.251 178.032 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 24.2 p30 . . . . . 0 N--CA 1.468 0.431 0 CA-C-N 119.123 0.874 . . . . 0.0 112.63 -174.771 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.476 0.858 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -132.17 43.07 3.06 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 125.092 1.357 . . . . 0.0 112.291 -179.911 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 7.2 p -152.37 142.83 15.38 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.442 0 C-N-CA 124.916 1.286 . . . . 0.0 111.321 -173.369 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 43.9 m 53.17 28.26 6.84 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 125.859 1.664 . . . . 0.0 115.361 177.618 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 35.4 t -153.57 -49.42 0.09 Allowed 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 124.916 1.286 . . . . 0.0 112.145 -179.029 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 78.1 mtm -131.16 69.08 1.48 Allowed 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 125.401 1.48 . . . . 0.0 110.556 178.648 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -77.1 74.7 3.67 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 124.836 1.255 . . . . 0.0 110.318 176.376 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 56.27 -170.98 0.08 Allowed 'General case' 0 CA--C 1.554 1.133 0 C-N-CA 126.479 1.912 . . . . 0.0 113.899 -167.887 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 98.4 mttt . . . . . 0 N--CA 1.478 0.97 0 C-N-CA 126.028 1.731 . . . . 0.0 111.712 178.757 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 98.8 mmm . . . . . 0 N--CA 1.47 0.531 0 CA-C-O 120.795 0.331 . . . . 0.0 111.437 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 22.2 m-20 -122.42 102.18 39.79 Favored Pre-proline 0 CA--C 1.547 0.834 0 C-N-CA 125.225 1.41 . . . . 0.0 111.008 177.902 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 65.1 Cg_endo -86.29 2.82 7.18 Favored 'Trans proline' 0 C--N 1.35 0.607 0 C-N-CA 123.66 2.906 . . . . 0.0 114.559 -179.336 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 84.6 mt -111.32 41.69 1.81 Allowed 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 125.449 1.5 . . . . 0.0 113.176 -171.575 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -110.02 1.02 18.72 Favored 'General case' 0 N--CA 1.48 1.031 0 N-CA-C 114.985 1.476 . . . . 0.0 114.985 176.572 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -117.13 -55.51 2.33 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 124.142 0.977 . . . . 0.0 113.418 -168.443 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.9 pp -129.22 12.23 2.61 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 C-N-CA 126.238 1.815 . . . . 0.0 112.996 -171.975 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 11.7 tt -41.98 126.81 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.908 0 C-N-CA 125.569 1.547 . . . . 0.0 113.794 -176.854 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 49.5 t30 -153.93 138.93 17.26 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.497 1.519 . . . . 0.0 110.516 165.515 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 33.5 t0 -152.59 62.07 0.81 Allowed 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.765 1.226 . . . . 0.0 110.204 171.509 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 86.8 mt 54.95 106.57 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.543 0 C-N-CA 128.363 2.665 . . . . 0.0 112.153 -162.013 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 11.6 mmpt? . . . . . 0 N--CA 1.48 1.075 0 C-N-CA 125.57 1.548 . . . . 0.0 113.438 175.611 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.1 mt . . . . . 0 CA--C 1.543 0.708 0 CA-C-O 120.328 0.109 . . . . 0.0 111.081 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 23.2 t -73.45 166.34 23.4 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.452 0.701 . . . . 0.0 110.768 169.015 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -56.98 -44.29 82.52 Favored 'General case' 0 N--CA 1.476 0.83 0 O-C-N 120.343 -1.473 . . . . 0.0 113.106 -174.732 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 6.7 pt20 -76.3 -35.88 58.63 Favored 'General case' 0 N--CA 1.47 0.542 0 O-C-N 121.642 -0.661 . . . . 0.0 112.233 175.028 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 92.7 mt-30 -65.35 -38.98 91.75 Favored 'General case' 0 N--CA 1.464 0.271 0 O-C-N 121.595 -0.69 . . . . 0.0 111.21 179.254 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 40.9 ttmt -58.87 -41.44 87.06 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 124.522 1.129 . . . . 0.0 110.814 175.569 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 42.5 mt -71.24 -41.21 74.85 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.638 0 CA-C-O 118.358 -0.829 . . . . 0.0 111.219 177.911 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 37.9 mt -65.15 -41.44 91.77 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.964 0 CA-C-N 120.166 1.348 . . . . 0.0 110.363 177.416 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -60.72 -48.45 81.72 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.541 1.137 . . . . 0.0 110.737 176.763 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -66.04 -50.21 64.96 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 124.472 1.109 . . . . 0.0 112.141 178.608 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -65.56 -22.65 66.72 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 119.222 0.919 . . . . 0.0 113.104 -176.185 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.437 ' CE2' HG22 ' A' ' 55' ' ' ILE . 1.2 t80 -71.58 -58.96 3.02 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.228 1.011 . . . . 0.0 110.834 173.075 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 86.8 mt -63.84 -33.06 59.61 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.451 0 C-N-CA 126.794 2.038 . . . . 0.0 111.598 -179.861 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -71.04 -24.75 62.41 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.076 0.951 . . . . 0.0 112.704 176.234 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -90.78 -38.81 12.76 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.199 0.999 . . . . 0.0 112.517 175.767 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.3 m -110.24 -3.41 10.54 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.111 0 N-CA-C 114.167 1.173 . . . . 0.0 114.167 -173.577 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 85.21 23.11 49.75 Favored Glycine 0 N--CA 1.473 1.112 0 C-N-CA 125.219 1.39 . . . . 0.0 115.457 159.326 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 56.87 6.9 0.35 Allowed 'General case' 0 CA--C 1.554 1.128 0 C-N-CA 127.577 2.351 . . . . 0.0 115.181 -170.335 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 29.2 mt-30 -104.71 -17.69 14.55 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 125.545 1.538 . . . . 0.0 112.977 -173.005 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 44.5 m-80 -123.98 4.17 8.68 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.396 1.078 . . . . 0.0 113.634 -173.543 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . 0.437 HG22 ' CE2' ' A' ' 46' ' ' TYR . 23.1 pt -75.28 155.26 6.22 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 C-N-CA 122.976 0.51 . . . . 0.0 111.291 173.377 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -137.62 142.85 41.23 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 124.487 1.115 . . . . 0.0 110.257 179.106 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -60.7 -27.45 67.89 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.741 0.816 . . . . 0.0 112.227 -179.867 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -65.93 -49.76 74.64 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.484 0 C-N-CA 125.606 1.562 . . . . 0.0 110.125 175.044 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 61.9 m -77.79 -43.41 30.73 Favored 'General case' 0 C--O 1.222 -0.387 0 C-N-CA 123.612 0.765 . . . . 0.0 109.962 -175.642 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 19.8 tp -61.39 -35.11 76.6 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 125.481 1.513 . . . . 0.0 112.171 174.322 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.459 ' HA ' HG13 ' A' ' 66' ' ' ILE . 30.3 t -54.96 -31.65 60.82 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 124.719 1.208 . . . . 0.0 112.513 168.501 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -100.57 -26.9 13.67 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 125.033 1.333 . . . . 0.0 114.162 -174.892 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 64.6 mmtt -61.44 -37.7 84.51 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 125.018 1.327 . . . . 0.0 111.773 174.974 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.2 mp -116.95 6.73 13.06 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 114.146 1.165 . . . . 0.0 114.146 -174.373 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 20.4 m-80 56.56 57.46 4.82 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 126.485 1.914 . . . . 0.0 113.23 -179.046 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.459 HG13 ' HA ' ' A' ' 61' ' ' SER . 1.6 pt -124.76 -170.93 0.67 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.693 0 C-N-CA 126.584 1.954 . . . . 0.0 110.917 -172.753 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.5 p -89.76 159.98 16.77 Favored 'General case' 0 N--CA 1.476 0.862 0 O-C-N 121.311 -0.868 . . . . 0.0 110.921 170.258 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 88.8 t -62.14 -30.18 48.2 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.893 0 C-N-CA 123.187 0.595 . . . . 0.0 111.307 172.641 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -79.73 -36.7 36.99 Favored 'General case' 0 N--CA 1.469 0.492 0 O-C-N 121.001 -1.062 . . . . 0.0 110.514 -179.055 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 4.6 tmtm? -68.08 -44.45 76.26 Favored 'General case' 0 C--O 1.222 -0.362 0 C-N-CA 124.421 1.088 . . . . 0.0 110.715 177.242 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -59.33 -46.87 87.42 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 125.046 1.338 . . . . 0.0 112.752 170.107 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 18.9 ttmm -67.67 -26.69 66.32 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 124.417 1.087 . . . . 0.0 111.523 -176.79 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -51.26 -42.14 60.86 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-N 118.171 0.441 . . . . 0.0 111.216 174.2 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 24.2 m-85 -70.39 -39.71 74.37 Favored 'General case' 0 C--O 1.225 -0.211 0 C-N-CA 124.479 1.111 . . . . 0.0 111.588 -177.474 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 52.6 mt -67.15 -24.79 32.58 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 C-N-CA 125.608 1.563 . . . . 0.0 111.185 179.292 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.428 ' HA ' ' HE2' ' A' ' 76' ' ' LYS . 10.6 mmpt? -95.23 -25.44 16.37 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 125.322 1.449 . . . . 0.0 113.177 178.46 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 42.6 m-20 . . . . . 0 N--CA 1.465 0.298 0 C-N-CA 125.305 1.442 . . . . 0.0 110.679 174.242 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 17.3 mm-40 . . . . . 0 N--CA 1.474 0.76 0 N-CA-C 114.083 1.142 . . . . 0.0 114.083 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -143.41 79.9 1.65 Allowed 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 124.579 1.152 . . . . 0.0 111.2 178.614 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 11.6 p -151.1 154.77 7.95 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.715 0 C-N-CA 125.71 1.604 . . . . 0.0 110.578 177.099 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 25.5 m 63.76 -39.42 0.2 Allowed 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 128.301 2.64 . . . . 0.0 116.909 -179.333 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 49.8 m -86.01 -19.56 30.16 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.738 1.215 . . . . 0.0 114.122 -177.547 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 13.5 ttt -144.57 28.99 1.28 Allowed 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.986 1.315 . . . . 0.0 112.458 -177.731 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -83.54 59.68 5.25 Favored 'General case' 0 CA--C 1.55 0.943 0 C-N-CA 124.881 1.273 . . . . 0.0 111.624 -174.75 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -152.02 165.1 35.71 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 125.841 1.656 . . . . 0.0 112.442 -177.628 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 36.4 mtmm . . . . . 0 N--CA 1.478 0.94 0 C-N-CA 125.848 1.659 . . . . 0.0 111.539 171.569 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 60.6 mtt . . . . . 0 N--CA 1.477 0.884 0 CA-C-O 121.418 0.628 . . . . 0.0 111.231 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -130.09 110.03 16.78 Favored Pre-proline 0 CA--C 1.55 0.949 0 C-N-CA 124.75 1.22 . . . . 0.0 111.79 -173.726 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 69.3 Cg_endo -85.28 -8.52 8.69 Favored 'Trans proline' 0 C--N 1.352 0.741 0 C-N-CA 123.51 2.807 . . . . 0.0 115.179 -176.609 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 96.6 mt -111.92 48.65 0.95 Allowed 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 126.261 1.825 . . . . 0.0 111.183 -177.757 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -118.29 1.52 11.86 Favored 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 114.26 1.208 . . . . 0.0 114.26 -179.836 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -119.12 -55.84 2.13 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 124.673 1.189 . . . . 0.0 112.879 -168.402 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.1 pp -128.98 14.32 2.72 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 C-N-CA 126.414 1.886 . . . . 0.0 112.762 -173.741 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 7.7 tt -46.54 105.31 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.1 0 C-N-CA 125.346 1.458 . . . . 0.0 112.4 179.79 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -154.71 -3.29 0.16 Allowed 'General case' 0 N--CA 1.478 0.929 0 N-CA-C 114.519 1.303 . . . . 0.0 114.519 -177.406 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -84.62 12.12 7.65 Favored 'General case' 0 CA--C 1.546 0.796 0 N-CA-C 115.157 1.54 . . . . 0.0 115.157 -162.383 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 7.1 tp -147.01 29.29 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 C-N-CA 125.73 1.612 . . . . 0.0 113.32 -173.707 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 2.3 tppp? . . . . . 0 N--CA 1.476 0.834 0 N-CA-C 114.824 1.416 . . . . 0.0 114.824 -179.085 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 49.7 mt . . . . . 0 CA--C 1.54 0.595 0 CA-C-O 120.537 0.208 . . . . 0.0 111.045 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 70.7 m -72.98 164.8 26.14 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 122.891 0.476 . . . . 0.0 110.255 169.794 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -55.21 -44.2 75.18 Favored 'General case' 0 N--CA 1.478 0.932 0 O-C-N 120.76 -1.213 . . . . 0.0 112.797 -176.261 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 12.8 tt0 -69.7 -42.92 73.41 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 123.552 0.741 . . . . 0.0 111.19 176.187 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 83.9 mt-30 -63.71 -39.0 93.2 Favored 'General case' 0 CA--C 1.536 0.42 0 O-C-N 121.659 -0.65 . . . . 0.0 112.12 179.183 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -61.21 -40.11 92.77 Favored 'General case' 0 N--CA 1.468 0.475 0 O-C-N 121.06 -1.025 . . . . 0.0 110.903 173.719 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 51.6 mt -69.62 -39.51 78.36 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 CA-C-O 117.789 -1.101 . . . . 0.0 111.704 175.817 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 47.3 mt -64.03 -43.28 97.53 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.947 0 CA-C-N 121.01 1.732 . . . . 0.0 110.285 176.814 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -59.5 -47.49 85.3 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.056 0.943 . . . . 0.0 110.885 176.795 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -69.44 -49.17 57.51 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 124.335 1.054 . . . . 0.0 112.86 -179.714 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -64.29 -23.14 67.19 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-N 118.91 0.777 . . . . 0.0 112.96 -176.646 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.445 ' CE2' HG22 ' A' ' 55' ' ' ILE . 1.4 t80 -69.4 -59.55 2.92 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 124.206 1.002 . . . . 0.0 110.72 174.309 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 50.5 mt -60.74 -34.28 58.37 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.436 0 C-N-CA 125.309 1.444 . . . . 0.0 111.492 176.95 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -67.07 -21.04 65.91 Favored 'General case' 0 CA--C 1.546 0.807 0 O-C-N 121.269 -0.895 . . . . 0.0 113.271 176.379 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -98.03 -31.27 12.23 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 124.748 1.219 . . . . 0.0 113.309 178.308 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 5.9 m -122.36 -19.21 4.36 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 N-CA-C 114.139 1.163 . . . . 0.0 114.139 -173.857 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 83.43 147.1 7.21 Favored Glycine 0 CA--C 1.532 1.096 0 C-N-CA 124.964 1.269 . . . . 0.0 112.864 -172.128 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 12.3 tp -61.63 -13.25 20.66 Favored 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 125.244 1.418 . . . . 0.0 113.81 -175.05 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 7.6 pt20 -87.8 -16.26 34.62 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 127.143 2.177 . . . . 0.0 114.134 179.437 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 76.1 m-80 -111.15 -11.66 14.22 Favored 'General case' 0 N--CA 1.476 0.858 0 N-CA-C 114.513 1.301 . . . . 0.0 114.513 -178.138 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . 0.445 HG22 ' CE2' ' A' ' 46' ' ' TYR . 43.8 pt -67.92 156.87 6.64 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.614 0 C-N-CA 123.83 0.852 . . . . 0.0 111.722 168.856 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.2 p -131.21 142.24 50.15 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 125.704 1.602 . . . . 0.0 109.645 174.215 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -63.17 -25.81 68.52 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 123.769 0.828 . . . . 0.0 112.27 177.573 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.9 mp -63.29 -49.61 82.31 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 C-N-CA 125.124 1.37 . . . . 0.0 109.601 173.055 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 97.2 m -75.26 -41.7 56.77 Favored 'General case' 0 C--O 1.224 -0.289 0 C-N-CA 123.929 0.892 . . . . 0.0 110.749 -177.846 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.9 tt -67.03 -32.63 73.97 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 124.627 1.171 . . . . 0.0 111.954 177.825 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.453 ' HA ' HG13 ' A' ' 66' ' ' ILE . 44.5 t -53.98 -33.33 56.73 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 124.791 1.236 . . . . 0.0 113.034 165.455 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -97.87 -22.79 16.16 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 125.071 1.348 . . . . 0.0 113.667 -175.166 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 7.9 mmtm -69.04 -37.95 78.86 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 124.792 1.237 . . . . 0.0 111.386 175.924 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.4 mp -107.52 -0.98 21.76 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 125.14 1.376 . . . . 0.0 114.057 -175.577 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 16.7 m-80 57.89 48.13 14.03 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 126.133 1.773 . . . . 0.0 112.603 -175.041 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.453 HG13 ' HA ' ' A' ' 61' ' ' SER . 15.3 pt -111.98 -159.19 0.14 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.632 0 C-N-CA 125.964 1.706 . . . . 0.0 110.992 -177.078 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 44.6 p -100.79 161.04 13.87 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 124.649 1.179 . . . . 0.0 111.323 168.084 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 59.6 t -61.59 -24.31 33.47 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 O-C-N 121.58 -0.7 . . . . 0.0 111.059 169.34 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -78.18 -37.02 46.73 Favored 'General case' 0 C--O 1.232 0.166 0 O-C-N 120.901 -1.124 . . . . 0.0 110.246 -178.15 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 33.5 mttm -64.71 -52.86 54.91 Favored 'General case' 0 C--N 1.347 0.498 0 CA-C-N 118.888 0.767 . . . . 0.0 110.568 167.395 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -58.99 -37.55 77.11 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.012 0.925 . . . . 0.0 112.773 -172.13 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 23.7 ttmm -77.57 -31.02 52.88 Favored 'General case' 0 CA--C 1.522 -0.123 0 C-N-CA 125.444 1.498 . . . . 0.0 111.889 177.777 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -57.09 -42.38 80.6 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 119.037 0.835 . . . . 0.0 111.531 179.596 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 39.3 m-85 -61.93 -51.5 67.88 Favored 'General case' 0 C--O 1.222 -0.389 0 C-N-CA 124.451 1.101 . . . . 0.0 109.641 178.481 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 71.3 mt -62.27 -25.07 36.69 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.875 0 C-N-CA 124.475 1.11 . . . . 0.0 111.517 -179.363 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 13.1 tppt? -87.48 -27.29 22.75 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 126.498 1.919 . . . . 0.0 113.28 -179.385 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 31.6 p30 . . . . . 0 CA--C 1.546 0.825 0 CA-C-N 119.897 1.226 . . . . 0.0 113.401 177.88 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 . . . . . 0 CA--C 1.541 0.623 0 CA-C-O 120.889 0.376 . . . . 0.0 110.302 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -133.62 65.22 1.59 Allowed 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 125.096 1.358 . . . . 0.0 111.307 -173.933 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 94.6 t -132.28 143.68 39.24 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.687 0 C-N-CA 125.061 1.344 . . . . 0.0 111.227 -179.569 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 82.8 p -147.4 -53.64 0.21 Allowed 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 173.138 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 22.6 t -149.99 113.32 4.93 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 124.634 1.173 . . . . 0.0 111.322 177.33 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 54.2 mtt 55.0 24.39 5.91 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 126.041 1.737 . . . . 0.0 115.145 -178.089 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 -82.62 67.48 8.69 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 125.33 1.452 . . . . 0.0 111.329 179.291 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -140.12 159.58 41.87 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 125.391 1.476 . . . . 0.0 112.6 -178.217 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 98.4 mttt . . . . . 0 N--CA 1.478 0.945 0 C-N-CA 125.92 1.688 . . . . 0.0 111.993 177.901 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.546 0.792 0 CA-C-O 122.37 1.081 . . . . 0.0 111.802 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 59.6 m-20 47.15 70.71 1.92 Allowed Pre-proline 0 CA--C 1.551 1.007 0 C-N-CA 127.006 2.122 . . . . 0.0 114.59 171.828 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 88.8 Cg_endo -69.35 0.39 5.4 Favored 'Trans proline' 0 CA--C 1.542 0.893 0 C-N-CA 124.21 3.274 . . . . 0.0 115.455 -173.634 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -134.93 33.14 3.17 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 126.408 1.883 . . . . 0.0 113.626 -178.65 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -99.58 -2.08 36.59 Favored 'General case' 0 N--CA 1.477 0.898 0 N-CA-C 114.407 1.262 . . . . 0.0 114.407 172.855 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -131.5 -60.78 0.93 Allowed 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 124.782 1.233 . . . . 0.0 113.458 -160.361 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.8 pp -106.45 9.66 9.35 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 C-N-CA 125.609 1.564 . . . . 0.0 112.937 -178.55 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 19.2 tt -46.11 129.06 2.45 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 124.632 1.173 . . . . 0.0 112.854 175.967 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -151.48 49.67 0.82 Allowed 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 125.683 1.593 . . . . 0.0 109.935 -179.646 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -115.71 15.56 16.46 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 124.347 1.059 . . . . 0.0 112.84 -170.378 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 15.9 tt -159.23 40.25 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 C-N-CA 126.692 1.997 . . . . 0.0 112.272 -175.815 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 87.0 tttt . . . . . 0 N--CA 1.476 0.85 0 N-CA-C 115.914 1.82 . . . . 0.0 115.914 -170.574 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 62.8 mt . . . . . 0 N--CA 1.471 0.616 0 CA-C-O 120.932 0.396 . . . . 0.0 112.015 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 66.0 m -71.33 164.3 26.01 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 123.295 0.638 . . . . 0.0 110.491 170.889 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -56.6 -44.72 81.4 Favored 'General case' 0 N--CA 1.477 0.901 0 O-C-N 120.633 -1.292 . . . . 0.0 112.974 -174.669 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 10.7 tt0 -68.82 -43.1 76.24 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 123.763 0.825 . . . . 0.0 110.989 175.752 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 85.0 mt-30 -61.13 -42.44 98.54 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 122.914 0.486 . . . . 0.0 111.968 178.349 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 40.1 ttmt -59.94 -39.07 84.26 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 124.073 0.949 . . . . 0.0 111.232 176.139 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 45.2 mt -68.26 -41.83 84.1 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 CA-C-O 118.121 -0.942 . . . . 0.0 111.386 174.386 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 48.3 mt -64.3 -44.66 97.32 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.982 0 CA-C-N 120.777 1.626 . . . . 0.0 110.48 178.555 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -56.02 -49.41 73.75 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 124.799 1.24 . . . . 0.0 110.195 176.54 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -65.52 -52.34 53.37 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.177 0.991 . . . . 0.0 113.024 178.185 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 19.6 mm-40 -62.24 -26.95 68.66 Favored 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 112.925 0.713 . . . . 0.0 112.925 -179.137 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -70.38 -55.28 9.48 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 123.576 0.751 . . . . 0.0 111.126 175.875 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 44.6 mt -60.57 -35.11 61.24 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.553 0 C-N-CA 124.958 1.303 . . . . 0.0 111.48 175.571 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -68.51 -21.46 64.58 Favored 'General case' 0 CA--C 1.545 0.765 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 176.761 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -95.92 -30.2 13.76 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.666 1.187 . . . . 0.0 113.029 178.963 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 6.0 m -122.27 -25.21 2.3 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.003 0 CA-C-N 119.651 1.114 . . . . 0.0 113.946 -173.966 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 94.07 142.38 12.19 Favored Glycine 0 CA--C 1.533 1.21 0 C-N-CA 125.303 1.43 . . . . 0.0 113.213 -172.694 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 55.0 tp -60.03 -16.85 34.43 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 127.046 2.139 . . . . 0.0 115.503 -171.879 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 7.9 pm0 -99.05 -10.15 22.97 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 127.732 2.413 . . . . 0.0 113.825 179.74 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 80.9 m-20 -107.18 -14.29 14.94 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.86 1.264 . . . . 0.0 114.111 178.907 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 26.5 pt -63.27 157.14 4.39 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 C-N-CA 123.267 0.627 . . . . 0.0 111.276 164.679 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -130.09 145.93 51.72 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.523 1.129 . . . . 0.0 110.035 175.28 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -61.73 -26.82 68.29 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 123.773 0.829 . . . . 0.0 112.271 177.288 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.9 mp -69.99 -40.08 78.18 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.454 0 C-N-CA 125.993 1.717 . . . . 0.0 110.519 175.857 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 90.8 m -80.78 -41.31 23.63 Favored 'General case' 0 C--O 1.223 -0.292 0 O-C-N 121.64 -0.663 . . . . 0.0 109.522 179.209 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 17.0 tp -64.77 -35.65 81.78 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 125.014 1.326 . . . . 0.0 111.946 177.026 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.441 ' HA ' HG13 ' A' ' 66' ' ' ILE . 60.2 p -60.38 -24.62 65.26 Favored 'General case' 0 N--CA 1.476 0.841 0 CA-C-N 118.893 0.77 . . . . 0.0 113.006 170.449 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -100.94 -31.03 11.32 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 125.3 1.44 . . . . 0.0 114.107 -177.119 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 54.9 mmtt -63.76 -34.51 78.06 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 125.331 1.452 . . . . 0.0 111.582 177.875 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.4 mp -117.67 4.23 12.33 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 124.987 1.315 . . . . 0.0 114.415 -175.165 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 21.6 m-80 57.58 60.96 2.62 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 126.276 1.831 . . . . 0.0 113.375 -178.591 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.441 HG13 ' HA ' ' A' ' 61' ' ' SER . 1.1 pt -133.48 174.8 12.64 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.843 0 C-N-CA 126.771 2.028 . . . . 0.0 111.946 -171.536 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.3 p -76.72 157.9 31.36 Favored 'General case' 0 N--CA 1.478 0.945 0 O-C-N 121.096 -1.003 . . . . 0.0 111.352 173.082 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 89.5 t -62.92 -28.47 45.09 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 CA-C-O 118.838 -0.601 . . . . 0.0 111.421 173.637 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 65.3 mm-40 -81.75 -36.62 28.34 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 120.307 1.412 . . . . 0.0 110.825 -178.872 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 5.2 tmtm? -62.6 -44.67 95.73 Favored 'General case' 0 N--CA 1.464 0.268 0 C-N-CA 125.456 1.503 . . . . 0.0 110.348 175.249 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -66.25 -48.74 69.51 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.989 1.716 . . . . 0.0 112.757 173.927 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -71.12 -27.95 63.95 Favored 'General case' 0 CA--C 1.515 -0.376 0 O-C-N 120.976 -1.077 . . . . 0.0 111.673 -173.388 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -60.59 -36.6 78.93 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 119.929 -0.708 . . . . 0.0 111.306 178.029 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 23.9 m-85 -61.28 -41.22 96.6 Favored 'General case' 0 N--CA 1.463 0.2 0 O-C-N 121.312 -0.867 . . . . 0.0 111.742 174.063 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 61.1 mt -70.44 -29.12 37.51 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.643 0 C-N-CA 124.683 1.193 . . . . 0.0 110.903 179.598 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 7.3 tptm -76.49 -35.16 58.54 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 125.169 1.388 . . . . 0.0 111.862 174.707 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 96.0 m-20 . . . . . 0 N--CA 1.462 0.153 0 C-N-CA 126.405 1.882 . . . . 0.0 110.338 -172.775 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 . . . . . 0 CA--C 1.543 0.701 0 N-CA-C 111.403 0.149 . . . . 0.0 111.403 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 54.18 65.82 1.4 Allowed 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 126.094 1.758 . . . . 0.0 113.594 -179.225 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 21.0 t -130.17 72.49 0.43 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 C-N-CA 125.166 1.387 . . . . 0.0 110.428 179.272 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 45.4 t -163.82 -68.32 0.04 OUTLIER 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.766 0.826 . . . . 0.0 113.013 172.638 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 17.1 t -74.05 -31.92 63.09 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 123.611 0.765 . . . . 0.0 112.786 -175.403 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 97.2 mtp -127.29 137.25 52.8 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 125.949 1.7 . . . . 0.0 109.556 169.524 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 17.7 tt0 -153.85 41.66 0.52 Allowed 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 124.616 1.166 . . . . 0.0 111.046 -177.317 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 52.41 -141.87 0.8 Allowed 'General case' 0 CA--C 1.552 1.045 0 C-N-CA 125.233 1.413 . . . . 0.0 112.253 -165.694 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 66.9 mttm . . . . . 0 N--CA 1.476 0.838 0 C-N-CA 125.777 1.631 . . . . 0.0 111.512 177.294 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 16.9 ttt . . . . . 0 CA--C 1.548 0.894 0 N-CA-C 112.716 0.636 . . . . 0.0 112.716 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 11.6 t0 -138.97 121.68 10.56 Favored Pre-proline 0 CA--C 1.55 0.981 0 O-C-N 120.626 -1.296 . . . . 0.0 112.344 -170.053 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_endo -83.83 -2.32 10.26 Favored 'Trans proline' 0 C--N 1.352 0.726 0 C-N-CA 123.768 2.979 . . . . 0.0 114.971 179.054 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 75.7 mt -107.54 41.59 1.48 Allowed 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.867 1.667 . . . . 0.0 112.173 -176.82 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -106.91 0.83 24.13 Favored 'General case' 0 N--CA 1.476 0.873 0 N-CA-C 114.779 1.4 . . . . 0.0 114.779 178.345 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -120.05 -56.87 1.98 Allowed 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 124.396 1.079 . . . . 0.0 113.328 -167.975 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.0 pp -129.1 14.7 2.67 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.925 0 C-N-CA 126.176 1.791 . . . . 0.0 112.988 -171.888 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 14.1 tt -41.08 130.4 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.917 0 C-N-CA 125.496 1.518 . . . . 0.0 112.851 177.824 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 35.3 t30 -141.71 0.63 1.45 Allowed 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 115.332 1.604 . . . . 0.0 115.332 -176.881 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -85.1 11.25 10.08 Favored 'General case' 0 CA--C 1.546 0.805 0 N-CA-C 114.601 1.334 . . . . 0.0 114.601 -173.777 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 13.5 tt -147.97 27.17 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.913 0 C-N-CA 125.533 1.533 . . . . 0.0 113.694 -170.989 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 58.5 mtmt . . . . . 0 N--CA 1.477 0.909 0 N-CA-C 115.311 1.597 . . . . 0.0 115.311 179.392 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.9 mt . . . . . 0 CA--C 1.545 0.751 0 N-CA-C 109.227 -0.657 . . . . 0.0 109.227 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 23.3 t -71.95 163.46 27.81 Favored 'General case' 0 N--CA 1.48 1.052 0 O-C-N 121.878 -0.514 . . . . 0.0 110.26 170.253 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -56.26 -45.48 80.05 Favored 'General case' 0 N--CA 1.477 0.924 0 O-C-N 120.257 -1.527 . . . . 0.0 112.863 -174.175 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 9.4 tt0 -71.18 -43.15 68.03 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 123.526 0.73 . . . . 0.0 111.553 175.675 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 89.3 mt-30 -61.29 -38.28 86.21 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 123.302 0.641 . . . . 0.0 111.885 178.587 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 41.2 ttmt -62.91 -44.23 96.65 Favored 'General case' 0 N--CA 1.464 0.249 0 C-N-CA 124.86 1.264 . . . . 0.0 110.731 175.732 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 49.8 mt -65.65 -43.97 93.7 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 CA-C-O 118.45 -0.786 . . . . 0.0 110.924 177.117 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 52.6 mt -63.97 -46.44 94.01 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 CA-C-N 120.078 1.308 . . . . 0.0 110.299 179.296 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -59.04 -48.9 79.91 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 125.14 1.376 . . . . 0.0 110.931 178.263 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -63.82 -53.04 56.98 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 124.954 1.301 . . . . 0.0 112.185 177.096 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 17.0 mm-40 -60.13 -30.45 69.3 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 119.088 0.858 . . . . 0.0 112.5 179.476 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.404 ' CD2' ' HE2' ' A' ' 63' ' ' LYS . 1.4 t80 -66.2 -58.83 4.53 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 118.988 0.813 . . . . 0.0 110.705 175.592 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 70.6 mt -62.72 -35.02 68.72 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.329 0 C-N-CA 126.573 1.949 . . . . 0.0 111.622 179.884 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -74.65 -29.42 61.25 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.05 0.94 . . . . 0.0 112.415 178.98 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -82.69 -40.0 21.23 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.778 0.831 . . . . 0.0 112.183 174.621 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.8 m -104.15 -12.55 9.15 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.086 0 N-CA-C 114.386 1.254 . . . . 0.0 114.386 -173.612 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 91.59 27.85 16.16 Favored Glycine 0 CA--C 1.534 1.253 0 C-N-CA 125.108 1.337 . . . . 0.0 115.805 164.589 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 56.13 9.08 0.45 Allowed 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 127.427 2.291 . . . . 0.0 115.027 -173.9 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 2.5 pt20 -117.92 -7.96 10.84 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 125.798 1.639 . . . . 0.0 113.435 -167.087 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 67.3 m-80 -123.28 -1.4 8.68 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 125.094 1.358 . . . . 0.0 113.305 178.339 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 21.7 pt -72.16 150.39 8.7 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 CA-C-O 121.016 0.436 . . . . 0.0 111.417 177.734 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -138.04 143.61 40.62 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 124.448 1.099 . . . . 0.0 109.398 177.687 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -61.39 -26.62 67.97 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 118.787 0.722 . . . . 0.0 112.468 -179.418 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -66.96 -42.99 89.48 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 C-N-CA 125.654 1.582 . . . . 0.0 110.548 174.601 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 81.6 m -79.77 -46.46 16.94 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 123.681 0.793 . . . . 0.0 109.192 -177.466 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 17.3 tp -62.59 -34.69 77.5 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.561 1.544 . . . . 0.0 112.511 177.563 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.455 ' HA ' HG13 ' A' ' 66' ' ' ILE . 60.2 p -61.95 -25.2 67.46 Favored 'General case' 0 N--CA 1.475 0.81 0 N-CA-C 113.222 0.823 . . . . 0.0 113.222 171.667 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -101.55 -24.67 14.1 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 125.434 1.493 . . . . 0.0 114.115 -178.112 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.404 ' HE2' ' CD2' ' A' ' 46' ' ' TYR . 21.0 mmmt -65.74 -34.87 79.19 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.9 1.28 . . . . 0.0 111.497 172.82 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 49.6 mt -115.91 -1.1 12.64 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 125.931 1.692 . . . . 0.0 113.52 -169.319 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 26.7 m-80 57.0 61.63 2.52 Favored 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 126.683 1.993 . . . . 0.0 113.542 -177.342 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.455 HG13 ' HA ' ' A' ' 61' ' ' SER . 0.6 OUTLIER -136.17 178.18 5.4 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 C-N-CA 127.118 2.167 . . . . 0.0 111.548 -171.838 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -78.25 159.13 28.67 Favored 'General case' 0 N--CA 1.478 0.975 0 O-C-N 121.047 -1.033 . . . . 0.0 111.392 172.266 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 98.6 t -63.49 -31.44 52.91 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.955 0 O-C-N 121.605 -0.685 . . . . 0.0 111.187 172.808 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -78.4 -35.95 46.44 Favored 'General case' 0 N--CA 1.471 0.584 0 O-C-N 120.895 -1.128 . . . . 0.0 110.065 -177.353 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 5.4 tmtm? -65.24 -49.96 67.65 Favored 'General case' 0 C--O 1.223 -0.292 0 C-N-CA 125.316 1.447 . . . . 0.0 110.379 174.255 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -58.53 -42.9 88.81 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 125.036 1.334 . . . . 0.0 112.605 174.23 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 34.5 ttmt -71.73 -28.13 63.46 Favored 'General case' 0 CA--C 1.519 -0.219 0 CA-C-O 118.076 -0.964 . . . . 0.0 111.577 -176.586 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -50.58 -44.6 56.89 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 118.973 0.806 . . . . 0.0 111.145 175.849 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 40.3 m-85 -65.54 -38.1 88.63 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.815 0.846 . . . . 0.0 110.782 -177.191 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 35.5 mt -69.39 -27.63 35.13 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.674 0 C-N-CA 124.916 1.286 . . . . 0.0 110.724 176.967 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 45.1 mttt -79.11 -31.88 44.35 Favored 'General case' 0 N--CA 1.47 0.563 0 O-C-N 120.393 -1.442 . . . . 0.0 114.553 176.51 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 24.7 p30 . . . . . 0 N--CA 1.471 0.625 0 CA-C-N 119.844 1.202 . . . . 0.0 112.351 -176.155 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 2.7 pp20? . . . . . 0 N--CA 1.474 0.774 0 N-CA-C 112.234 0.457 . . . . 0.0 112.234 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -147.12 57.12 1.14 Allowed 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 124.155 0.982 . . . . 0.0 111.939 175.617 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 26.5 t -134.87 133.54 53.85 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.94 0 C-N-CA 124.126 0.97 . . . . 0.0 112.14 -179.361 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 9.2 t -114.38 78.37 1.15 Allowed 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 125.015 1.326 . . . . 0.0 111.294 177.025 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 6.1 t 47.37 74.52 0.16 Allowed 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 126.848 2.059 . . . . 0.0 114.364 175.821 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 91.4 mtp 54.21 61.74 2.9 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 125.743 1.617 . . . . 0.0 113.485 -176.032 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -79.05 47.31 0.76 Allowed 'General case' 0 CA--C 1.553 1.07 0 C-N-CA 125.126 1.371 . . . . 0.0 112.037 174.808 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -147.74 155.73 42.01 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 126.165 1.786 . . . . 0.0 112.02 -176.213 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 36.6 mtmm . . . . . 0 N--CA 1.475 0.819 0 C-N-CA 125.397 1.479 . . . . 0.0 111.002 -176.976 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 83.6 mtp . . . . . 0 N--CA 1.475 0.803 0 CA-C-O 121.749 0.785 . . . . 0.0 111.175 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -119.99 148.25 46.31 Favored Pre-proline 0 CA--C 1.545 0.758 0 C-N-CA 125.552 1.541 . . . . 0.0 112.194 -170.852 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -69.24 -19.08 39.08 Favored 'Trans proline' 0 C--N 1.35 0.632 0 C-N-CA 123.284 2.656 . . . . 0.0 114.745 -175.04 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.44 HD23 ' H ' ' A' ' 4' ' ' LEU . 1.2 pt? -95.11 12.41 28.77 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 126.271 1.828 . . . . 0.0 114.343 -179.585 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -71.05 -8.04 50.62 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 115.189 1.551 . . . . 0.0 115.189 -176.809 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -116.72 -63.31 1.46 Allowed 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 124.796 1.238 . . . . 0.0 113.243 -163.631 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.3 pp -103.15 -18.09 6.79 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.85 0 C-N-CA 124.72 1.208 . . . . 0.0 113.053 -175.875 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . 0.287 11.3 tt 35.99 48.81 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.167 0 C-N-CA 127.301 2.24 . . . . 0.0 116.332 170.903 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -126.33 88.9 2.92 Favored 'General case' 0 CA--C 1.542 0.658 0 O-C-N 120.844 -1.16 . . . . 0.0 111.911 -177.136 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -138.17 79.98 1.77 Allowed 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.84 1.256 . . . . 0.0 110.813 -178.707 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . 0.358 9.5 tt 50.31 26.23 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.205 0 C-N-CA 127.708 2.403 . . . . 0.0 115.124 179.458 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 3.8 ttpt . . . . . 0 N--CA 1.473 0.679 0 C-N-CA 124.949 1.299 . . . . 0.0 114.462 -178.316 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.4 mt . . . . . 0 CA--C 1.544 0.723 0 N-CA-C 109.898 -0.408 . . . . 0.0 109.898 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 67.1 m -74.3 165.09 25.77 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 123.199 0.6 . . . . 0.0 110.829 171.925 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -55.06 -43.99 74.35 Favored 'General case' 0 N--CA 1.48 1.037 0 O-C-N 120.665 -1.272 . . . . 0.0 113.54 -172.983 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 8.5 pt20 -77.82 -35.21 51.5 Favored 'General case' 0 N--CA 1.472 0.625 0 O-C-N 121.56 -0.713 . . . . 0.0 112.547 174.802 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 84.6 mt-30 -65.17 -38.47 90.63 Favored 'General case' 0 N--CA 1.466 0.369 0 O-C-N 121.616 -0.678 . . . . 0.0 111.397 178.961 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 23.4 ttmm -58.99 -42.34 89.78 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 124.555 1.142 . . . . 0.0 110.879 175.173 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 41.0 mt -71.01 -42.3 76.86 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.557 0 CA-C-O 118.265 -0.874 . . . . 0.0 110.977 178.818 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 43.3 mt -63.13 -44.34 99.38 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 CA-C-N 120.412 1.46 . . . . 0.0 110.215 177.246 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -59.0 -49.11 79.15 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 125.12 1.368 . . . . 0.0 110.897 178.069 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -63.25 -52.83 60.51 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 124.858 1.263 . . . . 0.0 112.435 176.374 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -58.52 -31.48 67.94 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-N 119.28 0.945 . . . . 0.0 112.771 179.205 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.432 ' CE2' HG22 ' A' ' 55' ' ' ILE . 1.2 t80 -66.83 -58.44 5.04 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 118.794 0.725 . . . . 0.0 110.593 177.296 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 72.3 mt -65.82 -33.48 63.89 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.442 0 C-N-CA 126.323 1.849 . . . . 0.0 111.615 -178.638 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -72.41 -26.83 62.01 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 123.693 0.797 . . . . 0.0 112.294 177.733 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -86.21 -40.88 15.14 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.039 0.935 . . . . 0.0 112.096 174.939 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.2 m -108.4 -5.57 10.7 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.241 0 N-CA-C 114.552 1.315 . . . . 0.0 114.552 -171.918 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 86.72 26.94 30.76 Favored Glycine 0 CA--C 1.532 1.1 0 C-N-CA 124.711 1.148 . . . . 0.0 115.519 160.543 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 55.99 10.11 0.55 Allowed 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 127.479 2.312 . . . . 0.0 115.322 -173.991 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 5.1 pt20 -123.18 -3.7 8.49 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 124.946 1.298 . . . . 0.0 113.694 -168.948 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 58.8 m-80 -122.43 0.88 9.52 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 124.995 1.318 . . . . 0.0 113.191 174.638 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . 0.432 HG22 ' CE2' ' A' ' 46' ' ' TYR . 18.0 pt -76.97 154.25 5.59 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 C-N-CA 123.039 0.535 . . . . 0.0 111.593 175.963 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -139.82 143.65 36.93 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 124.805 1.242 . . . . 0.0 109.634 179.623 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -60.65 -27.09 67.54 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 118.871 0.76 . . . . 0.0 112.379 179.698 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -67.14 -48.45 78.71 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.463 0 C-N-CA 125.644 1.577 . . . . 0.0 110.194 175.574 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 76.9 m -78.33 -43.65 27.25 Favored 'General case' 0 C--O 1.224 -0.257 0 C-N-CA 123.477 0.711 . . . . 0.0 109.97 -176.659 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 18.6 tp -60.17 -34.58 73.78 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 125.375 1.47 . . . . 0.0 112.082 173.713 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.55 ' HA ' HG13 ' A' ' 66' ' ' ILE . 35.1 t -52.92 -36.14 59.24 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 124.363 1.065 . . . . 0.0 112.571 168.527 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -100.66 -22.82 14.8 Favored 'General case' 0 CA--C 1.533 0.299 0 N-CA-C 114.405 1.261 . . . . 0.0 114.405 -173.088 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 66.6 mmtt -63.99 -34.64 78.46 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 124.721 1.208 . . . . 0.0 111.947 174.953 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.5 mp -117.72 2.67 12.29 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 124.866 1.266 . . . . 0.0 114.076 -174.781 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 12.9 m-80 56.57 46.4 20.52 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 125.613 1.565 . . . . 0.0 112.763 -172.917 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.55 HG13 ' HA ' ' A' ' 61' ' ' SER . 9.9 pt -105.15 -171.99 0.36 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.619 0 C-N-CA 125.913 1.685 . . . . 0.0 111.11 -179.953 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -89.33 158.16 17.91 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 123.523 0.729 . . . . 0.0 110.41 170.081 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 49.7 t -59.1 -31.23 45.41 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.119 0 O-C-N 121.595 -0.69 . . . . 0.0 111.422 170.059 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -80.41 -35.95 34.44 Favored 'General case' 0 CA--C 1.53 0.211 0 O-C-N 121.139 -0.976 . . . . 0.0 110.184 -177.111 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 26.0 tttt -65.97 -44.71 84.14 Favored 'General case' 0 C--N 1.344 0.341 0 C-N-CA 123.393 0.677 . . . . 0.0 110.731 174.06 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -58.51 -49.56 76.95 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.673 1.589 . . . . 0.0 112.35 173.923 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 35.0 ttmt -68.88 -30.0 68.41 Favored 'General case' 0 N--CA 1.463 0.18 0 O-C-N 121.11 -0.994 . . . . 0.0 111.195 -177.152 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -56.15 -37.28 69.29 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 122.97 0.508 . . . . 0.0 112.362 175.311 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 48.6 m-85 -68.55 -45.13 72.96 Favored 'General case' 0 N--CA 1.463 0.218 0 C-N-CA 125.482 1.513 . . . . 0.0 110.609 176.092 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 79.7 mt -64.33 -31.53 53.88 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 C-N-CA 124.961 1.304 . . . . 0.0 111.35 -179.535 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 47.9 mtmt -81.81 -33.65 30.66 Favored 'General case' 0 N--CA 1.469 0.521 0 N-CA-C 113.875 1.065 . . . . 0.0 113.875 -178.188 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 5.7 p30 . . . . . 0 N--CA 1.465 0.322 0 CA-C-N 119.417 1.008 . . . . 0.0 111.31 173.944 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 . . . . . 0 CA--C 1.543 0.699 0 N-CA-C 112.331 0.493 . . . . 0.0 112.331 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 57.91 49.98 11.07 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 125.498 1.519 . . . . 0.0 114.41 179.671 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 45.3 t -130.27 137.52 56.14 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.743 0 C-N-CA 125.383 1.473 . . . . 0.0 110.546 176.066 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 13.7 t -136.81 -44.13 0.58 Allowed 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 123.829 0.851 . . . . 0.0 113.131 174.71 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 21.1 t -147.42 103.36 3.55 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.048 0.939 . . . . 0.0 111.826 175.101 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 24.8 mmt 52.13 31.92 9.73 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 126.04 1.736 . . . . 0.0 114.8 178.99 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 11.7 mt-10 -83.4 48.68 1.44 Allowed 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 125.657 1.583 . . . . 0.0 113.221 -176.227 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -119.23 155.44 31.71 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 126.642 1.977 . . . . 0.0 111.787 177.35 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 8.8 mptt . . . . . 0 N--CA 1.477 0.896 0 C-N-CA 125.091 1.357 . . . . 0.0 110.667 -178.963 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 77.6 mtm . . . . . 0 N--CA 1.474 0.77 0 CA-C-O 121.308 0.575 . . . . 0.0 112.184 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -128.84 75.04 80.49 Favored Pre-proline 0 CA--C 1.551 0.986 0 C-N-CA 124.981 1.312 . . . . 0.0 112.049 176.79 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 80.3 Cg_endo -78.9 -3.83 13.51 Favored 'Trans proline' 0 C--N 1.352 0.735 0 C-N-CA 123.973 3.115 . . . . 0.0 114.909 -179.834 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 94.1 mt -108.76 41.34 1.61 Allowed 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 126.279 1.832 . . . . 0.0 112.167 -177.261 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -107.14 -5.04 18.24 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 114.472 1.286 . . . . 0.0 114.472 178.035 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.21 -58.29 2.15 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 124.296 1.038 . . . . 0.0 113.027 -162.508 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.1 pp -129.04 15.11 2.69 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 C-N-CA 126.615 1.966 . . . . 0.0 112.713 -174.981 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 10.2 tt -41.55 124.35 0.49 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.995 0 C-N-CA 125.413 1.485 . . . . 0.0 112.488 177.121 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -147.11 29.87 0.96 Allowed 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 124.027 0.931 . . . . 0.0 112.996 -175.113 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -106.19 11.57 31.1 Favored 'General case' 0 N--CA 1.476 0.841 0 O-C-N 120.899 -1.126 . . . . 0.0 113.553 -179.321 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 15.5 tt -150.13 36.78 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.477 0.876 0 C-N-CA 126.509 1.924 . . . . 0.0 111.799 -175.343 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 2.9 tppt? . . . . . 0 N--CA 1.478 0.935 0 N-CA-C 115.309 1.596 . . . . 0.0 115.309 -176.175 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 6.9 mt . . . . . 0 CA--C 1.543 0.699 0 CA-C-O 120.303 0.097 . . . . 0.0 110.796 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 63.4 m -75.88 165.09 25.51 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 123.302 0.641 . . . . 0.0 110.528 171.628 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -55.15 -44.46 75.15 Favored 'General case' 0 N--CA 1.48 1.042 0 O-C-N 120.72 -1.237 . . . . 0.0 113.472 -173.526 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 8.9 pt20 -75.35 -36.64 60.95 Favored 'General case' 0 N--CA 1.469 0.51 0 O-C-N 121.601 -0.687 . . . . 0.0 112.486 175.306 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 76.4 mt-30 -65.75 -36.92 84.94 Favored 'General case' 0 N--CA 1.466 0.341 0 O-C-N 121.508 -0.745 . . . . 0.0 111.595 178.9 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 40.3 ttmt -61.59 -42.17 98.49 Favored 'General case' 0 N--CA 1.465 0.307 0 C-N-CA 124.405 1.082 . . . . 0.0 111.008 174.99 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 46.2 mt -69.03 -43.14 82.15 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 CA-C-O 118.449 -0.786 . . . . 0.0 111.045 176.732 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 44.0 mt -63.01 -44.25 99.54 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 CA-C-N 120.167 1.349 . . . . 0.0 110.343 178.73 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -59.53 -49.07 79.22 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.9 1.28 . . . . 0.0 110.794 176.586 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -67.42 -51.46 51.44 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 124.364 1.065 . . . . 0.0 112.799 -179.369 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 18.9 mm-40 -61.9 -24.12 66.75 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 118.968 0.804 . . . . 0.0 113.162 -178.385 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.502 ' CE2' HG22 ' A' ' 55' ' ' ILE . 1.4 t80 -70.29 -60.17 2.44 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 123.891 0.876 . . . . 0.0 110.841 174.031 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 64.7 mt -59.72 -35.15 58.24 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 C-N-CA 127.003 2.121 . . . . 0.0 111.762 177.846 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -70.86 -22.57 62.28 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 123.969 0.908 . . . . 0.0 113.116 178.143 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -94.9 -32.19 13.33 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.472 1.109 . . . . 0.0 112.731 178.013 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 4.5 m -118.57 -20.61 5.05 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.916 0 CA-C-N 119.552 1.069 . . . . 0.0 113.731 -173.461 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 83.2 141.98 4.54 Favored Glycine 0 CA--C 1.531 1.061 0 C-N-CA 124.787 1.184 . . . . 0.0 112.33 -171.312 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -66.83 -9.96 42.92 Favored 'General case' 0 N--CA 1.479 0.994 0 CA-C-O 122.721 1.248 . . . . 0.0 113.93 -171.485 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 5.6 pt20 -84.96 -11.74 54.85 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 126.268 1.827 . . . . 0.0 113.854 174.753 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 73.4 m-80 -114.35 -9.4 12.79 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 114.585 1.328 . . . . 0.0 114.585 -177.877 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . 0.502 HG22 ' CE2' ' A' ' 46' ' ' TYR . 21.8 pt -71.43 159.98 5.46 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 C-N-CA 123.574 0.749 . . . . 0.0 111.608 168.684 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.1 p -129.22 144.37 51.19 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 125.149 1.379 . . . . 0.0 110.014 173.805 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -63.9 -26.14 68.46 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.933 0.893 . . . . 0.0 112.169 175.875 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -63.49 -49.26 83.37 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.459 0 C-N-CA 125.291 1.436 . . . . 0.0 109.48 173.099 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 99.2 m -75.14 -43.02 54.89 Favored 'General case' 0 C--O 1.223 -0.309 0 C-N-CA 123.538 0.735 . . . . 0.0 110.156 -178.248 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 17.3 tp -62.22 -35.13 77.95 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.469 1.108 . . . . 0.0 112.093 176.23 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.47 ' HA ' HG13 ' A' ' 66' ' ' ILE . 47.2 t -53.79 -32.5 52.79 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.367 1.067 . . . . 0.0 113.015 168.349 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -100.74 -23.55 14.59 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 125.621 1.568 . . . . 0.0 114.008 -174.137 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 67.1 mmtt -66.05 -37.58 86.19 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 124.858 1.263 . . . . 0.0 111.343 173.977 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.3 mp -114.21 1.38 14.51 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 125.092 1.357 . . . . 0.0 114.256 -172.819 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 12.7 m-80 57.21 46.36 18.89 Favored 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 125.712 1.605 . . . . 0.0 112.868 -175.155 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.47 HG13 ' HA ' ' A' ' 61' ' ' SER . 7.0 pt -106.39 -166.42 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 C-N-CA 125.974 1.709 . . . . 0.0 111.537 -178.992 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -94.5 159.41 15.11 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 123.9 0.88 . . . . 0.0 110.491 167.644 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 93.8 t -60.39 -30.1 45.66 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 O-C-N 121.563 -0.711 . . . . 0.0 111.241 172.22 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -82.68 -32.52 28.06 Favored 'General case' 0 N--CA 1.465 0.287 0 O-C-N 121.049 -1.032 . . . . 0.0 110.567 -178.194 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 15.2 tttt -70.19 -41.59 73.52 Favored 'General case' 0 C--N 1.343 0.326 0 C-N-CA 123.313 0.645 . . . . 0.0 110.855 174.502 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -60.78 -47.33 86.8 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 125.56 1.544 . . . . 0.0 112.355 171.531 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 36.7 ttmt -72.78 -28.04 62.36 Favored 'General case' 0 CA--C 1.517 -0.296 0 CA-C-O 118.004 -0.998 . . . . 0.0 111.298 -173.519 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -49.72 -47.24 50.69 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 118.833 0.742 . . . . 0.0 110.408 174.272 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 18.9 m-85 -63.56 -43.19 97.75 Favored 'General case' 0 C--O 1.223 -0.326 0 C-N-CA 123.491 0.716 . . . . 0.0 110.43 -175.593 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 48.4 mt -67.92 -28.39 41.15 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.675 0 C-N-CA 125.435 1.494 . . . . 0.0 111.637 -178.773 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 28.4 mmmt -80.46 -23.41 40.23 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 125.423 1.489 . . . . 0.0 112.369 174.941 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 90.2 m-20 . . . . . 0 C--O 1.234 0.244 0 C-N-CA 126.326 1.85 . . . . 0.0 111.609 -173.502 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 . . . . . 0 CA--C 1.542 0.671 0 N-CA-C 110.018 -0.364 . . . . 0.0 110.018 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -133.6 122.41 23.48 Favored 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 124.694 1.197 . . . . 0.0 110.721 -176.336 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 60.6 t -134.21 108.7 11.52 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.469 0 C-N-CA 125.375 1.47 . . . . 0.0 109.712 178.749 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 32.2 t -162.99 -79.32 0.04 OUTLIER 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 123.757 0.823 . . . . 0.0 112.126 169.014 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 42.9 m -95.3 -27.54 15.43 Favored 'General case' 0 N--CA 1.478 0.948 0 N-CA-C 114.079 1.14 . . . . 0.0 114.079 -172.588 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 65.6 mtt -137.57 110.41 7.65 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 125.419 1.488 . . . . 0.0 109.658 -179.69 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -144.52 85.98 1.8 Allowed 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 124.768 1.227 . . . . 0.0 109.145 -179.693 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -153.29 161.71 42.08 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 124.884 1.273 . . . . 0.0 112.566 -178.437 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 52.3 mmtt . . . . . 0 N--CA 1.481 1.086 0 C-N-CA 125.75 1.62 . . . . 0.0 111.88 174.24 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 33.9 ttm . . . . . 0 CA--C 1.547 0.859 0 CA-C-O 121.349 0.595 . . . . 0.0 112.518 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 15.6 m-20 -126.96 156.23 74.47 Favored Pre-proline 0 CA--C 1.548 0.872 0 C-N-CA 125.691 1.597 . . . . 0.0 111.945 -177.001 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 91.7 Cg_endo -74.29 -0.25 9.4 Favored 'Trans proline' 0 CA--C 1.538 0.688 0 C-N-CA 123.468 2.778 . . . . 0.0 114.601 179.969 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 95.0 mt -117.28 36.69 4.14 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 125.878 1.671 . . . . 0.0 112.998 -175.296 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 27.9 m-20 -103.84 2.62 32.92 Favored 'General case' 0 N--CA 1.477 0.898 0 N-CA-C 114.301 1.223 . . . . 0.0 114.301 173.36 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -119.92 -57.17 1.97 Allowed 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 124.398 1.079 . . . . 0.0 113.525 -164.502 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.1 pp -131.36 16.39 1.87 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.94 0 C-N-CA 126.144 1.778 . . . . 0.0 112.869 -172.534 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 15.5 tt -42.03 -39.08 0.76 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.284 0 C-N-CA 126.156 1.782 . . . . 0.0 115.772 -177.164 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 15.9 m120 -121.54 108.38 13.54 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 125.514 1.526 . . . . 0.0 110.497 177.594 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 29.2 t0 -165.38 62.91 0.12 Allowed 'General case' 0 CA--C 1.533 0.29 0 CA-C-O 122.352 1.072 . . . . 0.0 110.655 -168.582 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 29.5 mt 50.08 59.36 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.742 0 C-N-CA 125.931 1.693 . . . . 0.0 110.626 -169.097 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.474 0.747 0 CA-C-N 114.62 -1.173 . . . . 0.0 112.064 -179.814 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 5.2 mt . . . . . 0 CA--C 1.544 0.717 0 CA-C-O 120.587 0.232 . . . . 0.0 111.104 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 18.3 t -73.57 165.89 24.25 Favored 'General case' 0 N--CA 1.479 0.99 0 O-C-N 121.965 -0.459 . . . . 0.0 110.396 167.54 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -59.57 -43.18 93.68 Favored 'General case' 0 CA--C 1.542 0.656 0 O-C-N 120.461 -1.399 . . . . 0.0 112.824 -173.724 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 10.2 tt0 -73.47 -41.88 62.6 Favored 'General case' 0 N--CA 1.469 0.524 0 O-C-N 121.299 -0.875 . . . . 0.0 111.43 175.743 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 30.4 mm-40 -57.06 -43.42 82.02 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 123.894 0.877 . . . . 0.0 111.032 176.637 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 40.8 ttmt -60.14 -42.31 94.57 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 124.981 1.313 . . . . 0.0 111.651 176.733 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 47.1 mt -68.88 -40.87 81.73 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 CA-C-O 118.413 -0.803 . . . . 0.0 111.053 177.535 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 43.6 mt -63.91 -44.22 97.95 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.933 0 CA-C-N 120.307 1.412 . . . . 0.0 110.385 177.705 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -59.22 -50.07 75.44 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.681 1.193 . . . . 0.0 110.396 176.105 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -65.68 -50.68 64.04 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.346 1.058 . . . . 0.0 112.93 -179.576 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.8 mm-40 -60.89 -24.38 65.92 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 118.997 0.817 . . . . 0.0 113.13 -179.145 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.435 ' CE2' HG22 ' A' ' 55' ' ' ILE . 1.7 t80 -73.23 -58.17 3.5 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 123.714 0.806 . . . . 0.0 111.31 175.865 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 15.3 mt -59.91 -33.79 53.91 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.583 0 C-N-CA 125.903 1.681 . . . . 0.0 111.629 175.815 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -69.78 -22.4 63.34 Favored 'General case' 0 CA--C 1.545 0.771 0 O-C-N 121.267 -0.895 . . . . 0.0 113.293 175.372 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -93.76 -32.96 13.78 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 124.526 1.13 . . . . 0.0 112.732 178.539 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 10.5 m -120.15 -19.68 5.04 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.911 0 N-CA-C 114.005 1.113 . . . . 0.0 114.005 -174.094 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 83.58 142.56 5.02 Favored Glycine 0 CA--C 1.531 1.052 0 C-N-CA 124.802 1.192 . . . . 0.0 112.145 -171.486 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 2.2 tt -65.48 -11.19 40.94 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 114.928 1.455 . . . . 0.0 114.928 -170.219 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 38.8 mt-30 -80.18 -20.69 44.19 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.672 1.589 . . . . 0.0 112.921 174.813 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 69.5 m-80 -109.63 -7.07 15.16 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 114.4 1.259 . . . . 0.0 114.4 -171.793 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . 0.435 HG22 ' CE2' ' A' ' 46' ' ' TYR . 16.5 pt -71.85 160.67 5.15 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 C-N-CA 123.676 0.791 . . . . 0.0 111.492 166.689 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.1 p -130.81 144.77 51.69 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 125.357 1.463 . . . . 0.0 109.991 173.923 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -62.98 -27.83 69.68 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 123.935 0.894 . . . . 0.0 112.239 176.679 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -62.83 -52.04 64.44 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.313 0 C-N-CA 125.41 1.484 . . . . 0.0 109.144 174.043 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 58.6 m -73.83 -42.89 60.22 Favored 'General case' 0 C--O 1.223 -0.303 0 C-N-CA 123.357 0.663 . . . . 0.0 110.442 -177.968 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 18.4 tp -59.79 -35.31 74.41 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.413 1.085 . . . . 0.0 111.996 174.819 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.489 ' HA ' HG13 ' A' ' 66' ' ' ILE . 47.7 t -55.39 -34.37 64.3 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 124.132 0.973 . . . . 0.0 113.124 170.156 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.1 -22.41 16.24 Favored 'General case' 0 CA--C 1.534 0.362 0 N-CA-C 114.533 1.308 . . . . 0.0 114.533 -177.448 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 68.0 mmtt -64.1 -38.44 91.06 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 119.508 1.049 . . . . 0.0 111.154 173.744 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.2 mp -112.34 -0.2 15.48 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 125.315 1.446 . . . . 0.0 114.363 -173.162 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 48.8 m-80 54.39 47.84 21.99 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 125.459 1.504 . . . . 0.0 112.84 -172.569 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.489 HG13 ' HA ' ' A' ' 61' ' ' SER . 8.2 pt -104.35 -162.63 0.14 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.766 0 C-N-CA 126.456 1.902 . . . . 0.0 110.849 178.72 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -100.2 159.22 15.28 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 124.364 1.066 . . . . 0.0 110.4 167.701 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 67.7 t -60.96 -29.18 45.06 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.958 0 O-C-N 121.634 -0.666 . . . . 0.0 111.26 172.425 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 85.6 mt-10 -80.16 -34.11 37.88 Favored 'General case' 0 N--CA 1.466 0.357 0 O-C-N 120.953 -1.092 . . . . 0.0 110.092 -178.766 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 13.5 tttp -69.7 -44.38 70.52 Favored 'General case' 0 C--N 1.345 0.378 0 C-N-CA 124.287 1.035 . . . . 0.0 110.344 175.984 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -59.85 -46.75 88.3 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 125.843 1.657 . . . . 0.0 112.688 173.293 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 38.8 ttmt -75.28 -25.12 57.71 Favored 'General case' 0 CA--C 1.518 -0.28 0 C-N-CA 124.099 0.96 . . . . 0.0 111.799 -172.42 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -52.79 -50.11 64.24 Favored 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 118.138 0.426 . . . . 0.0 110.47 171.597 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 19.0 m-85 -62.15 -39.16 91.67 Favored 'General case' 0 C--N 1.34 0.183 0 C-N-CA 124.113 0.965 . . . . 0.0 111.319 -175.847 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 73.8 mt -68.04 -37.78 78.79 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.409 0 C-N-CA 123.956 0.902 . . . . 0.0 110.122 179.4 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 15.8 ttmt -73.0 -40.42 65.24 Favored 'General case' 0 C--N 1.344 0.333 0 C-N-CA 124.338 1.055 . . . . 0.0 112.533 -176.618 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 23.9 p30 . . . . . 0 CA--C 1.532 0.256 0 C-N-CA 123.324 0.65 . . . . 0.0 111.696 -178.035 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 . . . . . 0 N--CA 1.471 0.605 0 CA-C-O 120.851 0.357 . . . . 0.0 111.384 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -145.47 111.04 5.39 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.792 1.237 . . . . 0.0 110.512 176.223 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 57.8 t -141.26 133.65 29.5 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 C-N-CA 125.333 1.453 . . . . 0.0 109.651 178.936 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 42.7 t -162.94 -71.43 0.05 OUTLIER 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 123.701 0.8 . . . . 0.0 112.498 175.322 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 60.8 p -85.85 -20.57 28.92 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 124.881 1.272 . . . . 0.0 113.956 -176.179 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 97.0 mtp -124.02 113.79 18.89 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 126.076 1.75 . . . . 0.0 109.199 176.035 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -142.62 74.21 1.44 Allowed 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.084 1.354 . . . . 0.0 109.757 -177.461 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -147.39 147.88 30.74 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 124.779 1.232 . . . . 0.0 112.144 -179.076 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 30.1 mtpp . . . . . 0 N--CA 1.478 0.969 0 C-N-CA 125.946 1.698 . . . . 0.0 110.751 177.47 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 11.2 mmt . . . . . 0 N--CA 1.478 0.945 0 N-CA-C 114.203 1.186 . . . . 0.0 114.203 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 46.5 t0 -148.4 108.76 3.62 Favored Pre-proline 0 CA--C 1.549 0.939 0 O-C-N 121.065 -1.022 . . . . 0.0 112.312 -178.183 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 65.2 Cg_endo -83.8 -2.09 10.21 Favored 'Trans proline' 0 C--N 1.351 0.682 0 C-N-CA 123.828 3.019 . . . . 0.0 114.712 178.333 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 96.8 mt -120.8 39.35 3.8 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 126.212 1.805 . . . . 0.0 111.78 -175.576 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -106.13 -3.58 21.31 Favored 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 114.253 1.205 . . . . 0.0 114.253 176.533 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.09 -57.06 2.31 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 124.233 1.013 . . . . 0.0 113.112 -161.017 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.9 pp -129.05 12.22 2.67 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.794 0 C-N-CA 126.389 1.876 . . . . 0.0 112.863 -175.118 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 8.4 tt -42.34 105.73 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.082 0 C-N-CA 126.0 1.72 . . . . 0.0 113.46 -176.459 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 4.3 t30 -150.52 10.94 0.67 Allowed 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 114.878 1.436 . . . . 0.0 114.878 179.87 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -81.6 5.25 18.7 Favored 'General case' 0 CA--C 1.545 0.771 0 N-CA-C 115.147 1.536 . . . . 0.0 115.147 -168.53 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 13.5 tt -148.33 27.57 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 C-N-CA 125.616 1.566 . . . . 0.0 113.975 -172.717 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 52.7 mtmt . . . . . 0 N--CA 1.477 0.883 0 N-CA-C 113.981 1.104 . . . . 0.0 113.981 176.555 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.1 mt . . . . . 0 CA--C 1.543 0.704 0 N-CA-C 109.26 -0.644 . . . . 0.0 109.26 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 70.0 m -71.48 164.64 25.43 Favored 'General case' 0 N--CA 1.481 1.077 0 O-C-N 121.788 -0.57 . . . . 0.0 110.5 169.559 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -55.89 -43.76 77.55 Favored 'General case' 0 N--CA 1.481 1.078 0 O-C-N 120.492 -1.38 . . . . 0.0 113.181 -174.949 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 11.6 tt0 -72.24 -41.42 66.82 Favored 'General case' 0 CA--C 1.536 0.442 0 O-C-N 121.549 -0.719 . . . . 0.0 111.537 175.47 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 86.8 mt-30 -62.4 -39.29 92.75 Favored 'General case' 0 N--CA 1.466 0.374 0 O-C-N 121.657 -0.652 . . . . 0.0 111.79 178.465 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 40.0 ttmt -60.81 -41.32 95.45 Favored 'General case' 0 N--CA 1.465 0.281 0 C-N-CA 123.987 0.915 . . . . 0.0 110.625 175.764 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 46.7 mt -67.86 -43.46 86.03 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 CA-C-O 118.332 -0.842 . . . . 0.0 111.266 176.673 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 45.5 mt -64.74 -44.78 96.48 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.956 0 CA-C-N 120.518 1.508 . . . . 0.0 110.481 179.314 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -58.63 -48.77 79.88 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.434 1.494 . . . . 0.0 110.87 176.154 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -64.0 -51.7 63.0 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 124.042 0.937 . . . . 0.0 112.333 176.939 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 13.9 mm-40 -59.75 -23.0 62.86 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 119.318 0.963 . . . . 0.0 113.394 -179.745 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.443 ' CE2' HG22 ' A' ' 55' ' ' ILE . 1.4 t80 -71.47 -64.15 0.98 Allowed 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 119.001 0.819 . . . . 0.0 110.824 172.905 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 27.4 mt -58.84 -34.61 52.81 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 C-N-CA 126.534 1.934 . . . . 0.0 112.019 178.862 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -71.71 -23.45 61.64 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.265 1.026 . . . . 0.0 112.996 177.721 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -91.44 -36.28 13.87 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 124.327 1.051 . . . . 0.0 112.624 176.109 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 19.4 m -112.66 -23.56 4.32 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.269 0 N-CA-C 115.326 1.602 . . . . 0.0 115.326 -174.385 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 83.86 139.16 3.89 Favored Glycine 0 CA--C 1.533 1.183 0 C-N-CA 124.916 1.246 . . . . 0.0 112.288 -167.845 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.2 tt -65.64 -7.94 17.78 Favored 'General case' 0 CA--C 1.551 0.992 0 N-CA-C 114.16 1.17 . . . . 0.0 114.16 -173.4 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 37.7 mt-30 -74.26 -19.3 60.55 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 126.411 1.884 . . . . 0.0 113.566 -178.548 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 13.5 p30 -130.7 2.34 4.47 Favored 'General case' 0 N--CA 1.476 0.868 0 N-CA-C 115.741 1.756 . . . . 0.0 115.741 -176.166 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . 0.443 HG22 ' CE2' ' A' ' 46' ' ' TYR . 31.2 pt -63.01 156.98 4.33 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.655 0 CA-C-N 118.797 0.726 . . . . 0.0 111.707 164.826 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -130.63 144.79 51.67 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 125.139 1.376 . . . . 0.0 110.631 176.063 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -62.97 -26.39 68.81 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 124.005 0.922 . . . . 0.0 112.256 175.923 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -66.35 -41.07 88.27 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.502 0 C-N-CA 125.415 1.486 . . . . 0.0 110.562 174.222 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 98.7 m -80.84 -43.65 19.64 Favored 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 123.23 0.612 . . . . 0.0 109.738 -179.289 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.4 tt -66.06 -33.45 75.82 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 124.648 1.179 . . . . 0.0 112.333 178.158 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.444 ' HA ' HG13 ' A' ' 66' ' ' ILE . 60.4 p -60.91 -26.28 67.34 Favored 'General case' 0 N--CA 1.475 0.795 0 CA-C-N 119.232 0.924 . . . . 0.0 112.978 169.878 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -96.32 -31.27 12.97 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 125.026 1.33 . . . . 0.0 113.39 -178.497 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 8.3 mmtm -61.06 -36.53 79.85 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 125.255 1.422 . . . . 0.0 111.75 175.7 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.1 mt -118.22 9.31 12.53 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 125.678 1.591 . . . . 0.0 113.654 -171.1 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . 0.291 7.4 p30 47.31 60.32 3.53 Favored 'General case' 0 CA--C 1.551 0.996 0 C-N-CA 126.771 2.029 . . . . 0.0 114.132 -176.821 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.444 HG13 ' HA ' ' A' ' 61' ' ' SER . 0.6 OUTLIER -130.64 178.5 5.34 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 127.788 2.435 . . . . 0.0 111.359 -173.438 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.1 p -79.56 158.88 27.05 Favored 'General case' 0 N--CA 1.477 0.91 0 O-C-N 121.011 -1.056 . . . . 0.0 111.598 173.337 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 86.3 t -63.7 -29.94 48.59 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.029 0 O-C-N 121.628 -0.67 . . . . 0.0 111.36 172.468 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -76.68 -38.4 54.54 Favored 'General case' 0 N--CA 1.468 0.468 0 O-C-N 120.985 -1.072 . . . . 0.0 109.951 -178.344 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 5.6 tmtm? -65.06 -47.92 75.61 Favored 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 125.56 1.544 . . . . 0.0 110.771 176.359 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -60.62 -43.03 97.94 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 125.95 1.7 . . . . 0.0 113.479 174.062 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 34.8 ttmt -72.31 -27.09 62.22 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 124.633 1.173 . . . . 0.0 111.657 -179.352 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -56.91 -43.11 81.07 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-O 119.02 -0.515 . . . . 0.0 111.245 177.419 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 65.2 m-85 -60.9 -42.74 98.64 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 124.922 1.289 . . . . 0.0 111.571 175.243 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 62.5 mt -69.23 -21.05 24.85 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.765 0 C-N-CA 124.457 1.103 . . . . 0.0 111.168 -179.855 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 30.3 mmtm -92.96 -23.46 18.71 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 125.656 1.582 . . . . 0.0 113.394 178.547 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 10.3 p30 . . . . . 0 N--CA 1.468 0.466 0 N-CA-C 113.822 1.045 . . . . 0.0 113.822 177.986 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 11.0 mp0 . . . . . 0 CA--C 1.549 0.939 0 CA-C-O 121.702 0.763 . . . . 0.0 112.427 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 24.5 tt0 -126.21 45.33 2.67 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 125.162 1.385 . . . . 0.0 112.325 -174.969 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 15.2 t -140.64 68.17 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 C-N-CA 124.978 1.311 . . . . 0.0 110.691 -179.911 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 36.0 t -161.49 -72.02 0.06 Allowed 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.375 0.67 . . . . 0.0 112.636 169.946 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 46.2 m -90.19 -22.67 21.57 Favored 'General case' 0 N--CA 1.478 0.972 0 N-CA-C 113.815 1.043 . . . . 0.0 113.815 -173.391 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 7.4 tpt -144.41 136.1 25.84 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 125.668 1.587 . . . . 0.0 109.358 174.823 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 13.6 tt0 -148.52 29.18 0.86 Allowed 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 124.191 0.996 . . . . 0.0 112.009 -172.904 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -123.59 151.18 43.23 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 125.326 1.45 . . . . 0.0 112.83 -171.678 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 52.2 mtmt . . . . . 0 N--CA 1.474 0.753 0 C-N-CA 125.474 1.509 . . . . 0.0 111.149 177.635 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 79.7 mtp . . . . . 0 N--CA 1.48 1.026 0 N-CA-C 114.083 1.142 . . . . 0.0 114.083 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 10.9 t0 -88.2 123.69 68.06 Favored Pre-proline 0 CA--C 1.553 1.082 0 C-N-CA 124.422 1.089 . . . . 0.0 112.027 -175.49 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_endo -87.68 0.2 7.2 Favored 'Trans proline' 0 C--N 1.353 0.779 0 C-N-CA 123.607 2.871 . . . . 0.0 115.224 -178.136 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 74.8 mt -109.85 28.78 8.24 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 124.874 1.27 . . . . 0.0 113.94 -171.376 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -99.15 -5.52 29.94 Favored 'General case' 0 N--CA 1.478 0.93 0 N-CA-C 115.661 1.726 . . . . 0.0 115.661 176.889 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -130.47 -30.58 1.89 Allowed 'General case' 0 N--CA 1.481 1.109 0 N-CA-C 117.17 2.285 . . . . 0.0 117.17 -169.066 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.5 pp -135.4 17.82 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.334 0 C-N-CA 125.337 1.455 . . . . 0.0 113.601 -177.531 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 13.1 tt -51.22 135.16 11.87 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 C-N-CA 125.289 1.435 . . . . 0.0 112.876 -176.826 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -156.24 124.74 5.84 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.876 1.27 . . . . 0.0 110.097 -175.762 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 18.9 p-10 -163.23 62.82 0.18 Allowed 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 122.654 1.216 . . . . 0.0 110.793 -178.101 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 52.5 mt 53.31 59.01 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.75 0 C-N-CA 126.125 1.77 . . . . 0.0 110.378 -173.797 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 4.3 tmmm? . . . . . 0 N--CA 1.475 0.823 0 CA-C-N 114.807 -1.088 . . . . 0.0 113.67 -177.447 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.3 mt . . . . . 0 CA--C 1.544 0.714 0 CA-C-O 120.53 0.205 . . . . 0.0 110.609 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 21.4 t -73.15 166.76 22.51 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 123.053 0.541 . . . . 0.0 110.509 166.95 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -57.52 -44.54 85.13 Favored 'General case' 0 N--CA 1.475 0.794 0 O-C-N 120.705 -1.247 . . . . 0.0 112.744 -175.131 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -74.58 -36.16 63.02 Favored 'General case' 0 N--CA 1.47 0.554 0 O-C-N 121.509 -0.744 . . . . 0.0 112.317 176.045 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 30.0 mm-40 -63.19 -41.47 99.19 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 123.669 0.788 . . . . 0.0 110.438 177.896 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 21.4 ttmm -60.02 -42.59 94.67 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 124.3 1.04 . . . . 0.0 111.159 176.18 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 46.5 mt -69.28 -42.6 81.44 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 CA-C-O 118.341 -0.838 . . . . 0.0 111.115 178.466 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 31.6 mt -63.67 -42.85 97.43 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 CA-C-N 120.586 1.539 . . . . 0.0 110.518 178.218 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -58.47 -47.69 83.23 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.629 1.172 . . . . 0.0 110.621 174.795 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -67.53 -50.42 58.82 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.569 1.147 . . . . 0.0 113.12 -179.597 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -60.46 -26.16 66.56 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-N 118.991 0.814 . . . . 0.0 113.188 -179.625 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 2.1 t80 -74.24 -54.37 7.86 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 123.606 0.762 . . . . 0.0 111.447 177.249 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 45.8 mt -58.81 -35.01 53.86 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 C-N-CA 125.053 1.341 . . . . 0.0 111.23 173.168 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -68.0 -21.07 65.06 Favored 'General case' 0 CA--C 1.547 0.835 0 N-CA-C 113.37 0.878 . . . . 0.0 113.37 175.655 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -95.34 -30.39 13.96 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.833 1.253 . . . . 0.0 113.165 178.406 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 7.7 m -124.54 -22.46 2.48 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 CA-C-N 119.695 1.134 . . . . 0.0 114.049 -173.659 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 89.12 143.96 10.14 Favored Glycine 0 CA--C 1.534 1.256 0 C-N-CA 125.56 1.552 . . . . 0.0 113.246 -172.96 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 58.2 tp -60.08 -17.96 43.49 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 125.707 1.603 . . . . 0.0 115.243 -172.218 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 1.2 pm0 -88.55 -13.4 40.21 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.13 1.372 . . . . 0.0 114.5 176.495 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 77.7 m-20 -110.83 -11.68 14.35 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 114.45 1.278 . . . . 0.0 114.45 -175.084 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 32.2 pt -64.38 156.46 5.46 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 C-N-CA 123.379 0.672 . . . . 0.0 111.205 166.101 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -126.81 144.05 51.08 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 124.752 1.221 . . . . 0.0 110.591 173.886 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -60.62 -26.73 67.23 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.723 0.809 . . . . 0.0 112.099 174.0 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 27.9 mm -63.9 -53.58 42.43 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.396 0 C-N-CA 124.831 1.252 . . . . 0.0 110.6 174.005 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 79.5 m -72.16 -41.52 67.0 Favored 'General case' 0 C--O 1.223 -0.338 0 C-N-CA 123.735 0.814 . . . . 0.0 109.895 -178.331 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 21.0 tp -62.86 -36.88 84.71 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.938 1.295 . . . . 0.0 111.868 177.052 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.498 ' HA ' HG13 ' A' ' 66' ' ' ILE . 43.5 t -54.04 -32.67 55.19 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 124.47 1.108 . . . . 0.0 113.143 168.724 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -100.44 -23.3 14.77 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 114.57 1.322 . . . . 0.0 114.57 -175.153 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 68.5 mmtt -65.76 -38.08 88.09 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 125.093 1.357 . . . . 0.0 111.262 172.861 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.4 mp -111.17 -0.61 16.46 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 125.342 1.457 . . . . 0.0 114.431 -173.535 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 42.7 m-80 55.21 49.51 17.12 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 125.535 1.534 . . . . 0.0 112.78 -173.513 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.498 HG13 ' HA ' ' A' ' 61' ' ' SER . 6.2 pt -109.14 -163.4 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 C-N-CA 126.467 1.907 . . . . 0.0 111.022 -179.33 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.2 p -99.16 161.45 13.62 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.33 1.052 . . . . 0.0 110.538 168.435 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 92.3 t -61.05 -29.11 45.05 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 O-C-N 121.601 -0.687 . . . . 0.0 111.196 173.339 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -82.27 -34.31 28.77 Favored 'General case' 0 N--CA 1.472 0.65 0 O-C-N 120.615 -1.303 . . . . 0.0 110.868 179.489 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 4.1 tttp -80.36 -3.83 51.15 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 126.341 1.856 . . . . 0.0 113.379 178.644 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -102.88 -46.35 4.71 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 129.248 3.019 . . . . 0.0 112.84 167.69 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 36.9 ttmt -69.92 -28.77 65.86 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 124.843 1.257 . . . . 0.0 111.14 -175.307 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 42.5 p-10 -45.7 -55.05 6.92 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 123.239 0.616 . . . . 0.0 111.07 171.646 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 25.0 m-85 -55.14 -42.1 72.6 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 126.021 1.728 . . . . 0.0 112.47 -179.844 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 50.5 mt -70.25 -26.53 29.52 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.728 0 C-N-CA 125.745 1.618 . . . . 0.0 111.467 -178.866 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 30.8 mmmt -87.17 -36.31 18.1 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 125.994 1.718 . . . . 0.0 112.27 175.641 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 73.6 m-20 . . . . . 0 CA--C 1.532 0.268 0 C-N-CA 125.858 1.663 . . . . 0.0 108.692 -175.381 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 . . . . . 0 N--CA 1.476 0.862 0 N-CA-C 112.451 0.538 . . . . 0.0 112.451 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -141.19 39.29 1.76 Allowed 'General case' 0 N--CA 1.479 0.982 0 N-CA-C 114.431 1.271 . . . . 0.0 114.431 -171.488 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 34.4 m -83.34 148.75 4.87 Favored 'Isoleucine or valine' 0 C--O 1.234 0.279 0 C-N-CA 124.71 1.204 . . . . 0.0 112.663 177.662 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 43.4 t -164.96 -73.36 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 124.477 1.111 . . . . 0.0 112.475 168.919 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 18.2 t -74.64 -31.2 61.89 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 123.863 0.865 . . . . 0.0 112.476 -177.98 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 62.5 mtt -128.3 151.4 49.36 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 125.914 1.685 . . . . 0.0 110.742 169.367 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 20.2 tt0 -141.4 19.65 2.22 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 125.393 1.477 . . . . 0.0 111.822 -176.451 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -119.95 105.52 11.14 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 125.257 1.423 . . . . 0.0 112.048 -170.776 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 96.8 mttt . . . . . 0 N--CA 1.482 1.135 0 C-N-CA 125.802 1.641 . . . . 0.0 113.584 174.581 . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 16.9 ttp . . . . . 0 N--CA 1.477 0.919 0 N-CA-C 113.112 0.782 . . . . 0.0 113.112 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 -120.42 130.7 24.72 Favored Pre-proline 0 CA--C 1.547 0.833 0 C-N-CA 124.834 1.254 . . . . 0.0 111.848 -171.931 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -80.07 -15.73 11.53 Favored 'Trans proline' 0 C--N 1.352 0.75 0 C-N-CA 123.084 2.522 . . . . 0.0 114.992 -175.454 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 96.9 mt -116.78 42.05 2.57 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 126.165 1.786 . . . . 0.0 111.806 -174.884 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -113.18 1.29 15.2 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 114.307 1.225 . . . . 0.0 114.307 179.241 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -119.22 -56.0 2.11 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 124.767 1.227 . . . . 0.0 113.063 -167.762 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.1 pp -129.72 14.38 2.44 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.875 0 C-N-CA 126.407 1.883 . . . . 0.0 112.892 -173.199 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 9.4 tt -44.73 124.05 0.83 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 C-N-CA 125.12 1.368 . . . . 0.0 112.254 178.074 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -147.1 12.61 1.09 Allowed 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 113.812 1.042 . . . . 0.0 113.812 -176.62 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -88.46 7.86 30.76 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 114.696 1.369 . . . . 0.0 114.696 -171.753 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 14.2 tt -148.71 30.61 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 C-N-CA 125.763 1.625 . . . . 0.0 113.318 -172.034 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 60.0 tttp . . . . . 0 N--CA 1.476 0.837 0 N-CA-C 114.28 1.215 . . . . 0.0 114.28 -179.437 . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.9 mt . . . . . 0 CA--C 1.545 0.761 0 N-CA-C 110.044 -0.354 . . . . 0.0 110.044 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 17.9 m -71.41 167.56 19.33 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 123.749 0.819 . . . . 0.0 110.733 169.293 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -56.25 -45.37 80.06 Favored 'General case' 0 N--CA 1.478 0.94 0 O-C-N 120.591 -1.318 . . . . 0.0 113.357 -174.799 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 10.4 tt0 -74.61 -42.1 59.23 Favored 'General case' 0 N--CA 1.471 0.593 0 O-C-N 121.416 -0.802 . . . . 0.0 111.46 177.004 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 29.2 mm-40 -55.3 -44.94 76.21 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.079 0.952 . . . . 0.0 110.812 176.577 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt -60.55 -42.03 95.76 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 125.058 1.343 . . . . 0.0 111.396 178.457 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 45.4 mt -69.29 -40.59 80.4 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 CA-C-O 118.117 -0.944 . . . . 0.0 111.245 177.912 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 38.2 mt -64.08 -43.05 97.42 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.848 0 CA-C-N 120.256 1.389 . . . . 0.0 110.205 177.301 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -60.24 -47.67 85.01 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.372 1.069 . . . . 0.0 110.931 177.159 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -67.51 -50.29 59.53 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 124.886 1.274 . . . . 0.0 112.328 179.722 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -64.2 -26.06 68.35 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 118.999 0.818 . . . . 0.0 112.783 -176.61 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.462 ' CD1' ' HE2' ' A' ' 63' ' ' LYS . 1.1 t80 -67.61 -58.43 4.69 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 123.913 0.885 . . . . 0.0 110.509 174.421 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.0 mt -62.61 -35.63 71.25 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 C-N-CA 126.539 1.935 . . . . 0.0 111.368 179.512 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -70.96 -26.64 63.25 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 123.881 0.873 . . . . 0.0 112.617 178.25 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -88.11 -38.84 15.05 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.267 1.027 . . . . 0.0 112.541 175.329 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.5 m -108.56 -6.99 10.96 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.147 0 N-CA-C 114.529 1.307 . . . . 0.0 114.529 -172.616 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 87.52 26.46 30.09 Favored Glycine 0 CA--C 1.531 1.056 0 C-N-CA 124.695 1.141 . . . . 0.0 115.476 161.865 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 57.15 10.21 0.8 Allowed 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 127.223 2.209 . . . . 0.0 115.09 -174.957 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 4.7 pt20 -123.27 -3.78 8.44 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 125.141 1.376 . . . . 0.0 113.713 -168.561 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 59.5 m-80 -123.47 0.52 8.85 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.953 1.301 . . . . 0.0 113.196 174.75 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . 0.434 HG22 ' CE2' ' A' ' 46' ' ' TYR . 19.0 pt -74.9 152.33 6.66 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.57 0 CA-C-O 121.099 0.476 . . . . 0.0 111.223 175.125 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -140.04 143.84 36.58 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 124.668 1.187 . . . . 0.0 109.581 179.625 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -60.4 -28.24 68.08 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 123.417 0.687 . . . . 0.0 112.247 179.732 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -64.78 -48.81 82.95 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 C-N-CA 125.467 1.507 . . . . 0.0 110.157 175.222 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 78.2 m -80.71 -41.43 23.65 Favored 'General case' 0 C--O 1.223 -0.326 0 C-N-CA 124.103 0.961 . . . . 0.0 110.202 -174.722 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 20.0 tp -62.51 -35.6 79.9 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 125.214 1.406 . . . . 0.0 112.265 173.448 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.458 ' HA ' HG13 ' A' ' 66' ' ' ILE . 29.6 t -54.51 -33.47 59.96 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.706 1.203 . . . . 0.0 112.366 168.781 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -94.89 -31.85 13.5 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.755 1.222 . . . . 0.0 113.68 -176.322 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.462 ' HE2' ' CD1' ' A' ' 46' ' ' TYR . 1.0 OUTLIER -62.02 -32.75 73.27 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 125.42 1.488 . . . . 0.0 112.52 178.413 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.6 mp -118.6 8.34 11.95 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.751 1.221 . . . . 0.0 114.01 -177.97 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 44.9 m-80 53.37 56.22 7.66 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 126.243 1.817 . . . . 0.0 113.304 -178.659 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.458 HG13 ' HA ' ' A' ' 61' ' ' SER . 1.5 pt -122.08 -168.33 0.5 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.701 0 C-N-CA 127.132 2.173 . . . . 0.0 110.536 -173.738 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 2.4 p -93.48 160.2 14.9 Favored 'General case' 0 N--CA 1.476 0.835 0 O-C-N 121.264 -0.898 . . . . 0.0 111.04 170.641 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 86.9 t -61.73 -29.98 47.39 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 C-N-CA 123.086 0.554 . . . . 0.0 111.271 172.527 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -79.25 -37.73 37.23 Favored 'General case' 0 N--CA 1.468 0.429 0 O-C-N 120.854 -1.154 . . . . 0.0 110.283 -178.224 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 5.2 tmtm? -67.66 -45.31 75.65 Favored 'General case' 0 C--N 1.339 0.138 0 C-N-CA 124.56 1.144 . . . . 0.0 110.741 178.275 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -60.3 -45.86 91.9 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.713 1.605 . . . . 0.0 113.278 170.877 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 33.5 ttmt -69.46 -27.12 64.96 Favored 'General case' 0 N--CA 1.466 0.373 0 O-C-N 121.005 -1.059 . . . . 0.0 111.546 -177.251 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -55.67 -43.67 76.55 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-O 119.372 -0.347 . . . . 0.0 111.334 175.806 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 30.7 m-85 -62.16 -44.35 96.8 Favored 'General case' 0 C--O 1.224 -0.263 0 C-N-CA 125.269 1.428 . . . . 0.0 111.515 177.339 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 65.0 mt -64.59 -30.34 49.94 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.586 0 C-N-CA 123.947 0.899 . . . . 0.0 110.571 178.653 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -77.24 -38.01 52.03 Favored 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 125.0 1.32 . . . . 0.0 113.368 -178.704 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 8.3 p30 . . . . . 0 N--CA 1.466 0.36 0 CA-C-N 119.105 0.866 . . . . 0.0 111.587 178.841 . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 . . . . . 0 N--CA 1.474 0.739 0 CA-C-O 121.104 0.478 . . . . 0.0 111.858 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -83.11 88.09 6.9 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 124.226 1.01 . . . . 0.0 110.992 178.264 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 12.2 p -149.06 145.77 17.73 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 C-N-CA 124.909 1.284 . . . . 0.0 111.724 176.08 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 75.0 m -147.38 -54.19 0.22 Allowed 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 124.724 1.21 . . . . 0.0 112.814 -178.295 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 25.9 t -107.51 -46.52 3.82 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 124.521 1.128 . . . . 0.0 112.955 -175.424 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 94.8 mtp -88.86 51.49 2.18 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 125.021 1.328 . . . . 0.0 112.143 -176.162 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 21.7 tt0 -80.41 57.73 2.92 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 125.42 1.488 . . . . 0.0 112.126 -177.114 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -137.36 124.74 21.93 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.439 1.496 . . . . 0.0 111.196 -179.522 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 59.9 mtpt . . . . . 0 N--CA 1.482 1.159 0 C-N-CA 125.448 1.499 . . . . 0.0 112.587 -179.029 . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 12.1 tmm? . . . . . 0 CA--C 1.539 0.531 0 N-CA-C 109.956 -0.387 . . . . 0.0 109.956 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 77.4 m-20 39.72 58.66 6.8 Favored Pre-proline 0 CA--C 1.555 1.135 0 C-N-CA 127.346 2.258 . . . . 0.0 115.159 177.994 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 78.7 Cg_endo -70.02 -16.53 36.48 Favored 'Trans proline' 0 C--N 1.352 0.752 0 C-N-CA 123.29 2.66 . . . . 0.0 115.365 -170.801 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.445 HD23 ' H ' ' A' ' 4' ' ' LEU . 2.4 pt? -113.93 13.1 18.25 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 126.148 1.779 . . . . 0.0 115.011 -176.974 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -74.94 -2.03 25.2 Favored 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 115.166 1.543 . . . . 0.0 115.166 -175.768 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -125.65 -61.86 1.23 Allowed 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 125.407 1.483 . . . . 0.0 112.951 -163.392 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.4 pp -104.16 -14.83 8.46 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 C-N-CA 124.681 1.193 . . . . 0.0 113.53 -177.105 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . 0.291 14.2 tt 34.44 48.95 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.27 0 C-N-CA 127.502 2.321 . . . . 0.0 116.234 170.04 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -95.94 37.33 1.23 Allowed 'General case' 0 CA--C 1.547 0.83 0 O-C-N 120.418 -1.426 . . . . 0.0 113.077 -170.902 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 -109.44 10.72 25.29 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 113.851 1.056 . . . . 0.0 113.851 -176.635 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 6.9 tp -150.14 31.34 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.48 1.047 0 C-N-CA 125.013 1.325 . . . . 0.0 113.61 -173.299 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 7.0 tmtm? . . . . . 0 N--CA 1.475 0.785 0 C-N-CA 123.717 0.807 . . . . 0.0 113.045 -176.827 . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.7 mt . . . . . 0 CA--C 1.545 0.759 0 N-CA-C 110.194 -0.298 . . . . 0.0 110.194 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 18.9 t -75.31 166.77 23.11 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 123.178 0.591 . . . . 0.0 110.503 169.727 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -55.83 -46.04 78.21 Favored 'General case' 0 N--CA 1.476 0.844 0 O-C-N 120.591 -1.318 . . . . 0.0 113.077 -173.017 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 11.8 tt0 -72.29 -42.22 65.77 Favored 'General case' 0 N--CA 1.47 0.566 0 O-C-N 121.53 -0.731 . . . . 0.0 111.268 176.796 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 14.8 mm100 -60.22 -42.25 94.78 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.797 0.839 . . . . 0.0 110.695 179.744 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 41.4 ttmt -60.73 -43.07 98.35 Favored 'General case' 0 N--CA 1.466 0.332 0 C-N-CA 125.194 1.398 . . . . 0.0 111.008 176.538 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 53.2 mt -67.25 -41.59 86.83 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 CA-C-O 118.179 -0.915 . . . . 0.0 111.155 177.185 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 44.1 mt -63.89 -45.38 97.14 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.928 0 CA-C-N 120.593 1.542 . . . . 0.0 110.166 178.097 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -58.18 -49.6 76.46 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.709 1.204 . . . . 0.0 110.87 176.953 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -65.59 -52.18 54.08 Favored 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 125.028 1.331 . . . . 0.0 112.677 179.515 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 -61.43 -29.21 69.8 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-N 119.169 0.895 . . . . 0.0 112.798 -179.294 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.46 ' CE1' HG22 ' A' ' 55' ' ' ILE . 1.4 t80 -66.83 -56.42 10.45 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 118.685 0.675 . . . . 0.0 110.849 175.342 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 81.1 mt -65.03 -32.01 56.44 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 C-N-CA 126.886 2.074 . . . . 0.0 111.763 178.856 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -73.0 -28.06 62.15 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 123.9 0.88 . . . . 0.0 112.436 176.149 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -85.29 -39.92 17.16 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.01 0.924 . . . . 0.0 112.165 176.054 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.1 m -109.94 -3.62 10.56 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.199 0 N-CA-C 114.152 1.167 . . . . 0.0 114.152 -173.761 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 86.43 19.87 55.86 Favored Glycine 0 N--CA 1.474 1.172 0 C-N-CA 125.539 1.542 . . . . 0.0 115.525 160.538 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 57.13 5.53 0.26 Allowed 'General case' 0 CA--C 1.555 1.164 0 C-N-CA 127.057 2.143 . . . . 0.0 114.706 -166.778 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 15.9 mt-30 -98.81 -14.31 19.74 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 125.901 1.681 . . . . 0.0 112.751 -173.481 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 39.2 m-80 -131.22 6.23 4.51 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 113.937 1.088 . . . . 0.0 113.937 -171.962 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . 0.46 HG22 ' CE1' ' A' ' 46' ' ' TYR . 20.1 pt -77.23 154.38 5.49 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 CA-C-N 118.691 0.678 . . . . 0.0 111.81 176.123 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -133.15 144.01 49.61 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 124.374 1.069 . . . . 0.0 110.306 175.959 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -60.58 -29.17 69.01 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.959 0.904 . . . . 0.0 111.756 177.995 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.9 mp -63.43 -57.18 12.97 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.218 0 C-N-CA 124.81 1.244 . . . . 0.0 108.903 173.93 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 52.9 m -68.42 -45.67 71.98 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 123.696 0.799 . . . . 0.0 109.764 -175.138 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 19.0 tp -57.87 -35.77 71.42 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.915 1.286 . . . . 0.0 112.175 174.324 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.447 ' HA ' HG13 ' A' ' 66' ' ' ILE . 19.4 p -63.91 -20.67 66.02 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 113.883 1.068 . . . . 0.0 113.883 172.551 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 13.6 mptt -103.82 -31.4 9.82 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 125.224 1.409 . . . . 0.0 113.351 -178.287 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 7.2 mtpp -65.87 -28.98 69.36 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 120.035 1.289 . . . . 0.0 112.105 176.836 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.9 mp -115.55 4.48 14.2 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.402 1.481 . . . . 0.0 114.381 -178.653 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 31.9 m-80 56.19 59.57 3.63 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 125.998 1.719 . . . . 0.0 113.651 179.611 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.447 HG13 ' HA ' ' A' ' 61' ' ' SER . 0.9 OUTLIER -135.41 176.63 8.11 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 C-N-CA 126.607 1.963 . . . . 0.0 111.492 -169.853 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.4 p -77.09 158.73 30.3 Favored 'General case' 0 N--CA 1.479 0.985 0 O-C-N 120.947 -1.095 . . . . 0.0 111.317 172.006 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 98.8 t -64.33 -28.5 45.03 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.984 0 O-C-N 121.684 -0.635 . . . . 0.0 111.349 173.644 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -77.86 -38.13 46.72 Favored 'General case' 0 N--CA 1.469 0.475 0 O-C-N 121.183 -0.948 . . . . 0.0 110.055 179.449 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 5.5 tmtm? -67.25 -43.24 82.4 Favored 'General case' 0 N--CA 1.462 0.175 0 C-N-CA 125.138 1.375 . . . . 0.0 111.346 177.244 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -60.7 -50.0 75.25 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.861 1.264 . . . . 0.0 112.92 170.277 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 33.8 ttmt -68.44 -24.79 64.77 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 124.615 1.166 . . . . 0.0 111.846 -176.525 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -53.64 -40.05 65.49 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 123.679 0.792 . . . . 0.0 111.444 171.899 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -70.79 -42.41 70.37 Favored 'General case' 0 C--O 1.224 -0.24 0 C-N-CA 124.152 0.981 . . . . 0.0 111.633 176.593 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 42.9 mt -65.45 -30.82 51.36 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 C-N-CA 124.711 1.204 . . . . 0.0 111.414 -179.289 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 12.4 tppt? -89.47 -22.8 22.3 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.808 1.643 . . . . 0.0 113.002 179.924 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 56.6 m-20 . . . . . 0 N--CA 1.466 0.347 0 C-N-CA 124.942 1.297 . . . . 0.0 110.409 172.961 . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 . . . . . 0 N--CA 1.474 0.758 0 CA-C-O 120.66 0.267 . . . . 0.0 111.108 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -99.99 97.71 8.54 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 124.49 1.116 . . . . 0.0 110.159 175.696 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 25.8 t -129.18 -67.48 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 C-N-CA 124.56 1.144 . . . . 0.0 112.589 -172.311 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 31.2 p 51.43 11.41 0.12 Allowed 'General case' 0 CA--C 1.547 0.851 0 N-CA-C 118.89 2.922 . . . . 0.0 118.89 177.31 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 27.6 t -123.79 -44.27 2.09 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 125.349 1.46 . . . . 0.0 113.318 -178.161 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 3.0 tmm? -137.36 60.05 1.66 Allowed 'General case' 0 N--CA 1.474 0.775 0 CA-C-O 123.388 1.566 . . . . 0.0 110.148 178.552 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 22.1 tt0 -82.5 53.78 2.43 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 126.022 1.729 . . . . 0.0 112.63 -170.716 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -75.5 94.01 3.07 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 124.846 1.258 . . . . 0.0 111.769 -178.741 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 20.0 mmmt . . . . . 0 N--CA 1.477 0.907 0 C-N-CA 126.494 1.918 . . . . 0.0 109.439 -177.746 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 17.7 ttt . . . . . 0 CA--C 1.547 0.854 0 CA-C-O 121.444 0.64 . . . . 0.0 111.617 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 -119.65 94.11 48.15 Favored Pre-proline 0 CA--C 1.545 0.778 0 C-N-CA 125.102 1.361 . . . . 0.0 111.481 -172.224 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -78.83 -13.77 14.23 Favored 'Trans proline' 0 C--N 1.351 0.658 0 C-N-CA 122.977 2.451 . . . . 0.0 114.9 -178.949 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 96.8 mt -101.71 46.07 0.95 Allowed 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 126.015 1.726 . . . . 0.0 113.189 -170.709 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -109.79 -2.66 17.19 Favored 'General case' 0 N--CA 1.479 0.975 0 N-CA-C 114.885 1.439 . . . . 0.0 114.885 171.693 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -128.63 -55.76 1.22 Allowed 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 124.303 1.041 . . . . 0.0 113.18 -166.384 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.8 pp -108.4 9.12 9.21 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 C-N-CA 125.593 1.557 . . . . 0.0 112.882 -178.201 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 10.0 tt -54.09 117.62 0.99 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.825 0 C-N-CA 123.781 0.833 . . . . 0.0 111.769 178.301 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -150.35 15.48 0.8 Allowed 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 124.131 0.972 . . . . 0.0 113.621 -178.167 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -85.2 5.2 31.12 Favored 'General case' 0 CA--C 1.545 0.763 0 N-CA-C 114.931 1.456 . . . . 0.0 114.931 -169.183 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 13.6 tt -146.77 24.4 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.805 0 C-N-CA 125.396 1.478 . . . . 0.0 114.262 -170.217 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 35.4 ttpt . . . . . 0 N--CA 1.475 0.789 0 N-CA-C 114.546 1.313 . . . . 0.0 114.546 177.98 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 36.6 mt . . . . . 0 CA--C 1.541 0.621 0 CA-C-O 120.531 0.205 . . . . 0.0 110.885 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 71.2 m -71.66 165.15 24.56 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 122.976 0.51 . . . . 0.0 110.412 169.741 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -53.79 -44.9 70.49 Favored 'General case' 0 N--CA 1.478 0.952 0 O-C-N 120.952 -1.092 . . . . 0.0 112.877 -176.19 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 6.9 pt20 -72.41 -36.0 68.53 Favored 'General case' 0 N--CA 1.47 0.539 0 O-C-N 121.733 -0.605 . . . . 0.0 112.211 176.683 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 86.7 mt-30 -67.87 -40.21 83.61 Favored 'General case' 0 CA--C 1.534 0.348 0 O-C-N 121.662 -0.648 . . . . 0.0 111.271 179.373 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 17.6 ttmm -59.65 -40.87 89.16 Favored 'General case' 0 N--CA 1.471 0.595 0 O-C-N 121.469 -0.769 . . . . 0.0 110.687 174.359 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 51.5 mt -69.73 -41.54 79.99 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 CA-C-O 117.865 -1.065 . . . . 0.0 111.638 176.969 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 35.9 mt -64.0 -43.08 97.53 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.943 0 CA-C-N 121.144 1.793 . . . . 0.0 110.04 177.598 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -58.12 -49.62 76.35 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.605 1.162 . . . . 0.0 110.688 177.381 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -62.77 -52.93 61.28 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 124.776 1.23 . . . . 0.0 112.834 175.78 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -59.06 -30.99 68.47 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-N 119.154 0.888 . . . . 0.0 112.729 -179.838 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.416 ' CE1' HG22 ' A' ' 55' ' ' ILE . 1.3 t80 -67.73 -57.31 6.56 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 123.35 0.66 . . . . 0.0 110.644 176.871 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 89.0 mt -64.15 -33.63 63.65 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 C-N-CA 126.212 1.805 . . . . 0.0 111.352 179.686 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -71.42 -27.24 63.16 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.016 0.926 . . . . 0.0 112.544 177.097 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -88.19 -37.61 15.98 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.085 0.954 . . . . 0.0 112.533 176.151 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.5 m -109.9 -4.79 10.9 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.223 0 N-CA-C 114.488 1.292 . . . . 0.0 114.488 -174.087 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 83.13 25.8 47.03 Favored Glycine 0 N--CA 1.471 1.004 0 C-N-CA 125.028 1.299 . . . . 0.0 115.049 162.203 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 57.6 6.65 0.45 Allowed 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 127.511 2.325 . . . . 0.0 115.175 -172.061 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 27.2 mt-30 -102.17 -15.34 16.71 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 125.55 1.54 . . . . 0.0 113.181 -172.637 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 42.4 m-80 -126.49 5.68 6.89 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.167 0.987 . . . . 0.0 113.569 -172.543 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . 0.416 HG22 ' CE1' ' A' ' 46' ' ' TYR . 15.1 pt -79.35 152.45 4.8 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.555 0 O-C-N 121.903 -0.498 . . . . 0.0 111.309 173.978 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -139.52 144.99 38.15 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 124.55 1.14 . . . . 0.0 109.592 178.915 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -61.94 -23.16 66.19 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 119.193 0.906 . . . . 0.0 112.59 -179.255 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 2.0 mp -70.29 -55.01 16.04 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.232 0 C-N-CA 125.336 1.454 . . . . 0.0 109.091 172.662 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 91.2 m -68.92 -43.32 75.41 Favored 'General case' 0 N--CA 1.464 0.274 0 O-C-N 121.535 -0.728 . . . . 0.0 110.385 -176.895 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 13.7 tp -60.8 -34.87 75.17 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 125.665 1.586 . . . . 0.0 112.241 173.43 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.486 ' HA ' HG13 ' A' ' 66' ' ' ILE . 4.4 t -57.11 -28.82 62.99 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 124.092 0.957 . . . . 0.0 112.685 169.806 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 8.7 mptt -105.56 -23.24 12.82 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.853 1.261 . . . . 0.0 113.789 -174.949 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 58.6 mmtt -66.46 -33.69 76.26 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 124.533 1.133 . . . . 0.0 111.458 175.316 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.0 mp -119.07 5.82 11.31 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 124.831 1.252 . . . . 0.0 114.364 -175.85 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 19.1 m-80 57.84 58.12 3.82 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 126.262 1.825 . . . . 0.0 113.221 -178.733 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.486 HG13 ' HA ' ' A' ' 61' ' ' SER . 3.4 pt -134.89 168.26 23.97 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 C-N-CA 126.072 1.749 . . . . 0.0 112.49 -170.082 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 30.5 p -69.57 151.72 45.63 Favored 'General case' 0 N--CA 1.47 0.525 0 O-C-N 121.382 -0.824 . . . . 0.0 111.405 174.918 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 91.7 t -61.09 -27.06 40.92 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.861 0 C-N-CA 123.095 0.558 . . . . 0.0 111.054 171.211 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -75.6 -41.92 53.24 Favored 'General case' 0 C--O 1.235 0.323 0 O-C-N 120.96 -1.088 . . . . 0.0 110.155 -176.839 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.25 -32.01 49.47 Favored 'General case' 0 C--N 1.346 0.416 0 CA-C-N 118.311 0.505 . . . . 0.0 111.627 179.626 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -63.86 -46.75 83.59 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.797 1.239 . . . . 0.0 112.194 171.502 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 39.4 ttmt -67.94 -29.46 68.53 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 124.3 1.04 . . . . 0.0 111.334 -178.861 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -55.35 -38.94 69.44 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 122.806 0.442 . . . . 0.0 112.071 176.393 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 35.2 m-85 -65.52 -45.57 82.98 Favored 'General case' 0 C--O 1.224 -0.264 0 C-N-CA 124.699 1.2 . . . . 0.0 111.398 175.664 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 61.6 mt -65.18 -30.59 50.75 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.592 0 C-N-CA 124.115 0.966 . . . . 0.0 110.79 -178.611 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt -79.2 -36.82 39.6 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 124.713 1.205 . . . . 0.0 113.144 179.018 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 6.3 p30 . . . . . 0 C--N 1.345 0.387 0 CA-C-N 120.019 1.282 . . . . 0.0 111.737 179.682 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 . . . . . 0 CA--C 1.544 0.726 0 CA-C-O 121.038 0.447 . . . . 0.0 111.225 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -149.4 71.37 1.11 Allowed 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 124.658 1.183 . . . . 0.0 110.912 -179.784 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 28.0 t -139.7 80.69 0.35 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 124.836 1.254 . . . . 0.0 110.1 177.519 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 47.5 t -163.23 -76.86 0.04 OUTLIER 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 123.935 0.894 . . . . 0.0 112.329 169.375 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 55.5 p -88.74 -29.14 20.04 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 125.028 1.331 . . . . 0.0 113.321 -176.744 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 43.9 mtt -126.61 142.41 51.55 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 126.465 1.906 . . . . 0.0 109.752 167.809 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -157.86 90.78 1.09 Allowed 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.839 1.655 . . . . 0.0 107.823 172.829 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -146.33 157.78 43.82 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 124.3 1.04 . . . . 0.0 113.273 -171.858 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 96.7 mttt . . . . . 0 N--CA 1.475 0.811 0 C-N-CA 125.907 1.683 . . . . 0.0 111.776 -174.894 . . . . . . . . 0 0 . 1 . 030 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.2 ttt . . . . . 0 N--CA 1.479 0.975 0 N-CA-C 113.388 0.884 . . . . 0.0 113.388 . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 8.6 t0 -101.85 123.01 45.37 Favored Pre-proline 0 CA--C 1.551 1.012 0 C-N-CA 124.471 1.109 . . . . 0.0 112.156 -176.614 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 69.1 Cg_endo -82.67 -3.42 11.27 Favored 'Trans proline' 0 C--N 1.352 0.725 0 C-N-CA 123.501 2.8 . . . . 0.0 115.147 179.437 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 81.8 mt -108.24 43.58 1.21 Allowed 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.799 1.64 . . . . 0.0 112.314 -175.793 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -104.81 0.5 28.17 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 115.013 1.486 . . . . 0.0 115.013 178.633 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -120.52 -57.72 1.89 Allowed 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 124.408 1.083 . . . . 0.0 113.489 -166.751 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.1 pp -129.71 15.87 2.44 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 C-N-CA 126.249 1.819 . . . . 0.0 112.76 -172.188 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 16.9 tt -38.88 120.66 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 C-N-CA 125.825 1.65 . . . . 0.0 113.369 178.027 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 1.9 m120 -165.01 108.1 0.85 Allowed 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.584 1.154 . . . . 0.0 109.685 179.372 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 23.3 t0 -166.44 81.91 0.26 Allowed 'General case' 0 N--CA 1.466 0.353 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 -178.82 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 46.1 mm 53.0 63.21 0.21 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.831 0 CA-C-O 123.169 1.461 . . . . 0.0 111.096 -170.463 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 1.3 mmmt . . . . . 0 N--CA 1.48 1.069 0 C-N-CA 124.781 1.233 . . . . 0.0 113.968 179.595 . . . . . . . . 0 0 . 1 . 030 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 86.9 mt . . . . . 0 CA--C 1.544 0.733 0 CA-C-O 120.595 0.236 . . . . 0.0 111.294 . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 26.8 m -72.04 169.51 15.84 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 124.32 1.048 . . . . 0.0 110.871 169.889 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -57.33 -43.54 83.44 Favored 'General case' 0 CA--C 1.545 0.773 0 O-C-N 120.427 -1.421 . . . . 0.0 113.324 -173.46 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 12.6 tt0 -74.69 -43.3 55.87 Favored 'General case' 0 N--CA 1.472 0.661 0 O-C-N 121.129 -0.982 . . . . 0.0 111.696 176.856 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 11.7 mm-40 -53.46 -45.32 69.48 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.0 1.32 . . . . 0.0 111.449 174.521 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 41.0 ttmt -60.45 -38.12 83.12 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 125.31 1.444 . . . . 0.0 111.761 176.889 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 49.9 mt -76.16 -35.81 29.17 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 CA-C-O 118.075 -0.964 . . . . 0.0 111.93 178.565 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 48.8 mt -60.51 -40.97 86.01 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.035 0 CA-C-N 120.766 1.621 . . . . 0.0 109.825 172.752 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.454 HD22 HD11 ' A' ' 60' ' ' LEU . 0.4 OUTLIER -59.45 -52.4 65.75 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.177 0.991 . . . . 0.0 110.649 175.0 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -65.36 -49.27 70.0 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 124.419 1.088 . . . . 0.0 113.42 -177.662 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 18.8 mm-40 -62.46 -25.05 67.78 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 123.941 0.896 . . . . 0.0 113.065 -179.297 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -71.87 -54.82 8.88 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 123.367 0.667 . . . . 0.0 110.999 175.883 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 52.7 mt -59.35 -36.17 62.4 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 C-N-CA 125.134 1.374 . . . . 0.0 111.262 174.202 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -67.84 -20.86 65.2 Favored 'General case' 0 CA--C 1.546 0.791 0 N-CA-C 113.266 0.839 . . . . 0.0 113.266 176.771 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -96.41 -29.72 13.78 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.882 1.273 . . . . 0.0 113.228 178.358 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 5.3 m -123.19 -22.79 2.77 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.993 0 CA-C-N 119.791 1.178 . . . . 0.0 114.068 -173.815 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 89.92 143.51 10.43 Favored Glycine 0 CA--C 1.534 1.251 0 C-N-CA 125.531 1.539 . . . . 0.0 113.082 -172.017 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 30.6 tp -59.89 -17.19 35.12 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 126.116 1.766 . . . . 0.0 114.932 -173.377 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 37.6 mt-30 -89.55 -18.99 25.55 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 126.474 1.91 . . . . 0.0 112.923 179.753 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 57.9 m-80 -108.67 -9.11 15.3 Favored 'General case' 0 N--CA 1.472 0.648 0 N-CA-C 114.35 1.241 . . . . 0.0 114.35 -173.748 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 30.5 pt -65.62 159.49 4.14 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.471 0 C-N-CA 123.787 0.835 . . . . 0.0 111.134 162.396 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -132.43 143.14 49.6 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 125.494 1.518 . . . . 0.0 109.904 175.612 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -59.44 -26.65 65.38 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 123.826 0.851 . . . . 0.0 112.219 174.679 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 27.7 mm -66.07 -44.33 92.01 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.495 0 C-N-CA 125.286 1.434 . . . . 0.0 111.686 175.36 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 56.2 m -83.4 -38.85 21.4 Favored 'General case' 0 C--O 1.222 -0.364 0 C-N-CA 123.175 0.59 . . . . 0.0 109.461 -178.515 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.454 HD11 HD22 ' A' ' 43' ' ' LEU . 14.3 tp -62.64 -37.82 87.84 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 125.0 1.32 . . . . 0.0 111.538 175.651 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.462 ' HA ' HG13 ' A' ' 66' ' ' ILE . 53.1 p -61.26 -25.76 67.3 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 113.2 0.815 . . . . 0.0 113.2 171.747 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -99.38 -28.29 13.35 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 125.092 1.357 . . . . 0.0 114.234 -177.196 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 51.9 mmtt -64.65 -36.47 84.36 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 125.806 1.642 . . . . 0.0 111.506 175.701 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.0 mp -115.31 3.64 14.26 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 125.408 1.483 . . . . 0.0 114.054 -174.0 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 42.3 m-80 56.13 61.13 2.87 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 126.347 1.859 . . . . 0.0 113.291 -179.171 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.462 HG13 ' HA ' ' A' ' 61' ' ' SER . 0.9 OUTLIER -134.82 178.11 5.9 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.715 0 C-N-CA 127.64 2.376 . . . . 0.0 111.226 -171.979 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.3 p -80.54 159.97 25.33 Favored 'General case' 0 N--CA 1.48 1.044 0 O-C-N 120.82 -1.175 . . . . 0.0 111.656 173.175 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 84.3 t -62.3 -29.13 45.98 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 C-N-CA 123.384 0.674 . . . . 0.0 111.303 172.943 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -81.28 -36.87 29.32 Favored 'General case' 0 N--CA 1.468 0.458 0 O-C-N 120.917 -1.114 . . . . 0.0 110.433 -179.436 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 9.7 tmtt? -64.08 -45.26 89.51 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 125.129 1.372 . . . . 0.0 110.702 175.922 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -60.0 -49.69 76.67 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 125.877 1.671 . . . . 0.0 113.008 170.335 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 34.7 ttmt -71.44 -23.14 61.79 Favored 'General case' 0 N--CA 1.466 0.332 0 O-C-N 121.003 -1.061 . . . . 0.0 111.876 -174.353 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -52.9 -40.34 63.44 Favored 'General case' 0 CA--C 1.546 0.796 0 CA-C-N 118.211 0.459 . . . . 0.0 111.324 172.039 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 27.8 m-85 -68.78 -40.72 79.52 Favored 'General case' 0 C--O 1.224 -0.238 0 C-N-CA 123.781 0.832 . . . . 0.0 111.486 179.5 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 61.2 mt -69.71 -26.85 31.53 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.676 0 C-N-CA 125.471 1.509 . . . . 0.0 111.121 179.666 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 71.2 mmtt -82.03 -32.0 30.69 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 125.016 1.326 . . . . 0.0 112.78 172.843 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 38.6 m-20 . . . . . 0 C--O 1.232 0.161 0 C-N-CA 124.42 1.088 . . . . 0.0 111.082 -177.522 . . . . . . . . 0 0 . 1 . 030 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 63.5 mm-40 . . . . . 0 N--CA 1.473 0.714 0 CA-C-O 121.212 0.529 . . . . 0.0 112.247 . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -123.09 101.53 7.46 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 125.308 1.443 . . . . 0.0 110.244 174.219 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 8.5 p -149.94 131.54 5.34 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 C-N-CA 124.982 1.313 . . . . 0.0 110.874 177.814 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 45.4 t -162.8 -64.93 0.05 OUTLIER 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 124.135 0.974 . . . . 0.0 112.247 173.697 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 11.1 t -89.31 -27.84 20.26 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 124.09 0.956 . . . . 0.0 113.336 -175.303 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 65.5 mtt -130.89 134.66 46.98 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 125.67 1.588 . . . . 0.0 110.259 173.359 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -136.5 5.26 2.93 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 125.449 1.5 . . . . 0.0 113.924 -175.364 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -114.64 159.49 20.42 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.871 1.669 . . . . 0.0 113.003 -174.595 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 9.5 mtpm? . . . . . 0 N--CA 1.477 0.896 0 C-N-CA 125.739 1.616 . . . . 0.0 110.309 179.666 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.564 0 N-CA-C 111.221 -0.752 . . . . 0.0 111.221 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 23.8 t -144.22 135.17 25.22 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 124.833 1.253 . . . . 0.0 111.111 176.316 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 27.1 t-80 -154.96 158.26 38.95 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 125.471 1.508 . . . . 0.0 111.278 179.712 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 26.7 ttt -148.24 143.56 27.06 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 124.801 1.24 . . . . 0.0 111.841 178.615 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -130.79 152.5 50.06 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.644 1.177 . . . . 0.0 112.57 171.607 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 7.8 t -157.42 167.27 30.72 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 125.757 1.623 . . . . 0.0 110.585 173.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 64.6 ttp -122.64 128.15 50.26 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 125.44 1.496 . . . . 0.0 111.247 174.537 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -141.24 159.17 62.25 Favored Pre-proline 0 CA--C 1.547 0.861 0 C-N-CA 126.181 1.792 . . . . 0.0 111.098 178.167 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -71.17 -13.07 30.91 Favored 'Trans proline' 0 C--N 1.35 0.658 0 C-N-CA 122.777 2.318 . . . . 0.0 114.624 176.556 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 97.8 mt -107.64 45.96 0.97 Allowed 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 126.186 1.795 . . . . 0.0 112.918 -173.414 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 37.3 m-20 -105.49 -0.57 25.8 Favored 'General case' 0 N--CA 1.48 1.036 0 N-CA-C 114.67 1.359 . . . . 0.0 114.67 173.421 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -126.92 -58.8 1.29 Allowed 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 124.165 0.986 . . . . 0.0 113.625 -164.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.6 pp -109.19 5.37 9.24 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.786 0 C-N-CA 125.767 1.627 . . . . 0.0 113.227 -175.947 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 14.1 tt -45.57 -45.62 4.39 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.085 0 N-CA-C 115.398 1.629 . . . . 0.0 115.398 -170.638 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -144.74 22.86 1.6 Allowed 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 124.874 1.27 . . . . 0.0 112.892 -168.407 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -83.05 12.72 4.68 Favored 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 115.526 1.676 . . . . 0.0 115.526 -161.441 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 12.9 tt -146.23 26.51 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.913 0 C-N-CA 125.538 1.535 . . . . 0.0 113.7 -178.715 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -129.91 -46.02 1.15 Allowed 'General case' 0 N--CA 1.476 0.871 0 N-CA-C 114.195 1.183 . . . . 0.0 114.195 177.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 36.4 mmtt -146.22 145.98 30.61 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 126.241 1.816 . . . . 0.0 111.919 -169.443 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 5.9 mp0 -126.23 150.86 48.1 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 125.157 1.383 . . . . 0.0 111.697 172.7 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -156.67 172.2 19.01 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.517 1.527 . . . . 0.0 111.831 -174.896 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 -144.52 130.97 19.82 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 124.648 1.179 . . . . 0.0 110.676 176.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 13.9 m-20 -136.63 151.22 49.07 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 125.403 1.481 . . . . 0.0 111.471 -178.543 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 71.2 p -81.72 -7.0 59.55 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 115.257 1.577 . . . . 0.0 115.257 -176.649 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -174.69 98.65 0.13 Allowed Glycine 0 CA--C 1.527 0.827 0 O-C-N 121.892 -0.505 . . . . 0.0 113.509 170.081 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 15.0 p -144.55 135.89 21.1 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 C-N-CA 125.37 1.468 . . . . 0.0 110.761 172.75 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 61.9 m 61.54 156.75 0.04 OUTLIER 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 126.883 2.073 . . . . 0.0 115.478 178.428 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -140.18 17.62 2.43 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 116.199 1.925 . . . . 0.0 116.199 -176.647 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -151.38 113.32 3.03 Favored Pre-proline 0 CA--C 1.548 0.881 0 C-N-CA 124.465 1.106 . . . . 0.0 112.818 -175.411 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -87.07 -29.75 0.37 Allowed 'Trans proline' 0 CA--C 1.542 0.912 0 C-N-CA 122.836 2.357 . . . . 0.0 113.508 176.668 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 22.4 tp -153.07 64.86 0.77 Allowed 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 125.136 1.374 . . . . 0.0 111.201 -175.743 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 49.7 m 56.22 36.52 27.6 Favored 'General case' 0 N--CA 1.478 0.949 0 N-CA-C 114.742 1.386 . . . . 0.0 114.742 174.869 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 9.5 p -154.25 144.06 15.4 Favored Pre-proline 0 N--CA 1.474 0.757 0 C-N-CA 126.242 1.817 . . . . 0.0 109.45 -173.606 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 83.2 Cg_endo -76.61 64.99 7.48 Favored 'Trans proline' 0 CA--C 1.55 1.278 0 C-N-CA 123.534 2.822 . . . . 0.0 112.803 -177.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 34.5 tptt 58.25 114.96 0.02 OUTLIER Pre-proline 0 N--CA 1.482 1.125 0 C-N-CA 129.941 3.296 . . . . 0.0 114.331 -172.409 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 96.3 Cg_endo -75.12 145.31 30.9 Favored 'Trans proline' 0 CA--C 1.538 0.703 0 C-N-CA 122.774 2.316 . . . . 0.0 111.663 -178.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 17.9 ptmt -72.35 140.22 48.34 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 124.173 0.989 . . . . 0.0 112.744 -177.935 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 14.9 tp -140.55 140.16 35.14 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.95 1.7 . . . . 0.0 110.907 -173.857 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -148.39 48.42 1.04 Allowed 'General case' 0 N--CA 1.476 0.86 0 CA-C-O 122.85 1.309 . . . . 0.0 113.081 -179.353 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 -107.37 80.88 1.46 Allowed 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.977 1.311 . . . . 0.0 113.465 -171.744 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 65.0 mt -129.69 160.42 33.41 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 126.892 2.077 . . . . 0.0 112.17 173.756 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 18.8 t -73.21 168.4 19.2 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 123.579 0.752 . . . . 0.0 110.642 170.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -57.76 -46.94 83.84 Favored 'General case' 0 N--CA 1.475 0.791 0 O-C-N 120.49 -1.381 . . . . 0.0 112.657 -175.465 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 10.4 tt0 -70.79 -42.42 70.36 Favored 'General case' 0 N--CA 1.47 0.529 0 O-C-N 121.5 -0.75 . . . . 0.0 111.105 177.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 31.1 mm-40 -57.37 -45.71 84.13 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.952 0.901 . . . . 0.0 111.095 176.297 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 41.3 ttmt -61.49 -40.59 95.12 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 124.514 1.126 . . . . 0.0 111.292 177.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 56.4 mt -66.85 -40.42 85.81 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 CA-C-O 118.103 -0.951 . . . . 0.0 111.327 175.261 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 42.7 mt -63.51 -45.29 98.18 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.98 0 CA-C-N 120.828 1.649 . . . . 0.0 110.468 177.343 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -58.75 -48.91 79.57 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.359 1.064 . . . . 0.0 110.917 176.328 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -67.21 -52.1 45.3 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.97 1.308 . . . . 0.0 112.978 -179.19 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.9 mm-40 -60.84 -27.65 68.24 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-N 119.104 0.866 . . . . 0.0 112.793 -179.247 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -68.04 -58.15 4.96 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 123.392 0.677 . . . . 0.0 110.967 175.061 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 79.7 mt -62.6 -34.11 63.36 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.453 0 C-N-CA 126.649 1.979 . . . . 0.0 111.447 178.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -70.39 -25.86 63.44 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.105 0.962 . . . . 0.0 112.791 176.808 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -89.75 -39.11 13.35 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.26 1.024 . . . . 0.0 112.214 175.954 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.3 m -111.12 -5.2 11.21 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.147 0 N-CA-C 114.541 1.312 . . . . 0.0 114.541 -172.02 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 86.98 26.13 32.4 Favored Glycine 0 N--CA 1.473 1.117 0 C-N-CA 124.641 1.115 . . . . 0.0 115.737 159.508 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 55.9 10.98 0.63 Allowed 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 127.42 2.288 . . . . 0.0 115.18 -175.013 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 5.2 pt20 -124.06 -3.99 8.02 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 125.338 1.455 . . . . 0.0 113.573 -170.453 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 61.9 m-80 -122.01 0.4 9.66 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.09 1.356 . . . . 0.0 113.034 174.377 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 18.8 pt -76.86 154.52 5.63 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 C-N-CA 123.219 0.608 . . . . 0.0 111.597 176.364 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -139.16 145.05 38.89 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 125.045 1.338 . . . . 0.0 109.59 179.417 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -62.01 -27.58 68.97 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 118.875 0.761 . . . . 0.0 112.049 179.35 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -65.26 -49.94 76.15 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.432 0 C-N-CA 125.241 1.416 . . . . 0.0 109.888 175.179 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 76.5 m -78.49 -43.0 28.1 Favored 'General case' 0 C--O 1.222 -0.394 0 C-N-CA 123.685 0.794 . . . . 0.0 109.967 -175.04 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 24.2 tp -61.13 -34.35 74.85 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 124.962 1.305 . . . . 0.0 112.045 174.085 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.471 ' HA ' HG13 ' A' ' 66' ' ' ILE . 47.0 t -56.05 -31.51 63.23 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.149 0.98 . . . . 0.0 113.179 168.368 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -101.93 -19.06 15.4 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 125.254 1.422 . . . . 0.0 114.441 -175.565 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 68.8 mmtt -66.89 -40.35 87.74 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 124.386 1.074 . . . . 0.0 110.5 171.551 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.7 mp -106.74 -2.4 21.6 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.254 1.422 . . . . 0.0 114.438 -175.159 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 50.6 m-80 54.79 49.05 18.77 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 125.521 1.528 . . . . 0.0 112.457 -172.947 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.471 HG13 ' HA ' ' A' ' 61' ' ' SER . 15.3 pt -107.05 -162.01 0.15 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.662 0 C-N-CA 126.419 1.887 . . . . 0.0 110.994 -179.309 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 47.0 p -97.02 159.75 14.73 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 124.508 1.123 . . . . 0.0 111.316 167.125 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 93.5 t -62.06 -23.78 32.63 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.876 0 O-C-N 121.574 -0.704 . . . . 0.0 111.21 169.559 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 13.7 mp0 -81.43 -32.24 32.77 Favored 'General case' 0 CA--C 1.531 0.236 0 O-C-N 120.689 -1.257 . . . . 0.0 110.298 -176.654 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 41.0 mttm -66.79 -52.99 37.6 Favored 'General case' 0 C--N 1.346 0.43 0 CA-C-N 118.634 0.652 . . . . 0.0 110.256 165.044 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -57.8 -41.5 82.3 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 124.052 0.941 . . . . 0.0 112.362 -172.393 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt -73.36 -27.65 61.61 Favored 'General case' 0 N--CA 1.463 0.184 0 C-N-CA 125.489 1.516 . . . . 0.0 111.976 179.347 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -60.74 -45.37 94.57 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 118.067 0.394 . . . . 0.0 111.571 176.929 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 66.2 m-85 -59.96 -44.98 94.08 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 124.875 1.27 . . . . 0.0 111.046 179.153 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 95.3 mt -64.39 -29.58 47.75 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.709 0 C-N-CA 124.459 1.104 . . . . 0.0 111.308 -178.572 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 50.0 mmtt -83.21 -36.57 24.53 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 125.472 1.509 . . . . 0.0 113.509 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 5.7 p30 -93.75 -43.37 8.66 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 119.976 1.262 . . . . 0.0 112.004 -179.915 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 20.8 m -102.01 97.2 7.56 Favored 'General case' 0 C--O 1.231 0.088 0 C-N-CA 123.386 0.675 . . . . 0.0 111.27 -177.823 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 -140.49 -58.27 0.53 Allowed 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 113.461 0.912 . . . . 0.0 113.461 -174.118 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 2.2 mpt_? -79.01 -19.83 50.56 Favored 'General case' 0 N--CA 1.484 1.26 0 N-CA-C 113.453 0.908 . . . . 0.0 113.453 179.371 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 6.5 tt -60.54 -36.1 77.61 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 124.662 1.185 . . . . 0.0 111.371 174.314 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -90.57 9.01 78.9 Favored Glycine 0 CA--C 1.54 1.594 0 C-N-CA 125.026 1.298 . . . . 0.0 116.017 175.341 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 8.2 mmt85 -101.31 -88.96 0.36 Allowed 'General case' 0 N--CA 1.477 0.923 0 CA-C-N 119.253 1.526 . . . . 0.0 110.696 176.725 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 4.3 t -157.61 124.81 5.12 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 124.438 1.095 . . . . 0.0 110.709 178.507 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 6.3 p30 -150.83 15.16 0.75 Allowed 'General case' 0 CA--C 1.552 1.031 0 C-N-CA 125.708 1.603 . . . . 0.0 112.956 -176.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 47.8 t30 -99.29 44.73 1.01 Allowed 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 125.79 1.636 . . . . 0.0 112.198 -176.396 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 6.8 tp -149.89 163.71 37.32 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.164 1.385 . . . . 0.0 110.899 -177.485 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 58.6 pttt -121.8 12.43 10.57 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 126.182 1.793 . . . . 0.0 113.458 -171.373 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 14.6 t -148.85 125.76 11.25 Favored 'General case' 0 C--O 1.233 0.209 0 C-N-CA 125.043 1.337 . . . . 0.0 109.97 173.171 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -138.0 1.78 0.72 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.725 0 C-N-CA 125.86 1.664 . . . . 0.0 113.602 -177.932 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 63.22 14.82 55.23 Favored Glycine 0 CA--C 1.539 1.542 0 O-C-N 121.0 -1.063 . . . . 0.0 114.952 -172.7 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . 0.271 3.1 mt 53.89 42.27 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.991 0 C-N-CA 126.685 1.994 . . . . 0.0 111.818 175.293 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 11.4 tp 54.52 25.38 6.15 Favored 'General case' 0 CA--C 1.552 1.046 0 C-N-CA 126.4 1.88 . . . . 0.0 114.581 -179.836 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 33.3 mt-30 -133.15 23.4 4.15 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 125.628 1.571 . . . . 0.0 113.017 -167.772 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -74.66 -62.93 1.36 Allowed 'General case' 0 N--CA 1.475 0.783 0 O-C-N 120.974 -1.079 . . . . 0.0 112.404 -179.856 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 55.79 48.13 18.88 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 125.951 1.701 . . . . 0.0 114.885 -179.128 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 20.8 t -131.52 135.89 58.36 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 C-N-CA 124.929 1.292 . . . . 0.0 111.434 178.221 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 50.1 m 52.72 31.96 11.24 Favored 'General case' 0 N--CA 1.483 1.184 0 N-CA-C 116.018 1.859 . . . . 0.0 116.018 170.053 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 32.3 t -149.54 -46.44 0.14 Allowed 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 124.354 1.062 . . . . 0.0 112.614 178.812 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 62.5 mtt -127.02 51.94 1.83 Allowed 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 125.414 1.486 . . . . 0.0 111.163 179.741 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -77.96 50.87 0.91 Allowed 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 125.9 1.68 . . . . 0.0 112.488 -178.485 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -135.87 166.11 24.06 Favored 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 125.989 1.716 . . . . 0.0 112.943 -172.852 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 65.2 pttt -140.04 168.46 19.75 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 125.902 1.681 . . . . 0.0 112.589 176.297 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 9.3 t -132.48 165.12 25.05 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 125.915 1.686 . . . . 0.0 111.127 171.954 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 10.1 ttt -142.79 158.94 43.13 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 125.129 1.372 . . . . 0.0 112.031 -175.78 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 9.2 m -98.58 143.22 29.22 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 124.839 1.256 . . . . 0.0 111.429 176.248 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 18.7 m-90 . . . . . 0 C--O 1.252 1.22 0 C-N-CA 126.276 1.83 . . . . 0.0 111.734 171.366 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.641 0 N-CA-C 111.319 -0.712 . . . . 0.0 111.319 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 21.3 t -72.14 146.92 47.13 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.799 0.84 . . . . 0.0 112.557 179.457 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 35.3 t-80 -95.59 81.2 3.5 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 124.776 1.23 . . . . 0.0 110.929 179.082 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 59.6 ttp -146.3 133.23 20.2 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 125.075 1.35 . . . . 0.0 111.063 177.718 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -151.74 163.48 39.04 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 124.645 1.178 . . . . 0.0 112.335 174.282 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 80.2 p -142.61 135.64 28.37 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 124.698 1.199 . . . . 0.0 112.382 -175.933 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 58.6 ttm -159.53 129.64 5.61 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.598 1.559 . . . . 0.0 109.954 175.396 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 -136.68 153.58 75.93 Favored Pre-proline 0 CA--C 1.547 0.857 0 C-N-CA 125.049 1.34 . . . . 0.0 112.05 179.019 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 96.1 Cg_endo -79.56 -0.68 10.9 Favored 'Trans proline' 0 C--N 1.35 0.651 0 C-N-CA 123.581 2.854 . . . . 0.0 114.909 -178.718 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 89.1 mt -112.27 42.57 1.77 Allowed 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.899 1.68 . . . . 0.0 112.535 -174.584 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -112.6 0.8 15.54 Favored 'General case' 0 N--CA 1.478 0.969 0 N-CA-C 114.652 1.353 . . . . 0.0 114.652 175.761 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -117.4 -55.67 2.29 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 124.311 1.044 . . . . 0.0 113.175 -168.453 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -130.07 17.7 2.26 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.767 0 C-N-CA 126.138 1.775 . . . . 0.0 112.928 -175.301 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 9.9 tt -46.25 125.62 1.54 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 C-N-CA 124.461 1.105 . . . . 0.0 112.282 177.304 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -145.99 5.86 1.01 Allowed 'General case' 0 CA--C 1.545 0.759 0 N-CA-C 113.83 1.048 . . . . 0.0 113.83 -179.467 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -83.19 10.23 8.81 Favored 'General case' 0 CA--C 1.547 0.831 0 N-CA-C 114.553 1.316 . . . . 0.0 114.553 -172.55 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 7.1 tp -143.64 28.39 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.775 0 C-N-CA 126.607 1.963 . . . . 0.0 112.434 -177.416 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -126.8 -43.33 1.71 Allowed 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 114.523 1.305 . . . . 0.0 114.523 -178.438 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 13.5 ttpp -133.13 158.07 43.72 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 125.65 1.58 . . . . 0.0 112.659 -174.091 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -117.65 169.69 9.37 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 126.275 1.83 . . . . 0.0 111.966 176.49 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -149.35 155.06 39.9 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 126.01 1.724 . . . . 0.0 111.198 176.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 17.0 t-20 -81.98 -26.52 33.84 Favored 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 113.417 0.895 . . . . 0.0 113.417 -177.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 23.8 m-20 -138.52 142.11 39.32 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 126.429 1.892 . . . . 0.0 110.816 172.729 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 23.0 t -149.21 102.5 3.23 Favored 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 124.619 1.168 . . . . 0.0 109.86 172.309 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 128.29 -6.71 6.73 Favored Glycine 0 N--CA 1.476 1.32 0 C-N-CA 125.265 1.412 . . . . 0.0 115.821 174.676 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 7.5 p -137.58 126.55 34.31 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.6 0 C-N-CA 125.26 1.424 . . . . 0.0 110.86 178.098 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -155.64 158.66 38.69 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 124.779 1.232 . . . . 0.0 112.904 179.622 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 3.3 mp -98.93 88.37 3.97 Favored 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 126.044 1.738 . . . . 0.0 110.315 -175.46 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -150.84 105.19 3.03 Favored Pre-proline 0 CA--C 1.548 0.901 0 CA-C-N 115.513 -0.767 . . . . 0.0 112.395 -157.213 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -81.1 -37.5 0.3 Allowed 'Trans proline' 0 C--N 1.354 0.829 0 C-N-CA 122.481 2.12 . . . . 0.0 113.716 -174.399 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 18.3 mt -143.18 67.33 1.3 Allowed 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 125.67 1.588 . . . . 0.0 111.347 -175.89 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 1.4 t 56.65 35.19 25.76 Favored 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 114.253 1.205 . . . . 0.0 114.253 174.043 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 9.5 p -156.09 141.58 12.6 Favored Pre-proline 0 N--CA 1.472 0.625 0 C-N-CA 126.461 1.904 . . . . 0.0 109.393 -174.039 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -77.36 67.76 7.66 Favored 'Trans proline' 0 CA--C 1.547 1.147 0 C-N-CA 123.546 2.831 . . . . 0.0 112.099 -178.607 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 43.7 tptt 60.67 112.98 0.02 OUTLIER Pre-proline 0 N--CA 1.481 1.092 0 C-N-CA 129.472 3.109 . . . . 0.0 113.425 -172.788 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -69.55 147.66 64.72 Favored 'Trans proline' 0 CA--C 1.537 0.672 0 C-N-CA 122.617 2.211 . . . . 0.0 111.757 -175.767 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.96 139.67 57.25 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.021 0.928 . . . . 0.0 111.823 -176.897 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.6 tp -154.38 130.38 10.23 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 124.939 1.295 . . . . 0.0 111.746 176.113 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -137.23 129.41 29.44 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 126.212 1.805 . . . . 0.0 108.03 156.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -145.11 70.41 1.27 Allowed 'General case' 0 CA--C 1.54 0.57 0 CA-C-O 122.572 1.177 . . . . 0.0 110.188 -177.718 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 27.3 mt -125.28 155.64 39.85 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 126.233 1.813 . . . . 0.0 111.032 -170.279 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 19.2 t -72.0 170.52 13.66 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.29 0.636 . . . . 0.0 110.417 167.341 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -58.95 -47.37 85.32 Favored 'General case' 0 N--CA 1.473 0.678 0 O-C-N 120.479 -1.388 . . . . 0.0 112.404 -175.9 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 12.0 tt0 -70.06 -41.27 74.38 Favored 'General case' 0 N--CA 1.471 0.575 0 O-C-N 121.494 -0.754 . . . . 0.0 111.256 178.454 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 38.4 mm-40 -58.55 -44.23 89.57 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.831 1.252 . . . . 0.0 111.301 175.45 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 19.7 ttmm -63.14 -41.89 99.37 Favored 'General case' 0 N--CA 1.471 0.604 0 O-C-N 121.056 -1.028 . . . . 0.0 111.065 175.106 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 57.3 mt -67.61 -40.86 84.93 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 CA-C-O 117.713 -1.137 . . . . 0.0 111.879 178.583 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 34.8 mt -63.82 -43.89 98.02 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 CA-C-N 121.384 1.902 . . . . 0.0 109.954 176.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -59.39 -45.95 90.05 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.651 1.18 . . . . 0.0 110.91 177.214 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -66.45 -51.59 55.26 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.949 1.3 . . . . 0.0 112.984 176.55 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -58.18 -31.34 67.2 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 119.289 0.949 . . . . 0.0 112.752 179.716 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -66.5 -56.36 11.27 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 118.516 0.598 . . . . 0.0 110.748 177.492 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 84.1 mt -63.32 -33.26 60.12 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.417 0 C-N-CA 126.758 2.023 . . . . 0.0 111.478 177.72 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -71.54 -27.72 63.37 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 123.873 0.869 . . . . 0.0 112.552 176.825 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -87.54 -39.72 14.9 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.317 1.047 . . . . 0.0 112.206 176.47 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.4 m -108.27 -4.16 10.4 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.161 0 N-CA-C 114.221 1.193 . . . . 0.0 114.221 -173.854 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 84.47 23.03 52.41 Favored Glycine 0 N--CA 1.471 1.01 0 C-N-CA 125.134 1.35 . . . . 0.0 115.345 160.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 58.33 5.0 0.37 Allowed 'General case' 0 CA--C 1.554 1.126 0 C-N-CA 127.382 2.273 . . . . 0.0 115.104 -171.028 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 29.1 mt-30 -101.5 -16.22 16.87 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 125.66 1.584 . . . . 0.0 112.857 -172.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 42.3 m-80 -125.88 5.74 7.33 Favored 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 113.804 1.038 . . . . 0.0 113.804 -172.789 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 21.1 pt -77.61 154.09 5.36 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 O-C-N 121.776 -0.578 . . . . 0.0 111.781 174.678 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -140.02 142.74 36.21 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 124.777 1.231 . . . . 0.0 109.427 177.999 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -59.47 -26.3 65.12 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 119.252 0.933 . . . . 0.0 112.597 -179.121 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.9 mp -69.71 -42.31 80.25 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 C-N-CA 126.101 1.76 . . . . 0.0 110.864 175.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 95.9 m -80.9 -42.31 21.61 Favored 'General case' 0 C--O 1.224 -0.288 0 C-N-CA 123.472 0.709 . . . . 0.0 109.777 -179.133 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 14.5 tp -61.97 -37.96 86.73 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 125.978 1.711 . . . . 0.0 111.523 175.324 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.446 ' HA ' HG13 ' A' ' 66' ' ' ILE . 57.3 p -62.28 -23.81 66.93 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 113.363 0.875 . . . . 0.0 113.363 172.119 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 66.5 mttm -101.72 -28.48 12.45 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 125.221 1.409 . . . . 0.0 114.278 -176.432 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 10.7 mmtm -63.13 -33.23 75.02 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 125.396 1.479 . . . . 0.0 111.846 174.548 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.9 mt -118.75 0.81 11.52 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 126.531 1.932 . . . . 0.0 113.011 -169.497 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 42.5 m-80 53.69 59.07 4.56 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 126.222 1.809 . . . . 0.0 113.028 -178.288 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.446 HG13 ' HA ' ' A' ' 61' ' ' SER . 0.8 OUTLIER -131.47 175.39 11.35 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.717 0 C-N-CA 126.93 2.092 . . . . 0.0 111.693 -172.277 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -74.6 154.84 38.38 Favored 'General case' 0 N--CA 1.473 0.706 0 O-C-N 121.408 -0.807 . . . . 0.0 111.144 172.748 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 69.3 t -64.89 -27.65 42.94 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 C-N-CA 123.816 0.846 . . . . 0.0 111.565 171.406 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -79.69 -29.77 40.88 Favored 'General case' 0 N--CA 1.466 0.366 0 O-C-N 121.086 -1.008 . . . . 0.0 110.822 179.768 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 4.7 ttmm -72.82 -46.21 54.31 Favored 'General case' 0 C--N 1.341 0.201 0 C-N-CA 124.225 1.01 . . . . 0.0 110.717 171.619 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -60.49 -49.04 79.14 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 125.059 1.344 . . . . 0.0 112.621 178.355 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 18.3 ptmt -69.43 -27.03 64.91 Favored 'General case' 0 N--CA 1.469 0.475 0 O-C-N 121.165 -0.96 . . . . 0.0 111.471 -177.463 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -57.16 -36.3 70.59 Favored 'General case' 0 CA--C 1.549 0.909 0 CA-C-N 118.152 0.433 . . . . 0.0 112.135 177.539 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 29.5 m-85 -68.2 -45.17 74.1 Favored 'General case' 0 C--O 1.225 -0.19 0 C-N-CA 125.084 1.353 . . . . 0.0 110.744 175.659 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 56.1 mt -65.55 -33.6 64.73 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.562 0 C-N-CA 124.47 1.108 . . . . 0.0 111.145 -179.702 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 72.6 mmtt -75.49 -38.25 59.65 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 124.205 1.002 . . . . 0.0 112.609 -178.033 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 6.7 p30 -85.97 -44.92 11.96 Favored 'General case' 0 C--N 1.344 0.341 0 CA-C-N 119.514 1.052 . . . . 0.0 110.703 176.471 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 7.8 t -95.87 87.78 4.73 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-O 121.305 0.574 . . . . 0.0 110.408 -174.269 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -141.86 -50.99 0.41 Allowed 'General case' 0 CA--C 1.539 0.536 0 N-CA-C 113.907 1.077 . . . . 0.0 113.907 -171.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 3.2 mpt_? -80.04 -10.23 59.75 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 124.291 1.036 . . . . 0.0 113.515 -179.529 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.0 mt -76.53 -46.79 24.99 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.641 1.176 . . . . 0.0 112.675 175.701 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -88.28 105.9 3.18 Favored Glycine 0 CA--C 1.533 1.2 0 C-N-CA 123.781 0.705 . . . . 0.0 111.631 178.177 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 14.3 mmm-85 -113.69 157.45 22.16 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 125.356 1.463 . . . . 0.0 113.008 -169.183 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 6.9 t -71.42 -26.65 62.84 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 125.431 1.492 . . . . 0.0 113.526 -178.806 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 73.8 m-80 -83.17 121.82 27.57 Favored 'General case' 0 CA--C 1.541 0.624 0 O-C-N 121.559 -0.713 . . . . 0.0 112.126 -178.546 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 56.5 t30 -150.47 175.28 12.02 Favored 'General case' 0 CA--C 1.551 1.01 0 C-N-CA 126.886 2.075 . . . . 0.0 109.553 177.54 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 10.2 tp 58.87 32.57 22.37 Favored 'General case' 0 CA--C 1.551 0.985 0 C-N-CA 125.044 1.338 . . . . 0.0 113.473 178.564 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 17.2 ptmt -123.31 2.47 9.13 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 126.559 1.944 . . . . 0.0 114.244 -173.712 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 14.0 t -149.52 123.44 9.36 Favored 'General case' 0 N--CA 1.465 0.282 0 C-N-CA 125.138 1.375 . . . . 0.0 109.712 174.46 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -139.86 4.59 0.58 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.83 0 C-N-CA 126.016 1.726 . . . . 0.0 113.069 -178.078 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 69.84 5.73 53.1 Favored Glycine 0 CA--C 1.538 1.505 0 O-C-N 120.885 -1.134 . . . . 0.0 114.941 -171.042 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . 0.251 14.3 mm 53.81 31.57 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.139 0 C-N-CA 126.741 2.016 . . . . 0.0 112.117 176.061 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 11.9 tp 52.65 29.96 8.06 Favored 'General case' 0 CA--C 1.554 1.114 0 C-N-CA 126.415 1.886 . . . . 0.0 114.578 -178.896 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 7.2 pt20 -130.65 29.34 4.8 Favored 'General case' 0 N--CA 1.476 0.831 0 N-CA-C 114.358 1.244 . . . . 0.0 114.358 -173.608 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -128.11 142.24 51.26 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 124.707 1.203 . . . . 0.0 112.528 -175.748 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -82.73 60.28 5.2 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 125.78 1.632 . . . . 0.0 112.72 -174.304 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 88.8 t -137.64 148.24 25.81 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 C-N-CA 125.838 1.655 . . . . 0.0 110.524 -178.792 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 10.7 t 65.44 -54.65 0.34 Allowed 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 128.061 2.544 . . . . 0.0 115.735 179.03 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 50.0 m -65.56 -33.08 75.07 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 124.159 0.984 . . . . 0.0 112.316 176.629 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 22.4 mmt -138.6 143.67 39.45 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 126.759 2.024 . . . . 0.0 109.419 165.003 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 15.1 tt0 -146.55 3.37 0.86 Allowed 'General case' 0 CA--C 1.551 1.001 0 N-CA-C 113.573 0.953 . . . . 0.0 113.573 -179.332 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -81.96 153.24 26.36 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 124.767 1.227 . . . . 0.0 113.044 -177.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 75.8 mmtt -121.91 5.7 9.89 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 125.816 1.646 . . . . 0.0 113.99 179.551 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 42.0 p -81.95 159.01 23.69 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 125.463 1.505 . . . . 0.0 113.211 179.005 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 1.3 mpt? -86.19 151.68 23.45 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.796 1.238 . . . . 0.0 112.323 178.054 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 7.0 t -86.37 166.95 15.18 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 124.418 1.087 . . . . 0.0 112.229 168.637 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 48.4 t-105 . . . . . 0 C--O 1.253 1.255 0 C-N-CA 125.727 1.611 . . . . 0.0 112.671 -173.251 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.692 0 N-CA-C 112.09 -0.404 . . . . 0.0 112.09 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 35.9 t -143.41 -61.11 0.41 Allowed 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 124.357 1.063 . . . . 0.0 112.049 177.451 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 53.5 t60 -147.74 93.53 2.22 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.734 1.214 . . . . 0.0 110.371 175.348 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 16.7 ptp -145.45 37.97 1.13 Allowed 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 124.874 1.27 . . . . 0.0 113.332 -173.732 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -147.94 168.49 22.13 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.035 0.934 . . . . 0.0 113.406 -175.357 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 99.7 p -132.97 161.26 34.78 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 126.246 1.818 . . . . 0.0 111.98 -177.283 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 52.0 ttm -121.2 105.04 10.21 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 125.277 1.431 . . . . 0.0 109.98 -178.559 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -152.17 138.49 11.85 Favored Pre-proline 0 CA--C 1.551 1.002 0 C-N-CA 124.645 1.178 . . . . 0.0 111.749 -173.42 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 81.6 Cg_endo -82.8 -2.57 10.95 Favored 'Trans proline' 0 C--N 1.352 0.732 0 C-N-CA 123.287 2.658 . . . . 0.0 115.919 -176.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 67.3 mt -109.54 38.99 2.19 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 125.366 1.466 . . . . 0.0 113.227 -174.066 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -104.68 -0.49 27.44 Favored 'General case' 0 N--CA 1.48 1.035 0 N-CA-C 115.387 1.625 . . . . 0.0 115.387 175.454 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -115.68 -56.28 2.35 Favored 'General case' 0 N--CA 1.484 1.231 0 N-CA-C 113.598 0.962 . . . . 0.0 113.598 -167.534 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.9 pp -129.3 12.68 2.59 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.896 0 C-N-CA 126.005 1.722 . . . . 0.0 112.963 -171.599 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 12.9 tt -40.95 123.84 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.947 0 C-N-CA 125.646 1.579 . . . . 0.0 113.902 -177.419 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -153.67 120.85 5.76 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.452 1.501 . . . . 0.0 108.787 172.473 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 30.1 t0 -161.96 70.7 0.33 Allowed 'General case' 0 N--CA 1.469 0.51 0 CA-C-O 122.352 1.072 . . . . 0.0 109.148 -178.81 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 54.7 mt 53.41 63.01 0.21 Allowed 'Isoleucine or valine' 0 CA--C 1.548 0.867 0 C-N-CA 125.699 1.6 . . . . 0.0 110.414 -169.922 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 4.0 tmmm? -151.51 -44.98 0.11 Allowed 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.882 1.273 . . . . 0.0 112.325 176.245 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 62.0 mttm -109.04 164.93 11.98 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 126.104 1.762 . . . . 0.0 112.547 174.885 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -132.8 149.02 52.31 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 126.193 1.797 . . . . 0.0 110.91 -177.567 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -142.03 153.69 44.42 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.813 1.245 . . . . 0.0 112.677 -177.914 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 7.7 t30 -79.16 -32.64 44.36 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 123.704 0.801 . . . . 0.0 113.033 -178.09 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 -139.42 98.9 3.6 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 125.585 1.554 . . . . 0.0 110.181 -177.77 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 80.7 p -132.88 -5.78 3.15 Favored 'General case' 0 N--CA 1.479 1.023 0 N-CA-C 115.776 1.769 . . . . 0.0 115.776 -173.492 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -176.51 41.21 0.1 Allowed Glycine 0 CA--C 1.53 0.997 0 O-C-N 121.716 -0.615 . . . . 0.0 114.292 177.281 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 12.0 p -141.78 17.13 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.017 0 C-N-CA 125.319 1.448 . . . . 0.0 112.528 -165.355 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.411 HG22 ' H ' ' A' ' 22' ' ' LEU . 0.2 OUTLIER -117.88 166.99 11.82 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 125.503 1.521 . . . . 0.0 112.056 -172.074 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.411 ' H ' HG22 ' A' ' 21' ' ' THR . 17.7 mt -81.05 28.09 0.37 Allowed 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 127.202 2.201 . . . . 0.0 114.133 -166.785 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -153.4 116.25 2.72 Favored Pre-proline 0 CA--C 1.548 0.894 0 C-N-CA 124.926 1.29 . . . . 0.0 112.286 -163.356 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_endo -84.42 -29.12 0.9 Allowed 'Trans proline' 0 CA--C 1.541 0.846 0 C-N-CA 122.653 2.236 . . . . 0.0 113.898 -178.771 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 17.6 tp -150.71 58.92 0.93 Allowed 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 124.517 1.127 . . . . 0.0 111.962 -173.207 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 1.9 t 56.95 36.92 28.42 Favored 'General case' 0 N--CA 1.48 1.029 0 N-CA-C 114.255 1.205 . . . . 0.0 114.255 179.647 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 7.4 p -155.3 141.26 12.86 Favored Pre-proline 0 N--CA 1.472 0.63 0 C-N-CA 126.215 1.806 . . . . 0.0 109.186 -175.502 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 93.0 Cg_endo -78.3 64.13 8.42 Favored 'Trans proline' 0 CA--C 1.549 1.256 0 C-N-CA 123.496 2.797 . . . . 0.0 112.716 -175.497 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 25.1 tptp 58.55 114.87 0.02 OUTLIER Pre-proline 0 N--CA 1.484 1.274 0 C-N-CA 129.392 3.077 . . . . 0.0 113.022 -168.535 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_endo -74.21 147.49 37.73 Favored 'Trans proline' 0 CA--C 1.538 0.681 0 C-N-CA 122.287 1.991 . . . . 0.0 111.977 -177.434 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 26.8 mmmt -61.8 143.36 56.41 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 124.763 1.225 . . . . 0.0 111.28 175.204 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.489 HD23 HD21 ' A' ' 73' ' ' ASN . 14.0 tp -138.8 137.26 36.48 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.988 1.315 . . . . 0.0 111.044 -177.913 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -139.54 114.97 9.87 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 125.48 1.512 . . . . 0.0 108.878 167.431 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -146.59 40.55 1.1 Allowed 'General case' 0 N--CA 1.476 0.855 0 CA-C-O 122.986 1.374 . . . . 0.0 114.148 -176.331 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 70.5 mt -106.69 149.91 26.79 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 125.28 1.432 . . . . 0.0 112.705 -173.113 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 28.1 m -73.43 166.94 22.28 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 124.2 1.0 . . . . 0.0 110.332 170.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -54.37 -43.63 71.52 Favored 'General case' 0 N--CA 1.474 0.765 0 O-C-N 121.132 -0.98 . . . . 0.0 113.052 -175.246 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 8.3 pt20 -75.06 -35.46 61.85 Favored 'General case' 0 N--CA 1.471 0.621 0 O-C-N 121.472 -0.767 . . . . 0.0 112.532 176.603 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 15.6 mm-40 -66.73 -41.09 88.44 Favored 'General case' 0 CA--C 1.537 0.445 0 O-C-N 121.686 -0.634 . . . . 0.0 110.487 179.789 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 15.3 ttmm -59.5 -41.68 90.46 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 123.867 0.867 . . . . 0.0 111.114 174.116 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 56.8 mt -68.41 -39.5 80.89 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.656 0 CA-C-O 117.856 -1.069 . . . . 0.0 111.388 176.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 27.5 mt -66.58 -42.42 89.91 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.976 0 CA-C-N 121.254 1.843 . . . . 0.0 110.629 178.003 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -55.47 -48.57 74.33 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 124.092 0.957 . . . . 0.0 110.017 175.004 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -67.55 -52.28 40.67 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.763 1.225 . . . . 0.0 113.659 178.649 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 52.8 mt-10 -60.15 -29.06 68.41 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-N 119.077 0.853 . . . . 0.0 112.889 -179.048 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -69.11 -54.04 17.08 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 118.613 0.642 . . . . 0.0 111.216 177.149 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 46.5 mt -61.01 -33.92 57.77 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.537 0 C-N-CA 125.281 1.432 . . . . 0.0 111.342 174.281 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -70.21 -22.83 62.88 Favored 'General case' 0 CA--C 1.546 0.816 0 O-C-N 121.211 -0.931 . . . . 0.0 113.064 175.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -93.03 -32.78 14.37 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.794 1.237 . . . . 0.0 112.916 178.644 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 4.7 m -121.9 -19.09 4.61 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.953 0 CA-C-N 119.595 1.089 . . . . 0.0 113.832 -174.006 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 86.18 142.19 6.59 Favored Glycine 0 CA--C 1.532 1.154 0 C-N-CA 125.247 1.404 . . . . 0.0 112.7 -171.787 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 46.4 tp -57.84 -19.75 31.19 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 125.484 1.514 . . . . 0.0 114.406 -177.432 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 35.9 mt-30 -80.75 -17.01 52.36 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 126.911 2.084 . . . . 0.0 113.033 -179.884 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 68.9 m-80 -115.81 -8.68 11.96 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 114.837 1.421 . . . . 0.0 114.837 -173.402 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 20.9 pt -68.21 156.8 6.75 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.546 0 C-N-CA 123.388 0.675 . . . . 0.0 111.736 169.871 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -131.25 149.61 52.5 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 124.269 1.027 . . . . 0.0 111.175 177.028 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -64.3 -27.07 68.78 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 123.645 0.778 . . . . 0.0 111.939 178.442 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -66.57 -50.21 68.5 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.399 0 C-N-CA 124.6 1.16 . . . . 0.0 109.13 173.882 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 82.9 m -73.01 -43.2 62.41 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 123.373 0.669 . . . . 0.0 110.868 -176.743 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 20.2 tp -63.95 -34.92 79.07 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.14 1.376 . . . . 0.0 111.862 176.101 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.508 ' HA ' HG13 ' A' ' 66' ' ' ILE . 25.7 t -55.8 -30.21 60.98 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 124.836 1.255 . . . . 0.0 112.727 169.629 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 11.8 mptt -100.52 -28.7 12.76 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 125.373 1.469 . . . . 0.0 113.51 -175.531 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 15.9 mmtm -64.46 -38.13 89.96 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.932 1.293 . . . . 0.0 111.373 177.868 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.3 mp -111.37 7.72 21.03 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 125.013 1.325 . . . . 0.0 113.823 -178.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 17.0 t30 55.01 57.01 5.96 Favored 'General case' 0 CA--C 1.552 1.052 0 CA-C-O 122.393 1.092 . . . . 0.0 111.605 177.185 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.508 HG13 ' HA ' ' A' ' 61' ' ' SER . 3.4 pt -127.57 -168.8 0.58 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.772 0 C-N-CA 126.617 1.967 . . . . 0.0 110.424 -173.627 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 41.7 p -89.25 160.63 16.83 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 123.935 0.894 . . . . 0.0 111.594 171.446 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 64.7 t -64.5 -23.67 33.92 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.944 0 O-C-N 121.658 -0.651 . . . . 0.0 111.209 168.406 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 26.3 mm-40 -78.61 -35.06 46.19 Favored 'General case' 0 N--CA 1.464 0.267 0 O-C-N 120.815 -1.178 . . . . 0.0 110.387 -177.481 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 35.2 mttm -65.05 -54.18 34.18 Favored 'General case' 0 C--N 1.346 0.432 0 CA-C-N 118.446 0.566 . . . . 0.0 110.587 166.836 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -56.75 -45.19 82.18 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.931 1.292 . . . . 0.0 112.311 -173.022 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 22.5 ttmm -68.65 -32.34 72.11 Favored 'General case' 0 CA--C 1.519 -0.228 0 C-N-CA 124.537 1.135 . . . . 0.0 111.203 178.459 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . 0.489 HD21 HD23 ' A' ' 32' ' ' LEU . 0.0 OUTLIER -63.34 -37.97 89.33 Favored 'General case' 0 CA--C 1.546 0.806 0 CA-C-O 118.793 -0.622 . . . . 0.0 112.578 179.575 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 79.5 m-85 -62.9 -42.91 99.95 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.52 1.128 . . . . 0.0 110.749 174.648 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 87.4 mt -71.03 -22.66 22.91 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.755 0 C-N-CA 125.057 1.343 . . . . 0.0 111.24 179.36 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 75.7 tttt -89.65 -32.96 16.83 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 125.572 1.549 . . . . 0.0 112.721 -177.885 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 8.9 p30 -86.92 -39.39 15.8 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 118.938 0.79 . . . . 0.0 111.617 170.918 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -109.55 102.57 11.41 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-O 121.398 0.618 . . . . 0.0 111.097 -174.196 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -154.75 143.78 21.0 Favored 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 112.517 0.562 . . . . 0.0 112.517 -178.098 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 39.5 mmt-85 53.31 8.27 0.11 Allowed 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 126.698 1.999 . . . . 0.0 115.928 -176.14 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 34.3 tp -132.41 -39.42 1.02 Allowed 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 125.676 1.59 . . . . 0.0 113.165 -167.118 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -78.37 76.78 1.79 Allowed Glycine 0 CA--C 1.536 1.367 0 C-N-CA 123.367 0.508 . . . . 0.0 113.431 -179.651 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 56.4 mmt-85 -87.38 157.81 19.16 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 125.06 1.344 . . . . 0.0 110.758 175.315 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 10.2 t -65.29 107.14 1.52 Allowed 'General case' 0 N--CA 1.472 0.634 0 CA-C-O 122.169 0.985 . . . . 0.0 111.872 178.051 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 38.9 m-80 -133.77 146.57 50.84 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.961 1.704 . . . . 0.0 110.849 176.723 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 8.4 t30 -149.95 -53.25 0.15 Allowed 'General case' 0 N--CA 1.474 0.75 0 N-CA-C 113.521 0.934 . . . . 0.0 113.521 175.198 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 6.6 mt -152.17 169.54 22.18 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 127.554 2.341 . . . . 0.0 110.624 -179.587 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 56.5 pttt -125.97 14.34 7.93 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 126.303 1.841 . . . . 0.0 113.513 -178.058 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 14.7 t -150.42 130.23 13.28 Favored 'General case' 0 C--O 1.234 0.257 0 C-N-CA 125.578 1.551 . . . . 0.0 109.628 175.365 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -137.49 3.93 0.77 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.764 0 C-N-CA 126.023 1.729 . . . . 0.0 113.72 -175.386 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 69.29 7.08 56.68 Favored Glycine 0 CA--C 1.538 1.494 0 O-C-N 120.768 -1.208 . . . . 0.0 115.049 -173.195 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . 0.275 42.3 mm 58.72 26.3 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.029 0 C-N-CA 125.977 1.711 . . . . 0.0 112.608 173.489 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 10.6 tp 58.55 21.42 8.6 Favored 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 126.551 1.94 . . . . 0.0 114.844 -177.951 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 35.7 mt-30 -96.23 58.97 1.87 Allowed 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 125.555 1.542 . . . . 0.0 112.061 -176.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 22.1 mm-40 -81.09 -45.71 16.07 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 123.976 0.911 . . . . 0.0 113.051 -177.423 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . 0.256 35.9 mt-10 52.65 38.96 27.41 Favored 'General case' 0 N--CA 1.48 1.062 0 N-CA-C 116.868 2.173 . . . . 0.0 116.868 172.139 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 33.1 t -81.7 146.82 6.74 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.327 0 C-N-CA 124.841 1.257 . . . . 0.0 111.671 -176.253 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 50.8 m 57.44 26.63 12.82 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 126.694 1.997 . . . . 0.0 115.252 177.721 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 23.2 t -149.65 -41.82 0.14 Allowed 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.559 1.144 . . . . 0.0 112.79 176.337 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 30.3 tpp -123.95 37.32 4.43 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 125.298 1.439 . . . . 0.0 111.889 -179.536 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -76.54 75.23 3.26 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 125.339 1.455 . . . . 0.0 111.504 -176.584 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -144.44 162.86 35.45 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 126.342 1.857 . . . . 0.0 111.979 -178.187 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 67.3 mttm -107.78 142.22 38.15 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 125.643 1.577 . . . . 0.0 111.53 178.292 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 80.5 p -153.86 165.17 36.9 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 125.433 1.493 . . . . 0.0 112.319 -178.479 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 99.1 mtp -137.96 159.87 40.87 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 125.64 1.576 . . . . 0.0 111.897 179.946 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 10.9 t -106.99 166.53 10.54 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 125.49 1.516 . . . . 0.0 111.864 170.663 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 29.8 t-105 . . . . . 0 C--O 1.253 1.239 0 C-N-CA 125.624 1.57 . . . . 0.0 112.827 -171.581 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.575 0 N-CA-C 111.576 -0.609 . . . . 0.0 111.576 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 50.0 m -113.74 137.68 51.29 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 124.855 1.262 . . . . 0.0 112.317 -176.202 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 90.4 m-70 -135.6 -35.47 0.8 Allowed 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 124.828 1.251 . . . . 0.0 113.745 179.462 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 9.2 tpt -145.13 130.7 18.86 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 124.797 1.239 . . . . 0.0 110.894 178.967 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -152.91 168.79 24.64 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 124.384 1.073 . . . . 0.0 112.849 -176.438 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 5.3 t -114.11 167.99 10.2 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.683 1.593 . . . . 0.0 111.907 174.095 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.8 ttt -116.98 123.19 46.31 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 125.511 1.524 . . . . 0.0 111.018 -177.555 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 -141.24 147.02 45.29 Favored Pre-proline 0 CA--C 1.549 0.916 0 C-N-CA 125.241 1.417 . . . . 0.0 112.277 -175.955 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_endo -79.79 -22.42 7.66 Favored 'Trans proline' 0 C--N 1.35 0.641 0 C-N-CA 123.303 2.669 . . . . 0.0 115.199 -175.762 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 96.9 mt -113.17 42.43 1.92 Allowed 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.981 1.713 . . . . 0.0 112.084 -173.566 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -109.13 0.28 19.73 Favored 'General case' 0 N--CA 1.474 0.728 0 N-CA-C 114.661 1.356 . . . . 0.0 114.661 -177.927 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -126.26 -56.1 1.43 Allowed 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 124.574 1.149 . . . . 0.0 113.423 -164.308 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.9 pp -124.39 13.05 4.78 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 C-N-CA 126.223 1.809 . . . . 0.0 112.772 -173.478 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 11.4 tt -44.23 109.87 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.48 1.068 0 C-N-CA 125.693 1.597 . . . . 0.0 113.345 -177.602 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -150.95 14.95 0.73 Allowed 'General case' 0 N--CA 1.476 0.84 0 N-CA-C 115.173 1.546 . . . . 0.0 115.173 -177.373 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -86.3 8.84 19.77 Favored 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 115.15 1.537 . . . . 0.0 115.15 -170.346 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 6.8 tp -143.45 22.35 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.96 0 C-N-CA 125.547 1.539 . . . . 0.0 114.26 -173.153 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 50.1 mtmt -118.67 -44.17 2.65 Favored 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 114.508 1.299 . . . . 0.0 114.508 179.333 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 63.2 mttp 46.0 36.99 3.32 Favored 'General case' 0 N--CA 1.488 1.442 0 C-N-CA 125.91 1.684 . . . . 0.0 114.208 -175.538 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 55.43 93.84 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 127.086 2.154 . . . . 0.0 113.304 -169.329 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -146.44 156.85 43.6 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 125.069 1.347 . . . . 0.0 112.081 179.288 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -84.4 51.65 2.15 Favored 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 125.041 1.337 . . . . 0.0 112.037 -177.937 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -136.59 132.46 35.16 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 125.66 1.584 . . . . 0.0 111.408 -178.97 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 66.0 m -137.45 94.0 2.87 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 125.155 1.382 . . . . 0.0 110.593 -177.31 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 84.72 104.93 0.62 Allowed Glycine 0 CA--C 1.534 1.231 0 C-N-CA 125.198 1.38 . . . . 0.0 112.558 -178.021 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 61.2 t -108.36 -1.56 9.94 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.219 0 C-N-CA 125.46 1.504 . . . . 0.0 113.07 -175.222 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -137.57 168.81 18.91 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 125.017 1.327 . . . . 0.0 113.017 -166.917 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 17.4 mt -79.01 16.79 0.84 Allowed 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 126.756 2.022 . . . . 0.0 115.018 -168.189 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -156.73 102.03 1.98 Allowed Pre-proline 0 CA--C 1.547 0.828 0 C-N-CA 125.312 1.445 . . . . 0.0 111.478 -163.301 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_endo -79.44 -39.68 0.3 Allowed 'Trans proline' 0 CA--C 1.539 0.756 0 C-N-CA 122.422 2.081 . . . . 0.0 112.774 -179.226 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 15.3 mt -145.56 84.16 1.68 Allowed 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 126.003 1.721 . . . . 0.0 110.697 178.239 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . 0.253 54.8 p 52.59 28.92 6.57 Favored 'General case' 0 N--CA 1.477 0.876 0 N-CA-C 116.602 2.075 . . . . 0.0 116.602 167.974 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 4.6 p -155.0 145.91 16.4 Favored Pre-proline 0 N--CA 1.475 0.789 0 C-N-CA 126.612 1.965 . . . . 0.0 109.891 -174.084 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_endo -74.73 70.13 5.15 Favored 'Trans proline' 0 CA--C 1.547 1.152 0 C-N-CA 123.575 2.85 . . . . 0.0 112.484 178.882 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 34.8 tptt 60.2 110.48 0.02 OUTLIER Pre-proline 0 N--CA 1.482 1.133 0 C-N-CA 129.823 3.249 . . . . 0.0 114.096 -175.577 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_endo -73.46 150.74 46.76 Favored 'Trans proline' 0 C--N 1.352 0.735 0 C-N-CA 122.906 2.404 . . . . 0.0 111.928 -178.069 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -70.72 140.67 51.47 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 123.989 0.915 . . . . 0.0 111.788 -178.758 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 13.1 tp -142.67 138.82 30.9 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 125.683 1.593 . . . . 0.0 110.59 -177.134 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -147.57 39.3 0.97 Allowed 'General case' 0 N--CA 1.478 0.959 0 CA-C-O 123.105 1.431 . . . . 0.0 113.951 179.162 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 29.6 mt-10 -92.3 80.4 4.98 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 125.562 1.545 . . . . 0.0 112.081 -173.684 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.8 mt -124.96 158.76 32.82 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 127.293 2.237 . . . . 0.0 110.517 -178.234 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 26.0 p -68.98 169.76 11.1 Favored 'General case' 0 N--CA 1.478 0.969 0 O-C-N 121.82 -0.55 . . . . 0.0 111.159 167.713 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -56.85 -44.36 82.05 Favored 'General case' 0 N--CA 1.473 0.71 0 O-C-N 120.909 -1.12 . . . . 0.0 111.766 176.377 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 9.3 tt0 -70.89 -44.91 65.32 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 123.587 0.755 . . . . 0.0 111.44 177.53 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 90.6 mt-30 -63.79 -37.19 86.43 Favored 'General case' 0 CA--C 1.534 0.363 0 O-C-N 121.722 -0.612 . . . . 0.0 111.777 179.433 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 23.6 ttmm -62.21 -43.5 98.68 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 123.805 0.842 . . . . 0.0 111.105 174.053 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 51.5 mt -65.24 -44.81 95.05 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 CA-C-N 119.021 0.828 . . . . 0.0 111.176 176.722 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 49.3 mt -64.81 -45.26 95.56 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 CA-C-N 120.095 1.316 . . . . 0.0 110.352 -179.711 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -57.09 -49.03 77.13 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 124.783 1.233 . . . . 0.0 110.357 176.838 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -65.94 -52.62 48.2 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 124.436 1.094 . . . . 0.0 112.601 179.116 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 18.7 mm-40 -60.96 -26.04 67.26 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 119.161 0.891 . . . . 0.0 113.089 -179.375 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.493 ' CE2' HG22 ' A' ' 55' ' ' ILE . 1.6 t80 -70.99 -59.12 2.96 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 123.979 0.912 . . . . 0.0 111.228 175.075 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 54.2 mt -60.12 -34.48 57.0 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 C-N-CA 126.229 1.812 . . . . 0.0 111.984 177.051 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -69.68 -24.82 63.65 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 123.953 0.901 . . . . 0.0 112.775 176.899 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -92.87 -29.41 15.95 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.497 1.119 . . . . 0.0 113.184 179.182 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 5.1 m -123.74 -22.82 2.6 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.981 0 N-CA-C 114.202 1.186 . . . . 0.0 114.202 -174.597 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 86.86 144.34 8.39 Favored Glycine 0 CA--C 1.534 1.275 0 C-N-CA 125.183 1.373 . . . . 0.0 113.373 -172.851 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -69.41 -5.37 23.2 Favored 'General case' 0 N--CA 1.478 0.967 0 N-CA-C 114.706 1.372 . . . . 0.0 114.706 -166.588 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 3.0 pm0 -101.54 -6.06 24.38 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 125.415 1.486 . . . . 0.0 114.087 173.63 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 76.4 m-20 -107.5 -12.08 15.36 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 124.57 1.148 . . . . 0.0 113.759 175.935 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.493 HG22 ' CE2' ' A' ' 46' ' ' TYR . 40.5 pt -68.07 157.49 6.28 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 C-N-CA 123.949 0.899 . . . . 0.0 111.27 164.691 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.3 p -124.54 144.24 50.24 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 125.002 1.321 . . . . 0.0 110.292 174.299 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -61.81 -30.77 71.05 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 124.182 0.993 . . . . 0.0 111.103 175.892 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -61.42 -58.33 8.06 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.256 0 C-N-CA 124.772 1.229 . . . . 0.0 108.565 174.811 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 46.7 m -69.91 -41.35 74.81 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 123.255 0.622 . . . . 0.0 110.649 -174.413 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 24.4 tp -60.94 -36.38 79.21 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 123.631 0.772 . . . . 0.0 112.032 174.197 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.468 ' HA ' HG13 ' A' ' 66' ' ' ILE . 10.8 p -62.21 -19.63 63.34 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 113.859 1.059 . . . . 0.0 113.859 173.667 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -105.21 -25.19 12.56 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 125.244 1.418 . . . . 0.0 114.665 176.299 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 22.1 mmtt -62.35 -35.8 80.24 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-N 119.778 1.172 . . . . 0.0 110.951 172.404 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 85.8 mt -113.8 -1.33 13.94 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 125.92 1.688 . . . . 0.0 114.029 -171.324 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 32.2 m-80 56.7 61.51 2.62 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 126.066 1.746 . . . . 0.0 113.386 -177.089 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.468 HG13 ' HA ' ' A' ' 61' ' ' SER . 0.5 OUTLIER -135.97 176.64 7.84 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.907 0 C-N-CA 126.486 1.915 . . . . 0.0 112.118 -171.0 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -71.22 154.19 41.86 Favored 'General case' 0 N--CA 1.476 0.829 0 O-C-N 121.307 -0.871 . . . . 0.0 111.535 173.007 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 86.3 t -65.13 -24.47 35.38 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 C-N-CA 124.084 0.954 . . . . 0.0 111.839 175.35 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 75.4 mm-40 -85.97 -35.36 20.47 Favored 'General case' 0 N--CA 1.469 0.484 0 O-C-N 120.907 -1.12 . . . . 0.0 110.67 176.942 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 45.3 tttt -65.01 -42.52 94.36 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 123.521 0.728 . . . . 0.0 111.117 177.904 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -58.56 -40.31 82.73 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 125.095 1.358 . . . . 0.0 112.296 170.617 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 23.0 ttpt -70.0 -32.17 70.22 Favored 'General case' 0 C--O 1.224 -0.261 0 C-N-CA 124.672 1.189 . . . . 0.0 111.29 -178.943 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -57.53 -37.69 73.48 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 123.168 0.587 . . . . 0.0 112.511 179.921 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 63.5 m-85 -66.25 -44.26 84.2 Favored 'General case' 0 N--CA 1.464 0.227 0 C-N-CA 125.088 1.355 . . . . 0.0 110.424 178.151 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 74.6 mt -64.62 -45.86 94.19 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.437 0 C-N-CA 124.751 1.22 . . . . 0.0 109.51 178.371 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 22.7 mmmt -65.72 -32.47 74.04 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 125.449 1.5 . . . . 0.0 112.712 -175.746 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 6.5 p30 -91.38 -39.02 12.24 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 119.259 0.936 . . . . 0.0 111.763 176.539 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 2.3 t -95.37 -9.17 33.6 Favored 'General case' 0 N--CA 1.474 0.745 0 N-CA-C 115.56 1.689 . . . . 0.0 115.56 -163.66 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 7.1 p30 -61.36 143.84 55.06 Favored 'General case' 0 CA--C 1.55 0.971 0 O-C-N 120.362 -1.461 . . . . 0.0 114.065 -176.401 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 1.9 mpp_? 54.33 17.55 1.57 Allowed 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 127.935 2.494 . . . . 0.0 116.224 -169.353 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.8 tt -136.87 -42.02 0.59 Allowed 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.066 0.946 . . . . 0.0 113.069 -177.977 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -77.31 71.44 2.27 Favored Glycine 0 CA--C 1.534 1.279 0 C-N-CA 124.115 0.864 . . . . 0.0 114.681 -176.553 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 48.4 mtp85 -130.48 -79.11 0.54 Allowed 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 125.038 1.335 . . . . 0.0 111.904 173.129 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 3.1 t -159.29 132.55 7.12 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 124.804 1.242 . . . . 0.0 110.67 -179.903 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 63.2 m-80 -137.93 -0.56 2.08 Favored 'General case' 0 CA--C 1.551 0.996 0 C-N-CA 124.741 1.216 . . . . 0.0 113.633 -175.906 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 2.4 p-10 -100.99 15.75 27.64 Favored 'General case' 0 CA--C 1.549 0.927 0 N-CA-C 115.303 1.594 . . . . 0.0 115.303 -165.056 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -105.99 -1.73 23.64 Favored 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 114.988 1.477 . . . . 0.0 114.988 -170.377 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -131.35 14.33 5.06 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 126.131 1.772 . . . . 0.0 114.08 178.739 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 15.4 t -154.73 117.54 4.37 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 125.539 1.536 . . . . 0.0 109.525 178.351 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -141.43 2.23 0.47 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.808 0 N-CA-C 114.202 1.186 . . . . 0.0 114.202 -174.875 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 67.28 5.14 33.43 Favored Glycine 0 CA--C 1.54 1.653 0 O-C-N 120.841 -1.162 . . . . 0.0 115.138 -173.014 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . 0.281 2.9 mp 48.5 37.65 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.549 0.932 0 C-N-CA 127.52 2.328 . . . . 0.0 111.99 -179.9 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 11.3 tp 53.18 25.76 4.54 Favored 'General case' 0 CA--C 1.553 1.059 0 C-N-CA 126.988 2.115 . . . . 0.0 115.272 178.62 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -132.88 64.9 1.6 Allowed 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 125.24 1.416 . . . . 0.0 112.012 -168.091 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 63.2 mm-40 -84.44 -39.24 19.2 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 124.116 0.966 . . . . 0.0 113.165 176.733 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 42.6 59.44 2.76 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 127.082 2.153 . . . . 0.0 115.09 175.46 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 12.3 t -77.23 61.04 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 C-N-CA 126.385 1.874 . . . . 0.0 112.277 -172.017 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 27.5 t -165.39 -42.73 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 125.375 1.47 . . . . 0.0 112.112 176.809 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 46.3 m -126.01 -22.71 4.07 Favored 'General case' 0 N--CA 1.479 0.999 0 N-CA-C 115.055 1.502 . . . . 0.0 115.055 -173.066 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 60.9 mtt -137.53 40.16 2.42 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 124.798 1.239 . . . . 0.0 111.72 -176.244 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 28.5 tt0 -77.2 70.39 3.59 Favored 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 126.168 1.787 . . . . 0.0 112.001 -176.202 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -143.84 149.78 37.48 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.153 1.381 . . . . 0.0 112.706 -178.922 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -133.95 -26.14 1.55 Allowed 'General case' 0 N--CA 1.483 1.189 0 N-CA-C 114.943 1.461 . . . . 0.0 114.943 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 78.8 p -149.17 160.96 42.9 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 125.201 1.4 . . . . 0.0 112.373 -177.793 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 97.9 mtp -140.21 154.16 46.81 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 125.501 1.52 . . . . 0.0 111.898 -178.976 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 9.1 t -88.42 167.65 13.3 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 124.5 1.12 . . . . 0.0 112.046 168.648 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 19.4 t-105 . . . . . 0 C--O 1.253 1.243 0 C-N-CA 125.414 1.486 . . . . 0.0 113.104 -170.907 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.543 0 N-CA-C 112.238 -0.345 . . . . 0.0 112.238 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 79.5 p -139.55 160.14 40.55 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 125.802 1.641 . . . . 0.0 111.821 178.181 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 47.7 t60 -146.29 147.56 31.51 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 124.402 1.081 . . . . 0.0 112.188 -176.155 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 11.7 tpt 47.57 59.49 4.1 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 126.346 1.858 . . . . 0.0 114.024 176.311 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -140.78 148.52 40.77 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.315 1.046 . . . . 0.0 113.383 -177.89 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 58.4 m -147.31 134.2 20.19 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 126.251 1.82 . . . . 0.0 110.817 -174.955 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 95.2 mtp -144.76 137.14 26.26 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 125.359 1.464 . . . . 0.0 110.815 177.444 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 17.6 m-20 -143.3 119.77 6.64 Favored Pre-proline 0 CA--C 1.549 0.924 0 C-N-CA 124.813 1.245 . . . . 0.0 111.405 178.252 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_endo -84.47 -12.1 7.92 Favored 'Trans proline' 0 C--N 1.351 0.661 0 C-N-CA 123.417 2.745 . . . . 0.0 115.173 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -107.9 29.66 7.06 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 125.549 1.539 . . . . 0.0 114.387 -166.601 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -104.66 -6.72 20.17 Favored 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 116.149 1.907 . . . . 0.0 116.149 -173.124 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.14 -28.55 1.71 Allowed 'General case' 0 N--CA 1.481 1.088 0 N-CA-C 117.059 2.244 . . . . 0.0 117.059 -169.482 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.3 pp -134.63 14.14 1.18 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.338 0 C-N-CA 125.545 1.538 . . . . 0.0 113.682 -178.036 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -56.1 114.02 0.59 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.848 0 C-N-CA 124.987 1.315 . . . . 0.0 111.792 -173.213 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -146.91 0.26 0.73 Allowed 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 113.862 1.06 . . . . 0.0 113.862 179.692 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -81.37 2.85 26.58 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 115.372 1.619 . . . . 0.0 115.372 -163.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 13.1 tt -145.31 24.71 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 C-N-CA 125.907 1.683 . . . . 0.0 113.637 -176.804 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 41.4 ttmt -112.72 -54.36 2.63 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 123.835 0.854 . . . . 0.0 113.125 174.158 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 18.4 tptm -163.23 130.95 3.61 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 125.079 1.352 . . . . 0.0 111.663 -172.488 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -155.26 107.38 2.67 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.786 1.234 . . . . 0.0 109.973 170.916 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -155.39 164.68 38.41 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.911 1.284 . . . . 0.0 112.168 178.913 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 69.2 m-80 -93.38 47.53 1.26 Allowed 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 125.504 1.522 . . . . 0.0 112.71 -179.269 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 21.2 t70 56.18 38.07 29.48 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 125.793 1.637 . . . . 0.0 114.713 175.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 24.0 m -77.3 102.03 6.54 Favored 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 113.305 0.854 . . . . 0.0 113.305 -169.451 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 63.75 38.87 96.82 Favored Glycine 0 CA--C 1.533 1.167 0 C-N-CA 124.707 1.146 . . . . 0.0 115.635 167.771 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 14.9 p -133.14 35.31 0.83 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.983 0 C-N-CA 124.958 1.303 . . . . 0.0 112.469 -163.561 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -136.89 169.97 16.88 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 124.771 1.229 . . . . 0.0 113.756 -173.014 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 20.3 mt -87.05 32.36 0.69 Allowed 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 127.697 2.399 . . . . 0.0 113.408 -166.69 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -158.11 141.01 10.74 Favored Pre-proline 0 CA--C 1.548 0.875 0 C-N-CA 125.507 1.523 . . . . 0.0 111.141 -167.583 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -78.68 -29.86 3.35 Favored 'Trans proline' 0 CA--C 1.54 0.794 0 C-N-CA 122.729 2.286 . . . . 0.0 113.364 -177.92 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -157.86 -168.78 2.63 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 126.445 1.898 . . . . 0.0 109.369 179.942 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 8.0 t -75.33 63.02 1.36 Allowed 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 125.105 1.362 . . . . 0.0 111.464 171.257 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 14.1 p -155.24 142.21 13.57 Favored Pre-proline 0 N--CA 1.471 0.615 0 C-N-CA 126.733 2.013 . . . . 0.0 109.75 -172.625 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_endo -77.01 73.38 5.46 Favored 'Trans proline' 0 CA--C 1.539 0.74 0 C-N-CA 122.857 2.371 . . . . 0.0 111.193 173.425 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.424 ' HA ' ' HD2' ' A' ' 30' ' ' PRO . 0.0 OUTLIER 36.87 93.41 0.05 OUTLIER Pre-proline 0 CA--C 1.548 0.87 0 C-N-CA 128.757 2.823 . . . . 0.0 115.948 171.398 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.424 ' HD2' ' HA ' ' A' ' 29' ' ' LYS . 73.5 Cg_endo -63.92 163.61 24.67 Favored 'Trans proline' 0 CA--C 1.539 0.769 0 C-N-CA 122.117 1.878 . . . . 0.0 112.119 170.572 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 35.8 mmtt -44.08 124.38 3.85 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 125.726 1.61 . . . . 0.0 112.084 177.728 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.8 tt -124.92 125.41 43.9 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.926 1.29 . . . . 0.0 111.609 -170.245 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -131.91 59.22 1.71 Allowed 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.897 1.279 . . . . 0.0 111.685 -168.288 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -118.32 78.37 1.25 Allowed 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 125.691 1.596 . . . . 0.0 110.856 -174.766 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 5.0 mt -132.01 151.51 51.7 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 127.166 2.186 . . . . 0.0 110.136 -177.586 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 73.4 m -72.95 164.02 27.29 Favored 'General case' 0 N--CA 1.479 1.009 0 O-C-N 121.869 -0.519 . . . . 0.0 110.514 170.162 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -55.42 -44.06 75.89 Favored 'General case' 0 N--CA 1.48 1.027 0 O-C-N 120.674 -1.266 . . . . 0.0 113.347 -172.832 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 6.1 pt20 -74.67 -36.75 62.81 Favored 'General case' 0 N--CA 1.47 0.565 0 O-C-N 121.482 -0.761 . . . . 0.0 112.486 174.953 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 89.7 mt-30 -63.81 -38.7 92.07 Favored 'General case' 0 N--CA 1.466 0.353 0 O-C-N 121.609 -0.682 . . . . 0.0 111.329 177.963 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 40.8 ttmt -61.91 -42.44 99.09 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 124.29 1.036 . . . . 0.0 111.063 176.763 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 44.5 mt -69.34 -42.44 81.23 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 CA-C-O 118.378 -0.82 . . . . 0.0 111.064 176.868 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 45.6 mt -63.6 -45.5 97.42 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.002 0 CA-C-N 120.278 1.399 . . . . 0.0 110.069 178.32 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -58.51 -48.65 80.11 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 125.301 1.44 . . . . 0.0 110.753 178.099 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -64.05 -52.63 58.51 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 124.461 1.104 . . . . 0.0 112.822 176.156 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.6 mm-40 -60.48 -32.15 71.14 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 118.964 0.802 . . . . 0.0 112.52 -179.456 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.5 t80 -65.71 -55.86 15.12 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 118.716 0.689 . . . . 0.0 110.642 176.939 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 66.6 mt -64.21 -34.59 69.97 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.251 0 C-N-CA 126.786 2.035 . . . . 0.0 111.739 179.205 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -68.82 -38.64 80.0 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 123.486 0.714 . . . . 0.0 111.336 175.705 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -77.42 -38.55 49.45 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.506 0.722 . . . . 0.0 112.548 179.525 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.3 m -108.64 -6.14 10.86 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.162 0 N-CA-C 114.25 1.204 . . . . 0.0 114.25 -174.206 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 86.75 26.02 33.42 Favored Glycine 0 N--CA 1.473 1.161 0 C-N-CA 124.775 1.179 . . . . 0.0 115.316 161.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 54.49 11.22 0.4 Allowed 'General case' 0 CA--C 1.554 1.115 0 C-N-CA 127.602 2.361 . . . . 0.0 115.32 -173.118 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 4.7 pt20 -121.47 -2.34 9.48 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 125.237 1.415 . . . . 0.0 113.546 -170.956 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 53.8 m-80 -125.59 2.73 7.58 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.03 1.332 . . . . 0.0 113.21 174.753 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 18.1 pt -75.16 152.19 6.55 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 CA-C-N 118.443 0.565 . . . . 0.0 111.459 175.214 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -138.81 145.06 39.64 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 124.327 1.051 . . . . 0.0 109.724 178.481 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -60.6 -26.66 67.14 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 119.259 0.936 . . . . 0.0 112.38 -179.296 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -70.27 -41.35 78.67 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.463 0 C-N-CA 126.086 1.754 . . . . 0.0 110.745 175.869 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 73.7 m -81.14 -44.57 17.71 Favored 'General case' 0 C--O 1.222 -0.365 0 O-C-N 121.81 -0.556 . . . . 0.0 109.53 -178.591 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 14.2 tp -61.15 -37.25 82.18 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.76 1.624 . . . . 0.0 111.682 176.214 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.446 ' HA ' HG13 ' A' ' 66' ' ' ILE . 59.7 p -61.42 -24.04 66.25 Favored 'General case' 0 N--CA 1.477 0.879 0 N-CA-C 113.488 0.922 . . . . 0.0 113.488 171.645 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -104.04 -26.54 12.56 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 125.489 1.515 . . . . 0.0 114.236 -175.149 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 60.0 mmtt -64.66 -35.04 79.75 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 125.336 1.454 . . . . 0.0 111.48 173.305 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 6.9 mt -116.39 -2.07 12.15 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 126.274 1.83 . . . . 0.0 112.908 -166.702 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 26.4 m-80 56.11 61.75 2.63 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 126.744 2.018 . . . . 0.0 113.282 -176.547 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.446 HG13 ' HA ' ' A' ' 61' ' ' SER . 0.6 OUTLIER -134.11 176.3 9.21 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 C-N-CA 126.875 2.07 . . . . 0.0 111.441 -173.137 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.4 p -78.72 158.78 28.22 Favored 'General case' 0 N--CA 1.479 1.007 0 O-C-N 121.069 -1.019 . . . . 0.0 111.231 172.943 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 92.0 t -63.88 -28.56 45.2 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.045 0 O-C-N 121.509 -0.744 . . . . 0.0 111.416 172.863 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -78.74 -38.76 38.01 Favored 'General case' 0 N--CA 1.469 0.497 0 O-C-N 120.923 -1.11 . . . . 0.0 109.722 -177.644 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 5.0 tmtm? -66.54 -47.28 73.38 Favored 'General case' 0 N--CA 1.463 0.213 0 C-N-CA 125.737 1.615 . . . . 0.0 110.615 175.245 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -58.24 -47.71 82.68 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.072 1.349 . . . . 0.0 112.9 172.514 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 35.0 ttmt -69.54 -25.35 63.97 Favored 'General case' 0 N--CA 1.464 0.252 0 O-C-N 120.993 -1.067 . . . . 0.0 111.473 -176.866 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -55.21 -41.44 72.04 Favored 'General case' 0 CA--C 1.545 0.753 0 CA-C-N 118.097 0.408 . . . . 0.0 111.576 173.886 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 53.4 m-85 -65.18 -45.61 84.18 Favored 'General case' 0 C--O 1.221 -0.408 0 C-N-CA 124.68 1.192 . . . . 0.0 111.03 176.089 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 65.3 mt -65.27 -24.87 35.94 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.7 0 C-N-CA 124.128 0.971 . . . . 0.0 111.363 -178.706 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 72.8 mmtt -87.57 -24.87 23.88 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 125.404 1.482 . . . . 0.0 114.547 179.637 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 10.6 p30 -95.28 -42.58 8.46 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 120.463 1.483 . . . . 0.0 112.103 169.087 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 65.0 m -99.64 105.15 16.97 Favored 'General case' 0 C--O 1.231 0.118 0 C-N-CA 124.063 0.945 . . . . 0.0 110.531 179.543 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 -145.5 -75.88 0.21 Allowed 'General case' 0 CA--C 1.539 0.545 0 N-CA-C 113.577 0.954 . . . . 0.0 113.577 -174.866 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 39.7 mmt-85 -86.31 -18.95 30.62 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 124.493 1.117 . . . . 0.0 113.777 -177.434 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 6.7 tt -75.7 -38.38 58.68 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.382 1.473 . . . . 0.0 112.227 -176.805 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 73.46 -158.7 52.78 Favored Glycine 0 CA--C 1.536 1.385 0 C-N-CA 123.907 0.765 . . . . 0.0 113.379 -175.186 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 19.7 mtp85 -150.07 150.78 32.22 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 126.298 1.839 . . . . 0.0 110.43 161.624 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 8.9 t -65.82 121.59 15.39 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 123.564 0.746 . . . . 0.0 110.963 167.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 46.7 m-80 -133.72 -77.38 0.47 Allowed 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.492 1.117 . . . . 0.0 111.799 178.196 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 31.8 t-20 53.63 -166.34 0.08 Allowed 'General case' 0 CA--C 1.559 1.291 0 C-N-CA 125.693 1.597 . . . . 0.0 113.193 -175.208 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 8.7 mp 56.11 36.84 28.11 Favored 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 126.476 1.911 . . . . 0.0 112.912 177.093 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 60.7 pttt -115.97 -5.34 11.99 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 126.097 1.759 . . . . 0.0 114.109 -172.509 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 14.7 t -149.4 124.65 10.16 Favored 'General case' 0 C--O 1.234 0.254 0 C-N-CA 125.208 1.403 . . . . 0.0 109.806 172.387 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -140.09 5.84 0.56 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.779 0 C-N-CA 125.988 1.715 . . . . 0.0 113.11 -177.029 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 67.9 6.87 46.92 Favored Glycine 0 CA--C 1.539 1.567 0 O-C-N 120.835 -1.166 . . . . 0.0 114.733 -171.137 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . 0.259 3.5 mp 51.2 39.19 0.32 Allowed 'Isoleucine or valine' 0 CA--C 1.549 0.938 0 C-N-CA 126.863 2.065 . . . . 0.0 111.536 178.697 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 12.6 tp 51.14 26.89 3.08 Favored 'General case' 0 CA--C 1.553 1.069 0 C-N-CA 127.076 2.15 . . . . 0.0 114.614 -176.757 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -127.38 52.16 1.84 Allowed 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 126.526 1.93 . . . . 0.0 110.895 -172.412 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -132.84 158.72 41.79 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 126.297 1.839 . . . . 0.0 111.706 175.371 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -135.3 113.7 11.52 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 124.844 1.258 . . . . 0.0 110.43 -179.017 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 7.7 t -142.64 151.46 17.81 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 C-N-CA 125.621 1.568 . . . . 0.0 109.95 -174.301 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 38.4 t -138.13 -64.06 0.54 Allowed 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 124.1 0.96 . . . . 0.0 112.456 176.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 15.8 t -65.85 -31.94 73.18 Favored 'General case' 0 N--CA 1.478 0.96 0 O-C-N 121.455 -0.778 . . . . 0.0 113.009 -177.948 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 98.4 mmm -107.25 18.43 21.66 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.891 1.676 . . . . 0.0 113.106 179.003 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 24.3 tt0 -79.79 53.46 1.64 Allowed 'General case' 0 CA--C 1.553 1.063 0 C-N-CA 124.757 1.223 . . . . 0.0 112.373 -176.144 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 56.32 -179.4 0.04 OUTLIER 'General case' 0 CA--C 1.552 1.05 0 C-N-CA 127.0 2.12 . . . . 0.0 114.713 -170.867 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -149.0 161.25 42.29 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 125.757 1.623 . . . . 0.0 112.081 177.495 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 50.1 p -147.47 -85.23 0.1 Allowed 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.574 1.15 . . . . 0.0 111.881 177.149 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 18.2 ttt -155.59 146.17 22.05 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 125.699 1.6 . . . . 0.0 111.381 179.673 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 9.9 m -81.22 142.1 33.51 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.876 0.871 . . . . 0.0 111.009 171.44 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 28.1 t-105 . . . . . 0 C--O 1.254 1.314 0 C-N-CA 125.646 1.579 . . . . 0.0 113.06 -175.9 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.653 0 N-CA-C 111.893 -0.483 . . . . 0.0 111.893 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 24.4 m -79.31 58.08 2.49 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 125.655 1.582 . . . . 0.0 114.059 -170.783 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 9.5 m170 -77.19 115.08 16.67 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 124.4 1.08 . . . . 0.0 111.024 177.675 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 59.4 ttp -152.17 143.76 23.5 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 125.662 1.585 . . . . 0.0 110.619 176.456 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -141.88 162.29 35.86 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.05 0.94 . . . . 0.0 113.463 -177.364 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 96.1 p -145.87 150.63 36.49 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 125.713 1.605 . . . . 0.0 112.019 -175.805 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 95.8 mtp -144.16 89.02 1.99 Allowed 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 125.154 1.382 . . . . 0.0 110.151 -175.082 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 -142.51 149.41 50.76 Favored Pre-proline 0 CA--C 1.549 0.905 0 C-N-CA 124.772 1.229 . . . . 0.0 112.422 -174.241 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -78.48 -2.93 12.92 Favored 'Trans proline' 0 C--N 1.353 0.766 0 C-N-CA 124.05 3.167 . . . . 0.0 114.61 178.048 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 94.7 mt -107.86 44.16 1.13 Allowed 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 126.218 1.807 . . . . 0.0 111.526 179.787 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -101.56 -19.04 15.65 Favored 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 114.648 1.351 . . . . 0.0 114.648 176.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.7 -32.37 5.18 Favored 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 115.94 1.83 . . . . 0.0 115.94 -166.267 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.2 pp -132.88 12.06 1.5 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.237 0 C-N-CA 125.011 1.324 . . . . 0.0 113.979 -176.957 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 14.9 tt -51.44 125.79 5.59 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 C-N-CA 124.805 1.242 . . . . 0.0 112.773 -173.717 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -146.52 -1.71 0.7 Allowed 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 114.154 1.168 . . . . 0.0 114.154 -179.399 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -88.06 9.98 20.69 Favored 'General case' 0 CA--C 1.544 0.715 0 N-CA-C 114.754 1.39 . . . . 0.0 114.754 -169.34 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 14.2 tt -144.08 23.2 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 C-N-CA 126.428 1.891 . . . . 0.0 113.065 -175.181 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 38.1 ttpt -122.93 -39.73 2.48 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 115.108 1.521 . . . . 0.0 115.108 -173.287 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 58.7 tttm -146.7 120.0 8.95 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 125.006 1.322 . . . . 0.0 111.876 -175.461 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -141.81 129.46 21.53 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 125.691 1.597 . . . . 0.0 110.605 179.56 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -153.64 6.44 0.34 Allowed 'General case' 0 CA--C 1.549 0.935 0 N-CA-C 115.229 1.566 . . . . 0.0 115.229 -169.557 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 48.6 t30 -111.59 90.48 3.35 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 124.557 1.143 . . . . 0.0 112.243 -169.676 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 5.8 t0 -152.36 161.87 41.99 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 125.228 1.411 . . . . 0.0 111.123 171.207 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 71.1 m -124.46 81.17 1.91 Allowed 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 125.665 1.586 . . . . 0.0 111.368 -173.589 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 88.3 102.09 0.95 Allowed Glycine 0 CA--C 1.531 1.078 0 C-N-CA 125.341 1.448 . . . . 0.0 112.415 179.757 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 45.0 t -117.05 129.27 73.88 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.919 0 C-N-CA 125.347 1.459 . . . . 0.0 110.609 -179.174 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 54.0 -157.77 0.18 Allowed 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 125.822 1.649 . . . . 0.0 113.073 -178.747 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 42.4 mt -116.71 26.13 10.07 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 126.333 1.853 . . . . 0.0 112.669 -171.091 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -151.12 104.12 2.98 Favored Pre-proline 0 CA--C 1.549 0.941 0 C-N-CA 125.612 1.565 . . . . 0.0 110.575 -166.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_endo -78.95 -18.38 11.53 Favored 'Trans proline' 0 CA--C 1.541 0.873 0 C-N-CA 123.222 2.615 . . . . 0.0 113.304 -177.92 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 8.2 tp -148.26 -159.16 0.99 Allowed 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 127.297 2.239 . . . . 0.0 108.285 178.301 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 5.2 t -77.08 52.82 0.92 Allowed 'General case' 0 N--CA 1.479 0.977 0 O-C-N 120.867 -1.146 . . . . 0.0 112.382 174.101 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 8.9 p -157.27 140.53 11.09 Favored Pre-proline 0 CA--C 1.543 0.682 0 C-N-CA 126.387 1.875 . . . . 0.0 110.462 -174.538 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 71.4 Cg_endo -78.76 65.43 8.73 Favored 'Trans proline' 0 CA--C 1.545 1.06 0 C-N-CA 123.738 2.959 . . . . 0.0 111.334 175.799 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 48.1 tptt 62.42 117.59 0.02 OUTLIER Pre-proline 0 N--CA 1.482 1.175 0 C-N-CA 129.048 2.939 . . . . 0.0 114.009 -173.38 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_endo -75.84 148.23 31.87 Favored 'Trans proline' 0 CA--C 1.54 0.782 0 C-N-CA 122.853 2.369 . . . . 0.0 112.041 -178.836 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 55.3 mtmt -68.89 142.33 54.8 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 124.526 1.13 . . . . 0.0 112.781 -176.918 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 51.8 tp -131.03 145.32 52.0 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 126.008 1.723 . . . . 0.0 111.136 -175.255 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -138.23 69.54 1.39 Allowed 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 125.666 1.586 . . . . 0.0 110.381 179.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -134.85 84.93 2.14 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 124.871 1.268 . . . . 0.0 112.063 -176.261 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.1 mt -131.55 152.27 50.9 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 127.543 2.337 . . . . 0.0 109.466 170.658 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 71.1 m -73.38 165.13 25.63 Favored 'General case' 0 N--CA 1.48 1.059 0 O-C-N 121.883 -0.511 . . . . 0.0 110.644 169.879 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -55.77 -43.48 76.79 Favored 'General case' 0 N--CA 1.48 1.058 0 O-C-N 120.588 -1.32 . . . . 0.0 113.382 -174.586 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 12.7 tt0 -73.64 -41.44 62.75 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 123.374 0.67 . . . . 0.0 111.464 175.111 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 85.8 mt-30 -62.78 -37.89 88.47 Favored 'General case' 0 CA--C 1.535 0.37 0 O-C-N 121.648 -0.658 . . . . 0.0 111.967 179.334 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 19.8 ttmm -59.4 -41.47 89.5 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 124.355 1.062 . . . . 0.0 110.978 174.348 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 43.3 mt -70.01 -42.37 79.5 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.561 0 CA-C-O 118.234 -0.889 . . . . 0.0 111.099 177.715 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 42.6 mt -64.71 -43.88 96.56 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.891 0 CA-C-N 120.467 1.485 . . . . 0.0 110.35 177.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -57.24 -49.18 76.85 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.955 1.302 . . . . 0.0 110.254 177.386 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -65.45 -52.22 54.66 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 124.256 1.022 . . . . 0.0 112.854 177.272 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.0 mm-40 -60.58 -27.56 67.8 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 119.165 0.893 . . . . 0.0 113.038 -178.91 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.452 ' CE2' HG22 ' A' ' 55' ' ' ILE . 1.6 t80 -70.89 -57.4 4.63 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 123.714 0.806 . . . . 0.0 111.153 176.186 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 75.6 mt -60.3 -34.26 56.81 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.49 0 C-N-CA 126.657 1.983 . . . . 0.0 111.338 176.744 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -70.69 -24.42 62.67 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 124.12 0.968 . . . . 0.0 113.111 176.032 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -91.25 -32.41 15.76 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.396 1.078 . . . . 0.0 112.621 178.375 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 5.3 m -121.0 -19.81 4.66 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.981 0 N-CA-C 113.992 1.108 . . . . 0.0 113.992 -173.3 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 83.58 141.47 4.58 Favored Glycine 0 CA--C 1.531 1.085 0 C-N-CA 125.034 1.302 . . . . 0.0 112.205 -171.092 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -65.06 -12.82 54.87 Favored 'General case' 0 N--CA 1.477 0.921 0 CA-C-O 122.986 1.374 . . . . 0.0 113.859 -172.611 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 35.3 mt-30 -78.98 -15.78 57.81 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 126.01 1.724 . . . . 0.0 112.976 175.229 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 60.6 m-80 -116.22 -6.16 11.86 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 114.713 1.375 . . . . 0.0 114.713 -173.061 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.452 HG22 ' CE2' ' A' ' 46' ' ' TYR . 15.5 pt -72.82 160.72 5.2 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 C-N-CA 123.753 0.821 . . . . 0.0 111.644 167.988 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -133.38 146.89 51.67 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 125.025 1.33 . . . . 0.0 110.577 176.004 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -63.05 -28.22 69.94 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.806 0.843 . . . . 0.0 112.135 177.672 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -64.04 -48.8 84.35 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.513 0 C-N-CA 125.275 1.43 . . . . 0.0 109.689 174.574 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 99.3 m -77.68 -40.02 42.91 Favored 'General case' 0 C--O 1.224 -0.277 0 C-N-CA 123.77 0.828 . . . . 0.0 110.721 -176.765 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 17.3 tp -63.44 -37.07 85.89 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.632 1.173 . . . . 0.0 111.774 173.611 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.442 ' HA ' HG13 ' A' ' 66' ' ' ILE . 40.1 t -55.2 -29.56 58.17 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.849 1.259 . . . . 0.0 112.753 169.341 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 59.5 mttm -95.41 -36.33 11.39 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 125.007 1.323 . . . . 0.0 113.569 -178.036 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 10.3 mmtm -61.94 -35.66 79.1 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 125.486 1.514 . . . . 0.0 112.193 -178.856 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.2 mp -115.53 6.67 14.72 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 114.113 1.153 . . . . 0.0 114.113 -176.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 13.9 m-80 57.21 59.11 3.53 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 126.431 1.893 . . . . 0.0 113.214 -179.327 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.442 HG13 ' HA ' ' A' ' 61' ' ' SER . 0.9 OUTLIER -125.67 -168.06 0.53 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.789 0 C-N-CA 126.755 2.022 . . . . 0.0 110.982 -172.427 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.5 p -96.35 160.11 14.59 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.311 1.044 . . . . 0.0 110.85 171.052 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 63.9 t -63.66 -28.75 45.63 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.893 0 O-C-N 121.748 -0.595 . . . . 0.0 111.417 173.801 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 44.4 mm-40 -78.55 -39.57 37.39 Favored 'General case' 0 N--CA 1.468 0.431 0 O-C-N 121.046 -1.034 . . . . 0.0 110.123 -179.16 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 5.4 tmtm? -64.38 -47.19 80.18 Favored 'General case' 0 N--CA 1.463 0.181 0 C-N-CA 125.245 1.418 . . . . 0.0 110.604 176.271 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -58.68 -48.14 82.11 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 125.687 1.595 . . . . 0.0 113.233 172.264 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 20.0 ttmm -68.34 -27.64 66.45 Favored 'General case' 0 N--CA 1.466 0.348 0 O-C-N 120.941 -1.1 . . . . 0.0 111.251 -177.928 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -56.96 -38.75 73.4 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 122.898 0.479 . . . . 0.0 112.152 176.403 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 68.1 m-85 -64.42 -45.43 87.61 Favored 'General case' 0 N--CA 1.464 0.272 0 C-N-CA 125.215 1.406 . . . . 0.0 110.956 175.091 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 81.5 mt -69.53 -26.81 31.92 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.649 0 C-N-CA 125.205 1.402 . . . . 0.0 111.468 -177.319 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 53.9 mtmt -79.56 -37.64 35.94 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.595 1.158 . . . . 0.0 113.21 177.168 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 5.9 p30 -87.67 -41.1 13.61 Favored 'General case' 0 C--N 1.342 0.275 0 CA-C-N 119.431 1.014 . . . . 0.0 111.915 177.642 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 10.7 t -109.94 116.62 31.95 Favored 'General case' 0 C--N 1.339 0.13 0 O-C-N 123.648 0.593 . . . . 0.0 111.499 178.271 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 8.5 t-20 -150.13 -48.71 0.13 Allowed 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 113.525 0.935 . . . . 0.0 113.525 -165.332 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 1.4 mpp_? -111.65 17.34 20.03 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 125.901 1.68 . . . . 0.0 113.328 175.744 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.8 tt -126.01 -61.62 1.22 Allowed 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 125.647 1.579 . . . . 0.0 111.648 -175.199 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 64.32 -108.54 2.32 Favored Glycine 0 CA--C 1.538 1.471 0 CA-C-N 118.553 0.615 . . . . 0.0 112.737 -171.531 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 76.7 mtp85 -112.09 -85.5 0.57 Allowed 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 125.887 1.675 . . . . 0.0 111.916 178.168 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 2.7 t -155.14 107.47 2.71 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 125.278 1.431 . . . . 0.0 109.687 176.616 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 11.3 p30 -155.81 -14.98 0.11 Allowed 'General case' 0 CA--C 1.548 0.902 0 N-CA-C 114.659 1.355 . . . . 0.0 114.659 -171.91 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 60.4 t30 -84.65 159.28 20.61 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.447 1.099 . . . . 0.0 111.907 179.163 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 1.2 tp 63.99 169.45 0.17 Allowed 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 126.061 1.744 . . . . 0.0 113.384 -173.341 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 56.8 pttt -107.25 4.72 26.92 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 126.177 1.791 . . . . 0.0 112.677 -178.245 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 13.7 t -150.74 123.18 8.43 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 126.174 1.79 . . . . 0.0 109.227 172.82 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -140.12 3.11 0.56 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.755 0 C-N-CA 125.048 1.339 . . . . 0.0 113.68 -177.007 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 68.06 9.54 57.21 Favored Glycine 0 CA--C 1.539 1.578 0 O-C-N 120.762 -1.211 . . . . 0.0 114.652 -170.585 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . 0.257 3.5 mp 50.23 41.34 0.35 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.886 0 C-N-CA 127.111 2.164 . . . . 0.0 111.861 176.345 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 11.4 tp 51.99 26.67 3.87 Favored 'General case' 0 CA--C 1.552 1.049 0 C-N-CA 126.729 2.011 . . . . 0.0 114.608 -179.498 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 29.9 mt-30 -122.56 55.78 1.15 Allowed 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 125.98 1.712 . . . . 0.0 111.561 -170.065 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -73.24 151.93 41.22 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 124.881 1.272 . . . . 0.0 111.608 171.677 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -108.03 109.61 21.1 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 124.885 1.274 . . . . 0.0 111.563 -176.643 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 53.4 t -127.86 91.41 1.7 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 C-N-CA 125.671 1.589 . . . . 0.0 109.099 174.939 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 38.0 t -169.77 -36.54 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 124.777 1.231 . . . . 0.0 111.949 176.658 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 28.1 t -139.82 130.22 25.46 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 125.142 1.377 . . . . 0.0 111.247 177.211 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 76.3 mtm 51.64 46.06 27.13 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 126.438 1.895 . . . . 0.0 113.835 173.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -85.51 4.92 33.64 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 126.328 1.851 . . . . 0.0 114.431 -177.809 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -74.3 163.22 28.07 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 125.529 1.532 . . . . 0.0 114.078 -177.333 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 62.3 mtpt -113.18 154.14 27.17 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 126.344 1.858 . . . . 0.0 112.041 177.202 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 24.9 p -79.67 -51.1 9.67 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.785 1.234 . . . . 0.0 113.188 -179.434 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 74.3 mtm 53.6 -166.25 0.08 Allowed 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 126.41 1.884 . . . . 0.0 113.877 -176.593 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 8.0 t -142.87 162.64 34.93 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 125.122 1.369 . . . . 0.0 112.358 179.378 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 21.1 m-90 . . . . . 0 C--O 1.252 1.216 0 C-N-CA 127.184 2.194 . . . . 0.0 112.167 -175.903 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.552 0 N-CA-C 111.803 -0.519 . . . . 0.0 111.803 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 20.0 m -89.33 -3.8 58.34 Favored 'General case' 0 N--CA 1.479 0.979 0 N-CA-C 115.077 1.51 . . . . 0.0 115.077 -171.551 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 39.6 t60 -75.5 107.91 7.95 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.175 0.99 . . . . 0.0 112.054 -175.784 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 26.8 ptt? -155.21 162.09 41.01 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 125.842 1.657 . . . . 0.0 111.771 176.923 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -136.61 138.85 41.62 Favored 'General case' 0 CA--C 1.539 0.546 0 N-CA-C 112.99 0.737 . . . . 0.0 112.99 172.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 45.1 m -150.81 147.69 27.58 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 126.905 2.082 . . . . 0.0 110.292 -176.483 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 52.0 tpp -142.2 59.01 1.47 Allowed 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 124.614 1.166 . . . . 0.0 111.073 -179.124 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -136.61 149.67 67.95 Favored Pre-proline 0 CA--C 1.547 0.861 0 C-N-CA 125.282 1.433 . . . . 0.0 112.023 -176.428 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_endo -81.84 -12.22 11.02 Favored 'Trans proline' 0 C--N 1.351 0.669 0 C-N-CA 123.297 2.665 . . . . 0.0 114.827 178.326 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 89.0 mt -101.01 47.01 0.92 Allowed 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.748 1.619 . . . . 0.0 113.285 -170.248 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 -105.51 -3.1 22.83 Favored 'General case' 0 N--CA 1.479 1.017 0 N-CA-C 114.795 1.406 . . . . 0.0 114.795 172.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -130.54 -57.32 1.06 Allowed 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 124.339 1.055 . . . . 0.0 113.356 -165.773 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.9 pp -109.1 12.16 8.82 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 C-N-CA 125.923 1.689 . . . . 0.0 112.837 -176.617 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 15.7 tt -46.96 130.09 3.33 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.777 0 C-N-CA 124.817 1.247 . . . . 0.0 112.314 176.113 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -148.79 49.33 1.0 Allowed 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.533 1.133 . . . . 0.0 111.756 -170.895 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 -106.06 11.12 31.84 Favored 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 114.005 1.113 . . . . 0.0 114.005 -175.303 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 7.2 tp -148.98 32.57 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.919 0 C-N-CA 125.589 1.556 . . . . 0.0 113.458 -172.96 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 3.1 tmtm? -132.35 -53.71 0.96 Allowed 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 123.854 0.861 . . . . 0.0 113.042 -179.449 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 5.0 mptp? 54.88 126.66 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.484 0 C-N-CA 128.225 2.61 . . . . 0.0 113.786 -161.734 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 -138.22 158.66 43.86 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 124.988 1.315 . . . . 0.0 112.857 -179.403 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -91.85 167.31 12.23 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 125.26 1.424 . . . . 0.0 113.146 174.546 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 65.9 m-20 -112.51 157.97 20.47 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.881 1.672 . . . . 0.0 112.436 -179.34 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 27.5 m-20 -80.45 151.2 29.42 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 124.599 1.159 . . . . 0.0 112.378 173.106 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 76.5 p -96.26 -0.08 50.24 Favored 'General case' 0 N--CA 1.477 0.912 0 N-CA-C 115.469 1.655 . . . . 0.0 115.469 -175.692 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -170.29 102.71 0.18 Allowed Glycine 0 CA--C 1.529 0.956 0 O-C-N 121.704 -0.622 . . . . 0.0 112.246 171.392 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 8.2 p -142.76 14.81 0.39 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.148 0 C-N-CA 124.587 1.155 . . . . 0.0 113.671 -172.664 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 2.2 m -133.65 150.52 51.56 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 124.273 1.029 . . . . 0.0 112.933 -166.117 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.448 HD23 ' H ' ' A' ' 22' ' ' LEU . 2.0 pt? -100.97 31.37 3.62 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 126.659 1.984 . . . . 0.0 115.314 -175.082 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -108.71 133.49 20.63 Favored Pre-proline 0 CA--C 1.548 0.874 0 C-N-CA 125.615 1.566 . . . . 0.0 111.468 -178.127 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -75.23 -39.24 1.19 Allowed 'Trans proline' 0 CA--C 1.542 0.898 0 C-N-CA 122.094 1.863 . . . . 0.0 113.449 -179.145 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 2.1 tt -154.2 72.82 0.9 Allowed 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 124.872 1.269 . . . . 0.0 110.541 179.471 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 33.1 m 53.69 37.3 25.84 Favored 'General case' 0 N--CA 1.48 1.069 0 N-CA-C 114.985 1.476 . . . . 0.0 114.985 174.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 9.4 p -153.36 145.28 16.82 Favored Pre-proline 0 N--CA 1.474 0.756 0 C-N-CA 125.72 1.608 . . . . 0.0 110.236 -172.847 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 93.7 Cg_endo -77.02 64.96 7.82 Favored 'Trans proline' 0 CA--C 1.548 1.187 0 C-N-CA 123.506 2.804 . . . . 0.0 112.242 177.073 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 39.0 tptt 59.45 113.18 0.02 OUTLIER Pre-proline 0 N--CA 1.483 1.204 0 C-N-CA 129.561 3.145 . . . . 0.0 114.175 -175.919 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 82.6 Cg_endo -76.45 145.42 26.64 Favored 'Trans proline' 0 C--N 1.352 0.713 0 C-N-CA 122.862 2.374 . . . . 0.0 111.568 -176.902 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 64.5 mttp -66.89 135.48 53.92 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 124.128 0.971 . . . . 0.0 111.485 -177.278 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 14.3 tp -137.33 136.67 38.18 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.887 1.675 . . . . 0.0 110.676 -173.214 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -130.78 67.72 1.49 Allowed 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 125.091 1.356 . . . . 0.0 110.837 178.627 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -122.72 86.27 2.55 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.134 1.374 . . . . 0.0 111.889 -173.908 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.2 mt -135.66 151.58 50.35 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 127.225 2.21 . . . . 0.0 109.726 176.465 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 22.8 t -71.48 164.71 25.29 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 123.006 0.523 . . . . 0.0 110.805 170.655 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -56.74 -44.53 81.78 Favored 'General case' 0 N--CA 1.477 0.906 0 O-C-N 120.388 -1.445 . . . . 0.0 113.155 -174.04 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 7.5 pt20 -76.64 -34.72 58.3 Favored 'General case' 0 N--CA 1.47 0.568 0 O-C-N 121.626 -0.671 . . . . 0.0 112.251 174.59 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 89.2 mt-30 -66.0 -39.44 90.3 Favored 'General case' 0 CA--C 1.53 0.207 0 O-C-N 121.693 -0.629 . . . . 0.0 111.535 -179.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 40.8 ttmt -59.6 -42.27 92.23 Favored 'General case' 0 N--CA 1.464 0.248 0 C-N-CA 124.749 1.22 . . . . 0.0 110.621 176.034 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 48.0 mt -68.56 -42.3 83.46 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.481 0 CA-C-O 118.256 -0.878 . . . . 0.0 111.06 177.286 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 40.2 mt -64.47 -44.36 96.97 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 CA-C-N 120.601 1.546 . . . . 0.0 110.335 178.668 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -60.61 -48.78 80.27 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 125.114 1.366 . . . . 0.0 111.128 177.366 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -64.27 -51.36 63.96 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 124.794 1.237 . . . . 0.0 112.49 177.27 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 17.0 mm-40 -61.17 -28.82 69.4 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-N 118.991 0.814 . . . . 0.0 112.545 179.246 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -65.3 -58.55 5.65 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-N 118.944 0.793 . . . . 0.0 110.47 174.434 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.3 mt -62.37 -35.58 70.28 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.363 0 C-N-CA 126.796 2.038 . . . . 0.0 111.796 179.394 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -72.08 -28.04 63.05 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.021 0.928 . . . . 0.0 112.389 178.551 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -86.71 -38.08 17.32 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.146 0.978 . . . . 0.0 112.555 175.429 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.5 m -108.5 -7.06 10.95 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.15 0 N-CA-C 114.664 1.357 . . . . 0.0 114.664 -173.197 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 86.21 27.77 29.84 Favored Glycine 0 CA--C 1.531 1.09 0 C-N-CA 124.732 1.158 . . . . 0.0 115.336 162.488 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 55.38 14.18 1.06 Allowed 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 127.224 2.21 . . . . 0.0 114.895 -176.165 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 5.1 pt20 -124.12 -6.94 7.73 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 125.147 1.379 . . . . 0.0 113.969 -170.449 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 57.2 m-80 -118.74 0.53 11.47 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 124.766 1.226 . . . . 0.0 113.264 174.414 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 23.0 pt -75.96 152.37 6.15 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 C-N-CA 123.271 0.628 . . . . 0.0 112.012 177.519 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -141.48 146.53 36.57 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 125.524 1.529 . . . . 0.0 109.354 176.442 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -62.94 -28.23 69.93 Favored 'General case' 0 C--O 1.222 -0.36 0 C-N-CA 123.743 0.817 . . . . 0.0 112.025 178.455 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -63.55 -43.38 98.25 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.471 0 C-N-CA 125.193 1.397 . . . . 0.0 109.864 174.15 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 81.9 m -83.53 -43.0 16.2 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 123.867 0.867 . . . . 0.0 110.296 -174.18 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 6.2 mt -59.13 -37.19 76.65 Favored 'General case' 0 CA--C 1.539 0.532 0 O-C-N 121.447 -0.783 . . . . 0.0 111.977 169.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.482 ' HA ' HG13 ' A' ' 66' ' ' ILE . 28.7 t -52.31 -33.82 44.09 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 124.055 0.942 . . . . 0.0 111.938 173.179 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -99.2 -29.53 12.78 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 124.729 1.212 . . . . 0.0 113.986 -174.774 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 18.7 mmmt -62.49 -29.13 70.32 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 125.108 1.363 . . . . 0.0 112.817 177.593 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.9 mp -127.34 14.62 7.18 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 124.865 1.266 . . . . 0.0 113.901 -177.51 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . 0.278 8.1 p30 47.12 51.18 13.36 Favored 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 126.211 1.805 . . . . 0.0 113.712 -176.257 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.482 HG13 ' HA ' ' A' ' 61' ' ' SER . 2.7 pt -110.46 -174.88 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 C-N-CA 126.905 2.082 . . . . 0.0 111.253 -177.168 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -84.96 158.55 20.49 Favored 'General case' 0 N--CA 1.477 0.912 0 O-C-N 121.227 -0.92 . . . . 0.0 110.999 170.881 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 95.5 t -63.67 -31.05 51.56 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 O-C-N 121.809 -0.557 . . . . 0.0 111.199 170.901 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -74.94 -35.31 62.16 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 119.783 1.174 . . . . 0.0 110.367 178.511 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 22.2 tttt -65.56 -48.9 70.83 Favored 'General case' 0 C--N 1.342 0.257 0 C-N-CA 123.279 0.631 . . . . 0.0 110.833 175.489 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -58.28 -41.46 84.42 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.917 1.687 . . . . 0.0 113.087 175.942 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 37.2 ttmt -74.13 -30.4 62.28 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 125.472 1.509 . . . . 0.0 111.6 -178.714 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -56.54 -42.92 79.31 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 122.85 0.46 . . . . 0.0 111.772 177.242 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 53.5 m-85 -64.53 -42.57 95.66 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 125.006 1.323 . . . . 0.0 111.004 178.495 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 74.0 mt -65.56 -38.98 83.69 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.477 0 C-N-CA 124.05 0.94 . . . . 0.0 110.672 178.817 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 71.3 mmtt -72.6 -40.72 66.32 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 124.761 1.224 . . . . 0.0 112.969 -177.403 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 4.7 p30 -87.53 -38.73 15.76 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 118.636 0.653 . . . . 0.0 111.208 -178.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -93.37 26.42 2.97 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 114.964 1.468 . . . . 0.0 114.964 -166.852 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -81.84 -36.85 27.84 Favored 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 114.139 1.162 . . . . 0.0 114.139 -169.106 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 2.5 mpt_? -73.58 -10.7 59.98 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 124.857 1.263 . . . . 0.0 113.323 -178.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 9.5 tt -68.6 -31.85 71.33 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 125.177 1.391 . . . . 0.0 111.86 169.269 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -91.05 -120.57 2.37 Favored Glycine 0 CA--C 1.535 1.317 0 C-N-CA 125.338 1.447 . . . . 0.0 112.817 175.52 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -117.45 -89.26 0.59 Allowed 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 125.639 1.576 . . . . 0.0 111.413 -177.739 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 4.5 t -159.86 98.23 1.33 Allowed 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 125.075 1.35 . . . . 0.0 110.49 176.756 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 64.8 m-80 -144.67 49.1 1.31 Allowed 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 125.591 1.557 . . . . 0.0 111.974 -171.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 35.2 t-20 -127.58 -178.18 4.37 Favored 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 125.727 1.611 . . . . 0.0 110.573 175.023 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 5.8 tp 60.86 25.73 15.63 Favored 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 126.663 1.985 . . . . 0.0 114.13 179.549 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 65.4 pttt -129.57 8.48 5.4 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 126.527 1.931 . . . . 0.0 114.496 -178.388 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 11.5 t -154.9 129.69 9.33 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 125.549 1.54 . . . . 0.0 109.703 173.566 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -137.67 2.02 0.75 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.688 0 C-N-CA 125.799 1.639 . . . . 0.0 113.722 179.628 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 68.82 10.22 60.81 Favored Glycine 0 CA--C 1.539 1.586 0 O-C-N 120.884 -1.135 . . . . 0.0 114.465 -171.811 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . 0.262 3.2 mp 50.4 40.7 0.35 Allowed 'Isoleucine or valine' 0 CA--C 1.549 0.917 0 C-N-CA 127.111 2.164 . . . . 0.0 111.995 176.44 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 11.4 tp 54.03 23.22 3.89 Favored 'General case' 0 CA--C 1.553 1.058 0 C-N-CA 126.55 1.94 . . . . 0.0 114.54 -177.997 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 36.2 mt-30 -134.91 46.49 2.44 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 127.193 2.197 . . . . 0.0 110.388 -170.298 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -140.92 107.34 5.28 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.17 1.788 . . . . 0.0 109.386 -176.098 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -146.23 31.47 1.01 Allowed 'General case' 0 N--CA 1.479 0.984 0 N-CA-C 115.503 1.668 . . . . 0.0 115.503 -166.593 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 52.6 t -135.65 117.9 21.43 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 C-N-CA 123.684 0.794 . . . . 0.0 111.937 -175.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 37.8 t -160.54 -72.69 0.07 Allowed 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 123.931 0.892 . . . . 0.0 112.618 176.605 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 25.5 m -73.0 -21.63 60.8 Favored 'General case' 0 N--CA 1.48 1.058 0 N-CA-C 113.806 1.039 . . . . 0.0 113.806 -176.422 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -132.61 136.62 46.64 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 125.957 1.703 . . . . 0.0 110.109 168.257 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -147.47 100.83 3.3 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.791 1.636 . . . . 0.0 108.463 175.814 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -137.59 149.91 47.03 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.757 1.223 . . . . 0.0 112.15 179.569 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -124.56 108.77 12.43 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 125.694 1.598 . . . . 0.0 109.732 175.52 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 10.8 t -151.62 158.25 43.23 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 125.641 1.576 . . . . 0.0 110.794 -178.887 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 74.6 mmm -113.25 163.67 14.5 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 125.169 1.388 . . . . 0.0 113.353 -176.645 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 9.5 t -146.09 153.5 40.77 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 125.998 1.719 . . . . 0.0 111.403 -173.495 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 7.4 t-105 . . . . . 0 C--O 1.254 1.29 0 C-N-CA 127.979 2.512 . . . . 0.0 114.19 179.639 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.498 0 N-CA-C 111.287 -0.725 . . . . 0.0 111.287 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 74.4 p -140.67 159.14 42.85 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 125.993 1.717 . . . . 0.0 111.686 178.477 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 24.9 m170 -92.5 -52.41 4.67 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 123.653 0.781 . . . . 0.0 112.526 -177.126 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 12.8 tpt -156.83 152.47 26.89 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 125.587 1.555 . . . . 0.0 111.464 177.717 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -138.75 159.6 41.72 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.709 1.204 . . . . 0.0 112.359 175.032 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 22.7 t -142.09 128.64 20.22 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 124.975 1.31 . . . . 0.0 110.708 176.584 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 10.4 tpt -155.79 88.81 1.13 Allowed 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 124.518 1.127 . . . . 0.0 110.852 -173.037 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 48.2 m-20 -95.84 148.87 35.24 Favored Pre-proline 0 CA--C 1.549 0.911 0 C-N-CA 124.329 1.051 . . . . 0.0 113.097 -179.745 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 65.4 Cg_endo -84.39 -5.97 10.1 Favored 'Trans proline' 0 C--N 1.351 0.703 0 C-N-CA 123.872 3.048 . . . . 0.0 114.516 174.58 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 97.8 mt -97.72 44.66 1.04 Allowed 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.153 1.381 . . . . 0.0 113.437 -172.414 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -111.33 -1.67 15.94 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 124.729 1.212 . . . . 0.0 114.235 171.298 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.67 -56.21 1.14 Allowed 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 124.489 1.116 . . . . 0.0 113.191 -165.211 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.7 pp -110.74 10.04 8.67 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.784 0 C-N-CA 125.848 1.659 . . . . 0.0 112.914 -178.134 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 13.3 tt -50.32 133.73 10.24 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 C-N-CA 124.189 0.996 . . . . 0.0 112.392 176.424 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 6.5 t30 -140.17 12.39 2.4 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 124.99 1.316 . . . . 0.0 113.195 -176.732 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -79.57 10.17 4.2 Favored 'General case' 0 CA--C 1.546 0.805 0 N-CA-C 115.029 1.492 . . . . 0.0 115.029 -169.468 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 13.9 tt -139.68 20.57 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 C-N-CA 127.247 2.219 . . . . 0.0 112.579 176.672 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 1.5 tmtp? -117.96 -42.23 2.84 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 124.367 1.067 . . . . 0.0 113.603 -176.112 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 41.7 tptt -135.88 114.18 11.56 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 125.104 1.362 . . . . 0.0 110.976 -179.438 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 14.6 pt-20 -159.7 169.78 22.97 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 125.974 1.71 . . . . 0.0 111.577 -173.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -73.42 161.19 30.71 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 123.589 0.755 . . . . 0.0 112.766 174.338 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 53.3 t-20 -143.39 120.98 11.77 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 124.47 1.108 . . . . 0.0 111.34 -177.71 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 20.3 m-20 -135.06 25.11 3.58 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 125.668 1.587 . . . . 0.0 112.17 176.172 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 35.6 m -79.1 -0.61 32.28 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 115.234 1.568 . . . . 0.0 115.234 -169.642 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -168.58 105.02 0.22 Allowed Glycine 0 CA--C 1.533 1.167 0 C-N-CA 124.119 0.866 . . . . 0.0 111.906 166.863 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 5.1 p -125.35 7.98 4.31 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.295 0 C-N-CA 125.196 1.398 . . . . 0.0 113.919 -174.903 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 3.9 m -112.73 139.02 48.69 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 124.164 0.986 . . . . 0.0 112.55 -163.378 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.532 HD23 ' H ' ' A' ' 22' ' ' LEU . 2.1 pt? -71.86 38.6 0.07 Allowed 'General case' 0 CA--C 1.551 1.007 0 C-N-CA 126.593 1.957 . . . . 0.0 115.196 178.766 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -137.28 151.35 71.38 Favored Pre-proline 0 CA--C 1.549 0.912 0 C-N-CA 125.768 1.627 . . . . 0.0 112.62 -171.626 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_endo -75.34 -24.57 12.18 Favored 'Trans proline' 0 CA--C 1.542 0.891 0 C-N-CA 123.29 2.66 . . . . 0.0 113.515 -179.348 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.406 ' HG ' ' H ' ' A' ' 26' ' ' SER . 8.3 tp -150.65 -165.67 2.33 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 127.137 2.175 . . . . 0.0 108.358 177.464 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.406 ' H ' ' HG ' ' A' ' 25' ' ' LEU . 3.7 t -78.12 45.87 0.56 Allowed 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.892 1.277 . . . . 0.0 113.192 177.851 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 7.4 p -157.64 138.92 9.67 Favored Pre-proline 0 N--CA 1.472 0.636 0 C-N-CA 126.694 1.997 . . . . 0.0 109.844 -177.11 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_endo -76.69 71.05 6.2 Favored 'Trans proline' 0 CA--C 1.545 1.071 0 C-N-CA 123.615 2.877 . . . . 0.0 112.183 -176.564 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 53.1 tptt 61.07 108.97 0.03 OUTLIER Pre-proline 0 N--CA 1.481 1.106 0 C-N-CA 129.267 3.027 . . . . 0.0 112.733 -172.753 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 98.7 Cg_endo -72.09 146.36 46.43 Favored 'Trans proline' 0 C--N 1.351 0.691 0 C-N-CA 122.567 2.178 . . . . 0.0 111.55 -177.364 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 9.6 ptmm? -67.11 142.68 57.01 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 112.734 0.642 . . . . 0.0 112.734 -175.231 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 39.2 tp -137.07 136.6 38.51 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 126.075 1.75 . . . . 0.0 109.638 -178.005 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -145.42 50.86 1.21 Allowed 'General case' 0 N--CA 1.471 0.609 0 CA-C-O 123.149 1.452 . . . . 0.0 111.681 -176.3 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -112.4 84.01 1.9 Allowed 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 126.517 1.927 . . . . 0.0 111.154 -173.198 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 2.1 mt -130.28 153.92 48.14 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 127.129 2.172 . . . . 0.0 110.085 176.54 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 15.5 m -72.18 166.66 21.93 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.397 0.679 . . . . 0.0 111.707 176.257 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -57.04 -36.44 70.49 Favored 'General case' 0 N--CA 1.477 0.887 0 N-CA-C 113.951 1.093 . . . . 0.0 113.951 -172.697 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 11.3 tt0 -87.23 -40.9 14.13 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 123.857 0.863 . . . . 0.0 112.253 173.7 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 24.7 mm-40 -53.75 -44.3 69.86 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 124.322 1.049 . . . . 0.0 111.475 176.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 13.7 ptmt -66.0 -32.67 74.29 Favored 'General case' 0 N--CA 1.469 0.507 0 O-C-N 121.561 -0.712 . . . . 0.0 111.926 -179.262 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 49.3 mt -72.82 -43.71 59.93 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 CA-C-N 119.124 0.874 . . . . 0.0 110.864 175.907 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 50.2 mt -60.47 -43.36 94.03 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.978 0 CA-C-N 119.706 1.139 . . . . 0.0 110.362 176.737 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -61.6 -48.54 80.47 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 124.966 1.306 . . . . 0.0 110.958 175.278 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -67.47 -48.84 65.99 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 124.081 0.952 . . . . 0.0 113.033 -178.218 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -61.79 -23.68 66.36 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.707 0.803 . . . . 0.0 113.061 -179.032 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -73.09 -58.72 3.11 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 123.971 0.909 . . . . 0.0 111.141 174.564 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 67.6 mt -57.96 -35.41 51.88 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 C-N-CA 126.869 2.068 . . . . 0.0 111.476 176.267 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -70.21 -22.56 62.91 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 124.256 1.022 . . . . 0.0 113.317 176.644 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -93.72 -31.86 14.26 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.689 1.196 . . . . 0.0 112.719 178.22 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 6.3 m -121.72 -20.65 4.01 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 N-CA-C 113.971 1.101 . . . . 0.0 113.971 -172.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 84.42 142.89 5.69 Favored Glycine 0 CA--C 1.531 1.059 0 C-N-CA 125.047 1.308 . . . . 0.0 112.24 -171.341 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -67.22 -5.89 15.81 Favored 'General case' 0 N--CA 1.479 0.999 0 CA-C-O 122.688 1.232 . . . . 0.0 114.24 -171.207 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 38.8 mt-30 -90.3 -16.25 29.63 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 126.476 1.91 . . . . 0.0 112.753 176.512 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 58.5 m-80 -111.06 -6.03 14.7 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.831 1.252 . . . . 0.0 114.119 -176.336 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 15.5 pt -73.3 161.26 4.97 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 C-N-CA 124.07 0.948 . . . . 0.0 111.42 166.189 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.1 p -131.75 145.49 51.64 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 125.162 1.385 . . . . 0.0 110.495 175.953 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -61.65 -29.88 70.35 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 123.976 0.91 . . . . 0.0 111.844 177.748 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -63.0 -49.07 85.02 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.499 0 C-N-CA 125.316 1.446 . . . . 0.0 109.977 175.261 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 58.5 m -78.48 -42.98 28.2 Favored 'General case' 0 C--O 1.222 -0.357 0 C-N-CA 123.711 0.804 . . . . 0.0 109.854 -175.275 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 20.2 tp -61.5 -36.43 80.5 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.435 1.094 . . . . 0.0 112.17 174.874 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.476 ' HA ' HG13 ' A' ' 66' ' ' ILE . 38.4 t -54.03 -30.72 48.85 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 124.765 1.226 . . . . 0.0 112.725 169.041 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -102.21 -23.98 13.96 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.435 1.494 . . . . 0.0 114.373 -174.724 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 69.9 mmtt -61.5 -39.4 90.84 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 124.582 1.153 . . . . 0.0 110.993 170.429 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 9.2 mt -115.03 4.34 14.68 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 126.666 1.986 . . . . 0.0 113.209 -166.665 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . 0.292 7.4 p30 46.29 57.95 4.92 Favored 'General case' 0 CA--C 1.55 0.943 0 C-N-CA 126.803 2.041 . . . . 0.0 114.085 -175.266 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.476 HG13 ' HA ' ' A' ' 61' ' ' SER . 0.9 OUTLIER -120.83 -168.23 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 C-N-CA 127.386 2.274 . . . . 0.0 111.359 -175.756 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -88.68 156.88 18.75 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.131 0.972 . . . . 0.0 110.867 169.5 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 87.6 t -62.6 -31.58 52.53 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 123.209 0.604 . . . . 0.0 111.345 173.27 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 10.7 mp0 -79.53 -34.41 41.12 Favored 'General case' 0 CA--C 1.532 0.27 0 O-C-N 120.744 -1.222 . . . . 0.0 110.037 -178.317 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 12.2 tmtt? -68.67 -41.82 78.74 Favored 'General case' 0 C--N 1.343 0.304 0 C-N-CA 123.375 0.67 . . . . 0.0 111.306 177.239 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -58.71 -43.53 90.12 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.39 1.476 . . . . 0.0 112.661 169.188 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 37.6 ttpt -69.26 -27.52 65.51 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 125.004 1.322 . . . . 0.0 111.951 -179.346 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -61.47 -34.36 75.32 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 123.321 0.648 . . . . 0.0 112.462 177.661 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 55.9 m-85 -67.18 -45.71 76.13 Favored 'General case' 0 N--CA 1.466 0.348 0 C-N-CA 124.369 1.067 . . . . 0.0 110.528 171.057 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 73.9 mt -65.17 -24.84 36.04 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.834 0 O-C-N 121.135 -0.978 . . . . 0.0 111.675 -179.859 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.42 ' HA ' ' HE3' ' A' ' 76' ' ' LYS . 0.0 OUTLIER -81.78 -37.51 27.04 Favored 'General case' 0 N--CA 1.472 0.655 0 O-C-N 120.248 -1.533 . . . . 0.0 113.291 175.983 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 3.7 p30 -94.77 -39.56 10.22 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 119.807 1.185 . . . . 0.0 112.509 -176.776 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 9.2 m -89.36 -9.31 50.88 Favored 'General case' 0 CA--C 1.538 0.516 0 N-CA-C 114.236 1.198 . . . . 0.0 114.236 -164.376 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 12.7 p30 -65.5 144.47 57.0 Favored 'General case' 0 CA--C 1.546 0.801 0 O-C-N 121.258 -0.901 . . . . 0.0 113.216 -169.228 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 3.7 mpt_? 53.76 23.43 3.74 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 126.379 1.872 . . . . 0.0 115.125 -172.565 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 62.1 tp -143.72 -41.91 0.28 Allowed 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 125.0 1.32 . . . . 0.0 113.739 178.304 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 78.19 -80.89 1.35 Allowed Glycine 0 CA--C 1.532 1.117 0 O-C-N 121.72 -0.613 . . . . 0.0 112.562 -172.568 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 82.0 mtm-85 -136.87 -71.28 0.45 Allowed 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 125.497 1.519 . . . . 0.0 112.702 -175.648 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 4.9 t -164.74 83.85 0.4 Allowed 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 124.733 1.213 . . . . 0.0 109.768 179.499 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 69.1 m-80 -139.8 139.94 36.51 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.633 1.173 . . . . 0.0 111.302 -174.944 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 45.5 t30 -146.48 148.82 32.63 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 125.458 1.503 . . . . 0.0 111.103 179.496 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 9.3 tp 58.21 21.26 7.91 Favored 'General case' 0 CA--C 1.554 1.113 0 C-N-CA 126.205 1.802 . . . . 0.0 114.625 -179.077 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 18.6 ptmt -144.58 10.03 1.4 Allowed 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 126.102 1.761 . . . . 0.0 114.357 -173.5 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 12.3 t -156.68 129.68 7.87 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 125.932 1.693 . . . . 0.0 109.434 -179.361 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -137.81 0.89 0.74 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.75 0 C-N-CA 125.46 1.504 . . . . 0.0 114.176 -176.997 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 82.73 -8.13 63.48 Favored Glycine 0 N--CA 1.477 1.367 0 O-C-N 120.867 -1.146 . . . . 0.0 114.903 -167.764 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 4.5 mp 54.75 80.23 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 C-N-CA 126.953 2.101 . . . . 0.0 110.319 -174.47 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 8.7 mp -53.07 101.39 0.04 OUTLIER 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 126.555 1.942 . . . . 0.0 111.619 -169.39 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 6.5 pt20 -127.6 -8.64 5.66 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 125.856 1.663 . . . . 0.0 114.08 -177.861 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -68.85 146.9 52.45 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 125.364 1.466 . . . . 0.0 112.726 -177.895 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -99.4 105.56 17.53 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 124.595 1.158 . . . . 0.0 110.493 177.397 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 57.3 t -133.9 100.62 3.42 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.574 0 C-N-CA 125.199 1.4 . . . . 0.0 109.526 174.134 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 43.1 t -166.54 -73.1 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.428 1.091 . . . . 0.0 111.834 171.779 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 18.1 t -84.94 -32.69 22.94 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 124.095 0.958 . . . . 0.0 112.838 -176.502 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -126.06 125.46 42.65 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 125.836 1.654 . . . . 0.0 110.274 175.807 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -152.64 105.91 3.03 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 125.653 1.581 . . . . 0.0 108.254 173.47 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -144.78 -41.49 0.25 Allowed 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 116.009 1.855 . . . . 0.0 116.009 179.388 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 46.8 mmtm -140.58 35.42 1.83 Allowed 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 126.611 1.964 . . . . 0.0 113.204 -173.443 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 58.3 p -92.69 -0.73 57.25 Favored 'General case' 0 N--CA 1.478 0.956 0 N-CA-C 115.002 1.482 . . . . 0.0 115.002 -177.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 64.5 mtt -70.83 157.27 38.39 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.802 1.241 . . . . 0.0 113.501 179.944 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 10.9 t -108.4 166.8 10.5 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 125.547 1.539 . . . . 0.0 111.711 169.677 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 33.8 t-105 . . . . . 0 C--O 1.254 1.307 0 C-N-CA 125.676 1.59 . . . . 0.0 112.902 -171.523 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.587 0 N-CA-C 112.062 -0.415 . . . . 0.0 112.062 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 51.1 p -135.55 -73.95 0.45 Allowed 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 124.705 1.202 . . . . 0.0 112.727 -178.154 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 13.7 t-80 -149.02 59.92 1.05 Allowed 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 125.138 1.375 . . . . 0.0 111.832 -176.854 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 62.7 ttp -144.2 139.06 28.5 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 125.127 1.371 . . . . 0.0 111.563 178.911 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -145.89 153.69 41.13 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.454 1.102 . . . . 0.0 112.978 175.723 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 58.5 m -146.8 151.57 37.35 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 126.627 1.971 . . . . 0.0 110.919 -175.571 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -142.79 114.94 8.34 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 124.211 1.005 . . . . 0.0 110.635 177.467 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 58.7 m-20 38.11 55.61 4.47 Favored Pre-proline 0 CA--C 1.555 1.154 0 C-N-CA 127.721 2.409 . . . . 0.0 115.183 -177.711 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_endo -80.42 -7.5 13.82 Favored 'Trans proline' 0 C--N 1.351 0.683 0 C-N-CA 123.034 2.489 . . . . 0.0 114.907 -170.53 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -133.65 23.62 3.99 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 125.307 1.443 . . . . 0.0 114.594 -173.633 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -111.27 0.3 16.67 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 114.59 1.33 . . . . 0.0 114.59 -168.92 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -136.69 -30.13 0.91 Allowed 'General case' 0 N--CA 1.477 0.886 0 N-CA-C 116.442 2.016 . . . . 0.0 116.442 -164.726 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.2 pp -136.93 11.78 0.83 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.29 0 C-N-CA 125.427 1.491 . . . . 0.0 113.848 -177.833 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 19.0 tt -45.89 107.39 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.926 0 C-N-CA 126.246 1.818 . . . . 0.0 114.654 -163.596 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 21.7 t-20 -161.58 104.48 1.23 Allowed 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 125.683 1.593 . . . . 0.0 110.537 175.793 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -149.4 9.56 0.74 Allowed 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 114.477 1.288 . . . . 0.0 114.477 175.786 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 12.7 tt -151.06 27.65 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.164 0 C-N-CA 124.548 1.139 . . . . 0.0 113.83 -169.827 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 58.1 tttp -141.09 -40.37 0.4 Allowed 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 124.353 1.061 . . . . 0.0 113.362 -177.467 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 52.9 mttp -137.31 157.51 46.46 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 127.29 2.236 . . . . 0.0 112.151 174.779 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -148.39 149.16 31.27 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 126.503 1.921 . . . . 0.0 110.058 175.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -138.53 173.53 11.5 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.875 1.27 . . . . 0.0 112.554 177.32 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 68.5 m-80 -129.86 159.28 37.05 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 126.091 1.757 . . . . 0.0 111.755 -176.447 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -140.95 162.23 35.97 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 124.947 1.299 . . . . 0.0 112.106 171.388 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 61.5 p -128.98 33.1 4.65 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 125.627 1.571 . . . . 0.0 112.999 -178.451 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 77.56 46.06 10.28 Favored Glycine 0 CA--C 1.531 1.091 0 C-N-CA 123.81 0.719 . . . . 0.0 113.497 -179.763 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 2.6 p -108.64 106.31 20.45 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 C-N-CA 126.474 1.91 . . . . 0.0 110.651 -174.761 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -155.93 167.86 29.07 Favored 'General case' 0 N--CA 1.476 0.863 0 CA-C-O 122.141 0.972 . . . . 0.0 113.454 -178.881 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 5.2 mt -98.65 33.89 2.17 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 126.741 2.017 . . . . 0.0 111.918 -167.037 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -160.95 161.69 23.76 Favored Pre-proline 0 CA--C 1.551 0.987 0 C-N-CA 125.588 1.555 . . . . 0.0 111.727 -162.352 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -68.16 48.25 0.4 Allowed 'Trans proline' 0 CA--C 1.553 1.437 1 C-N-CA 125.771 4.314 . . . . 0.0 115.047 173.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 28.5 tp -86.49 104.26 15.79 Favored 'General case' 0 CA--C 1.538 0.488 0 O-C-N 120.375 -1.453 . . . . 0.0 109.787 174.698 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 1.4 t 55.39 34.16 22.36 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 125.251 1.421 . . . . 0.0 114.255 -175.077 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 8.0 p -155.93 143.67 14.1 Favored Pre-proline 0 N--CA 1.471 0.597 0 C-N-CA 125.943 1.697 . . . . 0.0 109.619 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 94.3 Cg_endo -76.43 60.99 6.64 Favored 'Trans proline' 0 CA--C 1.545 1.064 0 C-N-CA 123.701 2.934 . . . . 0.0 112.047 177.661 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 63.06 129.25 0.02 OUTLIER Pre-proline 0 N--CA 1.481 1.108 0 C-N-CA 128.954 2.902 . . . . 0.0 113.924 -175.602 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -77.93 163.37 28.56 Favored 'Trans proline' 0 CA--C 1.54 0.806 0 C-N-CA 123.051 2.501 . . . . 0.0 112.46 172.94 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -114.55 109.89 18.96 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 125.503 1.521 . . . . 0.0 110.278 174.449 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -146.83 143.54 28.67 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.691 1.196 . . . . 0.0 113.943 -178.72 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 17.0 mm-40 -137.14 57.95 1.73 Allowed 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 126.766 2.027 . . . . 0.0 109.573 179.218 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -130.03 98.09 4.66 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 124.948 1.299 . . . . 0.0 111.595 -174.545 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.2 mp -120.09 162.05 19.94 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 127.246 2.218 . . . . 0.0 110.909 173.429 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 19.3 t -70.04 165.4 21.95 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 122.781 0.432 . . . . 0.0 110.472 170.547 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -56.45 -46.09 80.5 Favored 'General case' 0 N--CA 1.476 0.84 0 O-C-N 120.388 -1.445 . . . . 0.0 112.933 -173.188 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 9.2 tt0 -72.93 -43.0 62.9 Favored 'General case' 0 CA--C 1.539 0.523 0 O-C-N 121.41 -0.806 . . . . 0.0 111.418 177.686 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 36.7 mm-40 -55.1 -44.44 74.94 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.659 1.184 . . . . 0.0 111.233 175.664 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 42.0 ttmt -62.95 -44.0 97.26 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 125.171 1.388 . . . . 0.0 111.58 177.53 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 54.0 mt -65.95 -41.97 90.9 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 CA-C-N 119.12 0.873 . . . . 0.0 111.134 178.031 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 37.9 mt -66.67 -42.26 89.38 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.885 0 CA-C-N 120.291 1.405 . . . . 0.0 110.512 179.001 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -60.11 -47.26 86.64 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.033 0.933 . . . . 0.0 110.898 175.614 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -68.01 -49.85 59.08 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 124.819 1.248 . . . . 0.0 112.217 -179.931 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -64.27 -23.49 67.32 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 119.209 0.913 . . . . 0.0 112.976 -176.953 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -71.31 -59.68 2.64 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.388 1.075 . . . . 0.0 110.792 173.226 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 62.9 mt -62.5 -34.68 66.09 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.256 0 C-N-CA 127.417 2.287 . . . . 0.0 111.953 -179.625 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -68.58 -33.46 74.1 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 123.784 0.834 . . . . 0.0 111.989 176.933 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -85.36 -38.18 19.04 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.696 0.799 . . . . 0.0 112.3 179.068 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.0 m -108.39 -5.45 10.68 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.126 0 N-CA-C 114.013 1.116 . . . . 0.0 114.013 -173.909 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 87.79 24.63 34.83 Favored Glycine 0 N--CA 1.472 1.09 0 C-N-CA 125.047 1.308 . . . . 0.0 115.73 159.639 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 56.23 10.67 0.66 Allowed 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 127.146 2.178 . . . . 0.0 114.848 -174.014 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 5.2 pt20 -124.87 -5.91 7.41 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 125.564 1.546 . . . . 0.0 113.573 -169.873 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 59.4 m-80 -121.38 2.33 10.24 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.34 1.456 . . . . 0.0 112.577 173.294 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 23.2 pt -74.97 154.19 6.44 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.583 0 C-N-CA 123.048 0.539 . . . . 0.0 111.147 173.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -136.77 142.58 42.99 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 124.972 1.309 . . . . 0.0 109.177 177.465 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -61.57 -26.88 68.24 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 118.958 0.799 . . . . 0.0 112.494 -179.766 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -65.36 -47.69 86.06 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.559 0 C-N-CA 125.313 1.445 . . . . 0.0 109.989 174.3 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 72.5 m -77.75 -43.11 31.84 Favored 'General case' 0 C--O 1.221 -0.402 0 N-CA-C 109.411 -0.589 . . . . 0.0 109.411 -176.814 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 16.5 tp -60.71 -37.55 82.07 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 125.105 1.362 . . . . 0.0 112.155 175.143 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.458 ' HA ' HG13 ' A' ' 66' ' ' ILE . 24.3 p -63.11 -20.39 65.32 Favored 'General case' 0 N--CA 1.475 0.797 0 N-CA-C 113.567 0.951 . . . . 0.0 113.567 172.095 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 24.0 mtpp -106.89 -23.36 12.39 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 126.108 1.763 . . . . 0.0 114.474 -176.127 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 65.7 mmtt -66.48 -35.27 79.86 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 125.33 1.452 . . . . 0.0 111.125 170.381 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 14.3 mt -117.65 1.47 12.22 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 126.917 2.087 . . . . 0.0 113.099 -168.621 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 18.6 t30 55.08 61.99 2.7 Favored 'General case' 0 CA--C 1.553 1.066 0 C-N-CA 124.701 1.2 . . . . 0.0 112.296 176.655 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.458 HG13 ' HA ' ' A' ' 61' ' ' SER . 0.6 OUTLIER -137.91 178.08 4.81 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.782 0 C-N-CA 127.304 2.241 . . . . 0.0 111.302 -171.378 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 2.6 p -78.09 157.55 29.47 Favored 'General case' 0 N--CA 1.48 1.045 0 O-C-N 120.98 -1.075 . . . . 0.0 111.447 171.806 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 99.3 t -63.38 -29.67 47.84 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 C-N-CA 123.264 0.626 . . . . 0.0 111.365 173.54 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -78.89 -38.72 36.86 Favored 'General case' 0 N--CA 1.468 0.452 0 O-C-N 120.988 -1.07 . . . . 0.0 110.078 -177.794 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 4.1 tmtm? -66.27 -44.91 82.29 Favored 'General case' 0 C--N 1.339 0.137 0 C-N-CA 124.808 1.243 . . . . 0.0 110.856 176.399 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -59.21 -48.8 80.28 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 124.863 1.265 . . . . 0.0 112.738 171.195 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 36.6 ttmt -69.32 -27.42 65.36 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 124.403 1.081 . . . . 0.0 111.4 -175.225 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -53.01 -43.83 66.82 Favored 'General case' 0 CA--C 1.543 0.705 0 CA-C-N 118.154 0.434 . . . . 0.0 111.459 174.227 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 24.8 m-85 -63.05 -42.0 99.61 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 123.432 0.693 . . . . 0.0 111.458 177.944 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 13.7 mt -66.59 -26.26 37.0 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.651 0 C-N-CA 124.477 1.111 . . . . 0.0 110.996 177.859 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 68.9 mmtt -83.33 -25.63 31.3 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 125.774 1.629 . . . . 0.0 114.711 178.249 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 25.7 p30 -113.5 -41.89 3.56 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-N 120.131 1.332 . . . . 0.0 113.513 -178.521 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 2.3 t -80.41 -7.66 59.21 Favored 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 114.676 1.362 . . . . 0.0 114.676 -173.575 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 17.3 p30 -62.57 -10.01 10.69 Favored 'General case' 0 CA--C 1.549 0.919 0 N-CA-C 115.837 1.791 . . . . 0.0 115.837 -176.683 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 8.1 mpt_? -75.04 -23.87 58.21 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 124.931 1.292 . . . . 0.0 113.68 172.611 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 4.1 mt -84.76 -53.46 5.34 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 113.774 1.027 . . . . 0.0 113.774 -171.672 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -79.97 133.1 11.94 Favored Glycine 0 CA--C 1.535 1.295 0 O-C-N 122.092 -0.38 . . . . 0.0 112.877 -175.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 31.9 mmm180 -133.96 -97.11 0.27 Allowed 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 125.386 1.474 . . . . 0.0 112.462 -177.403 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 13.1 t -154.19 55.69 0.71 Allowed 'General case' 0 N--CA 1.481 1.084 0 CA-C-O 123.015 1.388 . . . . 0.0 111.839 -169.658 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 70.6 m-80 -113.86 12.4 18.16 Favored 'General case' 0 CA--C 1.549 0.928 0 N-CA-C 114.453 1.279 . . . . 0.0 114.453 -170.325 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 5.1 t30 -107.31 92.97 4.3 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 125.207 1.403 . . . . 0.0 110.692 178.795 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -139.44 165.49 27.07 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 127.096 2.158 . . . . 0.0 110.109 -175.502 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 58.5 pttt -131.83 13.29 4.84 Favored 'General case' 0 N--CA 1.481 1.116 0 N-CA-C 115.102 1.519 . . . . 0.0 115.102 -166.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 7.0 t -129.11 42.5 3.3 Favored 'General case' 0 N--CA 1.481 1.075 0 CA-C-O 123.47 1.605 . . . . 0.0 112.743 -172.759 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.523 HD13 ' H ' ' A' ' 90' ' ' ILE . 0.2 OUTLIER -90.61 2.67 7.27 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 N-CA-C 114.351 1.241 . . . . 0.0 114.351 -167.446 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 68.08 4.78 37.27 Favored Glycine 0 CA--C 1.535 1.307 0 C-N-CA 124.068 0.842 . . . . 0.0 114.188 -171.107 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . 0.275 20.1 mm 53.96 32.18 0.18 Allowed 'Isoleucine or valine' 0 CA--C 1.552 1.024 0 C-N-CA 126.736 2.014 . . . . 0.0 111.63 175.655 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 12.2 tp 51.15 29.84 5.13 Favored 'General case' 0 CA--C 1.554 1.116 0 C-N-CA 126.674 1.989 . . . . 0.0 114.657 -177.113 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -130.76 21.22 5.03 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.914 1.286 . . . . 0.0 114.317 -175.172 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -74.14 151.33 40.09 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 124.136 0.974 . . . . 0.0 112.976 177.851 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -134.01 110.29 9.56 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 125.115 1.366 . . . . 0.0 110.354 174.275 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 48.6 t -141.69 127.24 18.32 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 C-N-CA 125.038 1.335 . . . . 0.0 110.229 178.291 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 9.7 t -98.94 83.38 2.9 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 124.792 1.237 . . . . 0.0 111.355 175.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 49.2 m 48.87 73.65 0.22 Allowed 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 126.456 1.902 . . . . 0.0 114.569 173.918 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 20.4 mmt 56.35 56.19 5.96 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 125.244 1.417 . . . . 0.0 112.296 -173.066 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 75.0 tt0 -72.42 96.3 1.88 Allowed 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 125.558 1.543 . . . . 0.0 110.284 174.106 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -139.49 159.47 42.1 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 125.309 1.444 . . . . 0.0 112.382 -174.838 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 14.0 mmmm -124.82 104.18 8.48 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 125.65 1.58 . . . . 0.0 110.826 -177.446 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 25.3 t -151.99 123.95 8.06 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 125.563 1.545 . . . . 0.0 110.129 172.698 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 13.1 ttt -158.75 147.03 18.27 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 125.095 1.358 . . . . 0.0 111.288 -176.528 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 11.1 m -71.32 142.95 50.42 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 123.481 0.712 . . . . 0.0 110.58 168.27 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 25.1 t-105 . . . . . 0 C--O 1.253 1.27 0 C-N-CA 125.284 1.434 . . . . 0.0 113.046 -172.049 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.48 0 N-CA-C 110.842 -0.903 . . . . 0.0 110.842 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 45.8 m -140.79 158.82 43.42 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 125.401 1.48 . . . . 0.0 111.774 -175.287 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 38.3 m80 -127.83 144.32 51.09 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 124.997 1.319 . . . . 0.0 111.531 -179.826 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 78.3 mtp 52.75 36.56 21.51 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 125.447 1.499 . . . . 0.0 114.145 179.464 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -151.62 171.79 17.07 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 113.847 1.054 . . . . 0.0 113.847 -170.341 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 88.6 p -138.1 163.83 30.64 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 126.321 1.848 . . . . 0.0 112.383 -176.241 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 76.6 mtm -130.45 133.43 46.31 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 125.651 1.58 . . . . 0.0 110.535 175.473 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -147.12 136.47 11.64 Favored Pre-proline 0 CA--C 1.552 1.032 0 C-N-CA 124.897 1.279 . . . . 0.0 111.838 -176.596 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -81.49 -7.91 12.66 Favored 'Trans proline' 0 C--N 1.352 0.714 0 C-N-CA 123.388 2.725 . . . . 0.0 115.688 -177.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 83.3 mt -102.2 39.21 1.52 Allowed 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.303 1.441 . . . . 0.0 113.276 -173.994 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 12.6 m-20 -101.93 -3.16 28.29 Favored 'General case' 0 N--CA 1.478 0.962 0 N-CA-C 114.705 1.372 . . . . 0.0 114.705 168.335 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.74 -58.61 1.23 Allowed 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 124.297 1.039 . . . . 0.0 113.445 -164.82 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.8 pp -107.33 9.1 9.42 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 C-N-CA 125.495 1.518 . . . . 0.0 112.906 -177.748 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 10.5 tt -52.42 126.44 8.15 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.727 0 C-N-CA 123.825 0.85 . . . . 0.0 112.13 177.151 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -146.93 -1.25 0.68 Allowed 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 124.386 1.075 . . . . 0.0 113.497 -178.279 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -88.63 12.41 14.78 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 114.818 1.414 . . . . 0.0 114.818 -162.297 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 7.1 tp -143.89 21.95 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 125.62 1.568 . . . . 0.0 113.891 -171.337 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 29.4 mtpp -122.97 -38.51 2.6 Favored 'General case' 0 N--CA 1.479 1.005 0 N-CA-C 115.396 1.628 . . . . 0.0 115.396 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 50.6 tptt 47.96 48.68 17.81 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 125.566 1.546 . . . . 0.0 112.479 -175.342 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 27.1 tt0 -114.64 63.59 0.67 Allowed 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 125.311 1.444 . . . . 0.0 111.271 -169.294 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -142.12 165.19 28.12 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.392 1.477 . . . . 0.0 112.732 -178.893 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -122.92 55.82 1.18 Allowed 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 125.796 1.639 . . . . 0.0 110.923 -175.53 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -134.98 143.92 47.1 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 125.493 1.517 . . . . 0.0 111.452 -178.31 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 2.5 t -134.54 32.56 3.32 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.85 1.26 . . . . 0.0 113.051 -179.762 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 74.98 57.87 4.25 Favored Glycine 0 CA--C 1.531 1.032 0 C-N-CA 124.789 1.185 . . . . 0.0 113.985 174.634 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 7.7 p -97.23 2.62 10.26 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.104 0 C-N-CA 126.188 1.795 . . . . 0.0 113.951 -175.023 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -86.61 160.49 18.9 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 125.746 1.618 . . . . 0.0 113.633 -168.863 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 1.3 pt? -114.37 33.64 5.18 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 126.708 2.003 . . . . 0.0 114.509 -174.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -128.56 133.31 25.03 Favored Pre-proline 0 CA--C 1.547 0.852 0 C-N-CA 125.702 1.601 . . . . 0.0 111.422 -175.517 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -77.19 -36.92 1.19 Allowed 'Trans proline' 0 CA--C 1.541 0.842 0 C-N-CA 122.254 1.97 . . . . 0.0 113.549 -178.113 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 22.5 tp -154.88 69.19 0.72 Allowed 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.931 1.292 . . . . 0.0 111.123 -179.94 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 50.3 m 55.52 37.59 29.08 Favored 'General case' 0 N--CA 1.48 1.043 0 N-CA-C 114.64 1.348 . . . . 0.0 114.64 175.521 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 7.7 p -153.18 145.28 16.93 Favored Pre-proline 0 N--CA 1.473 0.696 0 C-N-CA 125.931 1.693 . . . . 0.0 110.105 -171.685 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 97.8 Cg_endo -77.37 62.26 7.58 Favored 'Trans proline' 0 CA--C 1.549 1.23 0 C-N-CA 123.511 2.808 . . . . 0.0 112.389 178.095 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 26.2 tptt 59.42 111.19 0.02 OUTLIER Pre-proline 0 N--CA 1.484 1.263 0 C-N-CA 129.397 3.079 . . . . 0.0 113.817 -176.267 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 94.0 Cg_endo -74.54 143.36 30.61 Favored 'Trans proline' 0 CA--C 1.537 0.648 0 C-N-CA 122.61 2.206 . . . . 0.0 111.636 -173.597 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 25.4 pttm -67.55 128.78 37.73 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 123.258 0.623 . . . . 0.0 111.971 -179.408 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 2.6 pp -143.77 152.11 40.83 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 113.868 1.062 . . . . 0.0 113.868 -173.098 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 22.6 mm-40 -141.11 102.04 4.16 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 126.71 2.004 . . . . 0.0 108.815 173.719 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -139.1 78.62 1.68 Allowed 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 124.598 1.159 . . . . 0.0 110.243 -178.256 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 5.2 mt -129.91 155.15 46.51 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 126.989 2.116 . . . . 0.0 110.397 -177.332 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 19.8 t -71.77 166.96 20.93 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 122.759 0.424 . . . . 0.0 110.388 167.271 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -57.0 -45.88 82.71 Favored 'General case' 0 N--CA 1.475 0.796 0 O-C-N 120.571 -1.331 . . . . 0.0 112.589 -175.213 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 10.2 tt0 -72.51 -42.42 64.83 Favored 'General case' 0 N--CA 1.469 0.517 0 O-C-N 121.528 -0.732 . . . . 0.0 111.341 177.416 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 34.7 mm-40 -57.03 -43.11 81.57 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 124.082 0.953 . . . . 0.0 111.109 176.782 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 21.8 ttmm -61.65 -43.0 99.68 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.626 1.17 . . . . 0.0 111.288 177.12 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 49.7 mt -67.37 -40.4 84.65 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 CA-C-O 118.197 -0.906 . . . . 0.0 111.097 177.601 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 35.0 mt -65.46 -44.19 94.33 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.956 0 CA-C-N 120.652 1.569 . . . . 0.0 110.721 177.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -56.56 -48.35 77.54 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.27 1.028 . . . . 0.0 110.544 174.589 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -66.97 -51.9 49.42 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.454 1.101 . . . . 0.0 112.926 -179.7 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -59.12 -27.26 65.44 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 119.25 0.932 . . . . 0.0 113.118 179.849 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -70.95 -58.74 3.28 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 123.415 0.686 . . . . 0.0 111.26 176.469 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 55.5 mt -59.24 -34.54 54.12 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.61 0 C-N-CA 126.26 1.824 . . . . 0.0 111.314 176.481 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -70.19 -22.44 62.94 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 124.209 1.003 . . . . 0.0 113.256 176.146 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -96.14 -29.91 13.81 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.591 1.157 . . . . 0.0 113.097 178.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 7.8 m -121.96 -19.13 4.57 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.002 0 N-CA-C 114.121 1.156 . . . . 0.0 114.121 -175.487 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 82.36 142.06 4.04 Favored Glycine 0 CA--C 1.532 1.146 0 C-N-CA 124.77 1.176 . . . . 0.0 112.199 -171.171 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -65.76 -12.1 51.19 Favored 'General case' 0 N--CA 1.479 0.99 0 O-C-N 121.059 -1.259 . . . . 0.0 113.898 -171.709 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 35.9 mt-30 -77.68 -16.85 58.22 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 126.257 1.823 . . . . 0.0 112.969 174.94 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 67.0 m-80 -114.37 -6.5 12.92 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 114.642 1.349 . . . . 0.0 114.642 -173.058 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 13.8 pt -74.93 159.63 5.45 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.656 0 C-N-CA 124.09 0.956 . . . . 0.0 111.869 170.097 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.4 p -135.16 145.07 47.43 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 125.248 1.419 . . . . 0.0 110.142 175.284 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -60.47 -30.2 69.53 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 124.044 0.938 . . . . 0.0 112.176 179.041 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -61.95 -42.32 94.31 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.513 0 C-N-CA 125.352 1.461 . . . . 0.0 110.264 175.105 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 86.8 m -88.1 -40.84 13.47 Favored 'General case' 0 C--O 1.223 -0.336 0 C-N-CA 125.152 1.381 . . . . 0.0 109.699 -172.351 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 24.7 tp -60.57 -36.97 79.79 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.915 1.286 . . . . 0.0 111.543 170.994 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.501 ' HA ' HG13 ' A' ' 66' ' ' ILE . 40.8 t -53.99 -34.09 58.85 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 124.865 1.266 . . . . 0.0 113.154 168.927 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -97.52 -27.05 14.6 Favored 'General case' 0 C--N 1.329 -0.326 0 C-N-CA 124.578 1.151 . . . . 0.0 113.743 -174.205 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 19.8 mttp -69.36 -33.4 73.02 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 124.219 1.007 . . . . 0.0 112.448 174.374 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 4.5 mp -108.02 -0.85 21.0 Favored 'General case' 0 CA--C 1.541 0.596 0 N-CA-C 114.385 1.254 . . . . 0.0 114.385 -178.641 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 33.8 m-80 54.92 43.91 29.16 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 125.336 1.455 . . . . 0.0 112.587 -173.58 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.501 HG13 ' HA ' ' A' ' 61' ' ' SER . 9.9 pt -103.16 -171.89 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.674 0 C-N-CA 126.218 1.807 . . . . 0.0 111.246 -178.644 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 43.9 p -85.62 159.44 19.85 Favored 'General case' 0 N--CA 1.471 0.625 0 O-C-N 121.473 -0.767 . . . . 0.0 111.057 165.711 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 58.0 t -60.6 -27.31 40.18 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.978 0 O-C-N 121.407 -0.808 . . . . 0.0 111.398 169.943 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 4.9 tm-20 -80.57 -40.78 25.23 Favored 'General case' 0 CA--C 1.531 0.249 0 O-C-N 120.609 -1.307 . . . . 0.0 110.168 -173.86 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . 0.367 0.0 OUTLIER -86.94 7.79 25.94 Favored 'General case' 0 C--N 1.348 0.502 0 N-CA-C 113.175 0.806 . . . . 0.0 113.175 173.589 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -94.61 -45.12 7.52 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.827 1.251 . . . . 0.0 111.557 158.071 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt -74.47 -27.86 60.77 Favored 'General case' 0 CA--C 1.519 -0.234 0 C-N-CA 124.86 1.264 . . . . 0.0 111.84 -172.927 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 31.2 p-10 -56.21 -37.85 70.21 Favored 'General case' 0 CA--C 1.545 0.765 0 N-CA-C 112.906 0.706 . . . . 0.0 112.906 175.813 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 28.7 m-85 -65.86 -48.97 69.79 Favored 'General case' 0 C--O 1.222 -0.372 0 C-N-CA 126.791 2.036 . . . . 0.0 109.889 176.449 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 76.7 mt -64.2 -38.72 83.23 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 C-N-CA 123.859 0.864 . . . . 0.0 110.374 -179.619 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 28.4 mmtm -63.41 -31.41 72.55 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 125.668 1.587 . . . . 0.0 113.448 177.509 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 8.9 p30 -95.53 -35.76 11.55 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 119.817 1.19 . . . . 0.0 112.463 174.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 69.6 m -87.04 -13.04 45.52 Favored 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 116.007 1.854 . . . . 0.0 116.007 -170.57 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 10.5 p30 -57.41 145.46 32.63 Favored 'General case' 0 CA--C 1.549 0.926 0 CA-C-N 119.686 1.13 . . . . 0.0 113.868 -175.282 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 1.9 mpt_? 59.71 -31.69 0.05 Allowed 'General case' 0 N--CA 1.493 1.679 0 C-N-CA 129.091 2.956 . . . . 0.0 115.999 -169.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -84.53 -45.8 12.24 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 126.793 2.037 . . . . 0.0 112.236 -172.89 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -80.79 127.26 7.81 Favored Glycine 0 CA--C 1.534 1.259 0 C-N-CA 123.218 0.437 . . . . 0.0 112.787 -178.241 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 91.8 mtt180 -140.23 177.76 7.76 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 125.559 1.544 . . . . 0.0 112.767 -171.586 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 7.3 t -118.77 21.76 12.32 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 126.028 1.731 . . . . 0.0 114.24 -162.345 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 66.4 m-80 -89.72 125.53 35.31 Favored 'General case' 0 CA--C 1.544 0.737 0 O-C-N 120.542 -1.349 . . . . 0.0 112.031 -179.717 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -153.88 65.07 0.72 Allowed 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 125.136 1.374 . . . . 0.0 110.848 -178.267 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 3.6 mp -127.68 162.81 25.67 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.18 1.392 . . . . 0.0 112.19 -173.593 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 8.7 ptmm? -131.19 14.1 5.13 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 126.456 1.902 . . . . 0.0 114.697 -168.81 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 10.7 t -131.42 41.43 3.31 Favored 'General case' 0 N--CA 1.482 1.137 0 CA-C-O 123.461 1.6 . . . . 0.0 112.727 -170.535 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.495 HD13 ' H ' ' A' ' 90' ' ' ILE . 0.2 OUTLIER -90.84 1.6 8.11 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 N-CA-C 114.792 1.404 . . . . 0.0 114.792 -167.735 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 67.2 5.98 37.21 Favored Glycine 0 CA--C 1.538 1.506 0 O-C-N 121.162 -0.961 . . . . 0.0 114.104 -170.891 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . 0.29 3.3 mp 48.92 39.18 0.32 Allowed 'Isoleucine or valine' 0 CA--C 1.548 0.896 0 C-N-CA 127.188 2.195 . . . . 0.0 111.498 179.79 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 10.2 tp 55.22 20.65 3.54 Favored 'General case' 0 CA--C 1.552 1.033 0 C-N-CA 127.569 2.348 . . . . 0.0 115.711 179.606 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 35.2 mt-30 -137.95 51.63 1.88 Allowed 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 125.497 1.519 . . . . 0.0 112.295 -165.868 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -93.23 7.01 46.07 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 125.203 1.401 . . . . 0.0 113.722 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -103.51 53.05 0.76 Allowed 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 125.648 1.579 . . . . 0.0 113.084 -169.19 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 59.5 t -139.1 140.72 37.72 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 C-N-CA 125.502 1.521 . . . . 0.0 110.491 -179.825 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 21.9 t -130.41 -62.8 0.91 Allowed 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 124.461 1.104 . . . . 0.0 113.157 178.185 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 75.0 m -138.7 102.28 4.54 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 124.5 1.12 . . . . 0.0 111.429 -176.764 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 69.4 mtm 51.37 31.06 6.7 Favored 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 125.869 1.668 . . . . 0.0 113.933 -177.457 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -96.69 -2.29 44.84 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.242 1.417 . . . . 0.0 113.244 -168.093 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -75.27 160.12 30.72 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.246 1.419 . . . . 0.0 112.893 178.758 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 44.7 mmtm -104.01 122.39 45.15 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 125.171 1.388 . . . . 0.0 110.431 173.314 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 78.9 p -154.33 164.78 38.06 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 125.699 1.599 . . . . 0.0 111.84 -177.378 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 66.2 mtt -136.39 171.22 14.8 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 125.537 1.535 . . . . 0.0 112.198 -177.202 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 12.8 t -131.16 164.12 26.21 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 125.714 1.606 . . . . 0.0 111.804 175.765 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 25.1 m-90 . . . . . 0 C--O 1.253 1.264 0 C-N-CA 126.222 1.809 . . . . 0.0 112.564 -172.329 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.617 0 N-CA-C 111.451 -0.66 . . . . 0.0 111.451 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 1.9 t -127.36 15.41 7.17 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 124.979 1.312 . . . . 0.0 113.41 -177.282 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 76.3 m80 -95.78 154.06 17.42 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 125.62 1.568 . . . . 0.0 112.48 -177.958 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 28.0 ttt -143.14 118.52 10.27 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 125.276 1.43 . . . . 0.0 110.537 179.072 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -153.76 160.38 42.25 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 124.87 1.268 . . . . 0.0 112.497 178.958 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 58.7 m -141.72 125.78 17.29 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 125.35 1.46 . . . . 0.0 111.415 -174.359 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 62.7 mtt -144.01 138.01 28.08 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 125.912 1.685 . . . . 0.0 110.111 172.825 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -132.91 57.4 27.92 Favored Pre-proline 0 CA--C 1.555 1.169 0 C-N-CA 124.54 1.136 . . . . 0.0 113.432 -174.909 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_endo -78.12 -4.92 14.78 Favored 'Trans proline' 0 C--N 1.353 0.803 0 C-N-CA 123.391 2.727 . . . . 0.0 115.285 -176.105 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -132.77 35.68 3.56 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.839 1.656 . . . . 0.0 114.018 -175.022 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -104.6 -1.21 26.76 Favored 'General case' 0 N--CA 1.478 0.945 0 N-CA-C 114.547 1.314 . . . . 0.0 114.547 176.302 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -130.07 -58.56 1.07 Allowed 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 124.369 1.068 . . . . 0.0 113.515 -164.124 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.8 pp -107.77 10.2 9.17 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.786 0 C-N-CA 125.631 1.572 . . . . 0.0 113.033 -178.07 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 17.7 tt -47.97 125.5 2.32 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 C-N-CA 124.775 1.23 . . . . 0.0 113.18 179.507 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 21.3 t30 -147.43 0.34 0.68 Allowed 'General case' 0 CA--C 1.543 0.693 0 N-CA-C 114.511 1.3 . . . . 0.0 114.511 -179.788 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -85.31 10.85 11.43 Favored 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 115.02 1.489 . . . . 0.0 115.02 -167.792 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 16.0 tt -144.19 34.59 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 C-N-CA 126.543 1.937 . . . . 0.0 112.049 -177.612 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 33.3 ttmt -123.83 -50.08 1.84 Allowed 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 114.522 1.304 . . . . 0.0 114.522 -173.817 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 68.5 tttt 44.21 52.85 6.94 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 126.328 1.851 . . . . 0.0 113.392 -173.589 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 26.4 tt0 -141.98 155.51 45.45 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 124.511 1.125 . . . . 0.0 112.176 -176.828 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -79.48 -174.68 4.36 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 125.069 1.348 . . . . 0.0 113.876 -179.305 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 50.8 p-10 -126.99 169.59 13.17 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 126.331 1.852 . . . . 0.0 113.2 -176.994 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 20.4 m-20 -131.44 39.74 3.49 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 125.587 1.555 . . . . 0.0 112.748 -173.589 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 71.2 p -81.34 29.45 0.36 Allowed 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 115.645 1.72 . . . . 0.0 115.645 -176.692 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -95.17 -97.67 1.71 Allowed Glycine 0 CA--C 1.534 1.251 0 C-N-CA 125.167 1.365 . . . . 0.0 113.259 175.629 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 84.0 t 59.02 117.97 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.943 0 C-N-CA 129.154 2.982 . . . . 0.0 114.369 -173.981 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.468 HG22 ' H ' ' A' ' 22' ' ' LEU . 0.8 OUTLIER 57.12 -157.59 0.28 Allowed 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 125.158 1.383 . . . . 0.0 111.788 178.176 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.468 ' H ' HG22 ' A' ' 21' ' ' THR . 1.0 OUTLIER -123.36 33.11 5.45 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 125.633 1.573 . . . . 0.0 112.655 174.557 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -106.56 139.56 20.47 Favored Pre-proline 0 CA--C 1.548 0.885 0 C-N-CA 126.041 1.737 . . . . 0.0 111.218 -179.645 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -73.74 -34.3 5.59 Favored 'Trans proline' 0 CA--C 1.539 0.752 0 C-N-CA 122.493 2.129 . . . . 0.0 113.272 -178.717 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 15.6 tp -151.03 56.29 0.89 Allowed 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 124.145 0.978 . . . . 0.0 112.418 178.954 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.3 t 56.31 37.48 28.87 Favored 'General case' 0 N--CA 1.479 1.008 0 N-CA-C 114.302 1.223 . . . . 0.0 114.302 178.388 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 8.8 p -154.24 144.24 15.54 Favored Pre-proline 0 N--CA 1.472 0.67 0 C-N-CA 126.281 1.832 . . . . 0.0 109.745 -172.807 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 79.5 Cg_endo -74.25 74.02 3.71 Favored 'Trans proline' 0 CA--C 1.545 1.026 0 C-N-CA 123.306 2.671 . . . . 0.0 112.658 -177.98 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 51.3 tptt 54.65 91.7 0.07 OUTLIER Pre-proline 0 N--CA 1.483 1.224 0 C-N-CA 129.127 2.971 . . . . 0.0 113.542 173.192 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -81.02 154.05 19.35 Favored 'Trans proline' 0 CA--C 1.537 0.67 0 C-N-CA 123.344 2.696 . . . . 0.0 112.694 -167.21 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 36.6 pttt -51.14 132.12 27.9 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 126.365 1.866 . . . . 0.0 112.841 179.463 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 49.5 tp -142.84 141.61 31.63 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 124.908 1.283 . . . . 0.0 112.004 -164.353 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -139.21 113.47 8.86 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 125.152 1.381 . . . . 0.0 109.585 173.938 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -150.64 52.35 0.88 Allowed 'General case' 0 N--CA 1.474 0.773 0 CA-C-O 123.078 1.418 . . . . 0.0 113.606 -176.148 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 5.9 mt -110.68 151.83 27.25 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 126.003 1.721 . . . . 0.0 111.607 -174.444 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 22.7 t -72.16 166.28 22.67 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 123.31 0.644 . . . . 0.0 110.545 167.074 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -55.57 -43.71 76.19 Favored 'General case' 0 N--CA 1.476 0.831 0 O-C-N 120.83 -1.169 . . . . 0.0 112.495 -177.809 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 13.1 tt0 -73.49 -41.76 62.71 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 123.561 0.744 . . . . 0.0 111.315 176.22 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 84.4 mt-30 -63.07 -38.35 90.84 Favored 'General case' 0 N--CA 1.466 0.335 0 O-C-N 121.698 -0.626 . . . . 0.0 111.94 179.58 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 20.9 ttmm -59.3 -42.19 90.74 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 123.975 0.91 . . . . 0.0 110.748 174.171 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 46.2 mt -69.61 -42.12 80.45 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 CA-C-O 118.036 -0.983 . . . . 0.0 111.361 178.129 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 40.4 mt -64.47 -43.84 96.95 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 CA-C-N 120.644 1.565 . . . . 0.0 110.174 177.997 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -57.98 -47.51 82.76 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.886 1.275 . . . . 0.0 110.336 177.281 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -67.22 -52.19 44.14 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.645 1.178 . . . . 0.0 113.429 177.574 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.7 mm-40 -61.18 -26.42 67.7 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-N 119.1 0.864 . . . . 0.0 113.101 -177.947 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.476 ' CE2' HG22 ' A' ' 55' ' ' ILE . 1.6 t80 -71.93 -55.71 6.99 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 123.981 0.912 . . . . 0.0 111.21 175.492 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 55.8 mt -58.5 -35.82 56.31 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.589 0 C-N-CA 125.387 1.475 . . . . 0.0 111.168 174.436 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -68.02 -20.78 65.03 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 124.104 0.962 . . . . 0.0 113.326 177.078 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -96.33 -28.15 14.62 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.812 1.245 . . . . 0.0 113.231 178.437 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 9.2 m -126.36 -21.61 2.16 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 N-CA-C 114.376 1.25 . . . . 0.0 114.376 -174.038 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 88.84 141.69 8.17 Favored Glycine 0 CA--C 1.534 1.242 0 C-N-CA 125.633 1.587 . . . . 0.0 112.788 -172.205 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 62.5 tp -60.74 -16.58 41.45 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 125.497 1.519 . . . . 0.0 114.561 -175.395 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -82.83 -18.68 39.56 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.763 1.625 . . . . 0.0 113.079 177.095 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 63.6 m-20 -114.58 -7.69 12.77 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 114.651 1.352 . . . . 0.0 114.651 -170.066 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.476 HG22 ' CE2' ' A' ' 46' ' ' TYR . 26.6 pt -67.32 158.52 5.41 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.42 0 C-N-CA 123.675 0.79 . . . . 0.0 111.265 167.099 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -126.01 146.22 49.98 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 125.086 1.354 . . . . 0.0 111.444 174.916 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -61.68 -27.46 68.7 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.025 0.93 . . . . 0.0 111.975 172.927 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 29.9 mm -63.85 -52.58 55.09 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.444 0 C-N-CA 124.797 1.239 . . . . 0.0 110.567 174.556 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 54.1 m -75.18 -39.33 60.32 Favored 'General case' 0 C--O 1.223 -0.334 0 C-N-CA 123.264 0.625 . . . . 0.0 110.088 -177.749 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 18.1 tp -63.18 -37.04 85.66 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.437 1.095 . . . . 0.0 111.854 175.402 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.444 ' HA ' HG13 ' A' ' 66' ' ' ILE . 44.1 t -53.87 -32.57 53.64 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.951 1.3 . . . . 0.0 112.25 169.411 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -96.98 -31.89 12.3 Favored 'General case' 0 CA--C 1.534 0.351 0 N-CA-C 113.881 1.067 . . . . 0.0 113.881 -176.015 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 47.6 mmtt -60.17 -39.54 86.79 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 125.703 1.601 . . . . 0.0 111.839 178.407 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.3 mp -114.07 15.7 18.3 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 124.753 1.221 . . . . 0.0 113.631 -177.374 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . 0.278 7.5 p30 46.56 55.5 7.52 Favored 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 126.536 1.934 . . . . 0.0 114.037 -177.706 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.444 HG13 ' HA ' ' A' ' 61' ' ' SER . 1.8 pt -119.4 -165.5 0.37 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.761 0 C-N-CA 127.156 2.182 . . . . 0.0 110.958 -174.249 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 5.7 p -98.64 160.38 14.31 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 124.661 1.184 . . . . 0.0 110.901 171.583 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 71.4 t -62.72 -29.66 47.53 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 C-N-CA 123.085 0.554 . . . . 0.0 110.952 173.68 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 58.4 mp0 -77.28 -39.91 46.41 Favored 'General case' 0 CA--C 1.53 0.195 0 O-C-N 121.017 -1.052 . . . . 0.0 109.928 -178.685 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 10.8 tmtt? -66.92 -44.38 80.83 Favored 'General case' 0 C--N 1.341 0.236 0 C-N-CA 124.952 1.301 . . . . 0.0 110.941 178.866 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -58.98 -50.24 74.84 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 126.064 1.746 . . . . 0.0 113.357 170.204 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 21.2 ttmm -69.01 -25.33 64.44 Favored 'General case' 0 N--CA 1.468 0.46 0 O-C-N 120.839 -1.163 . . . . 0.0 111.327 -177.333 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -59.04 -31.7 69.08 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 123.529 0.731 . . . . 0.0 112.608 174.065 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 58.6 m-85 -69.78 -50.21 45.42 Favored 'General case' 0 C--O 1.221 -0.438 0 C-N-CA 124.527 1.131 . . . . 0.0 110.538 170.199 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 84.5 mt -64.15 -25.24 37.61 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.839 0 C-N-CA 124.201 1.0 . . . . 0.0 111.73 -175.589 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 69.0 mmtt -81.54 -25.36 35.94 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 125.461 1.504 . . . . 0.0 114.408 177.741 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 8.6 p30 -97.63 -47.51 5.6 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 119.994 1.27 . . . . 0.0 111.958 170.136 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 65.6 m -93.66 99.65 12.03 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 124.178 0.991 . . . . 0.0 109.339 -178.763 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 4.9 t-20 -143.4 -61.83 0.41 Allowed 'General case' 0 CA--C 1.537 0.477 0 N-CA-C 113.19 0.811 . . . . 0.0 113.19 -172.799 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 37.3 mmt-85 -95.03 -16.07 22.99 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 125.026 1.33 . . . . 0.0 113.246 176.7 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 7.1 tt -82.69 -35.61 26.62 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 124.883 1.273 . . . . 0.0 112.828 -173.095 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 79.1 -174.2 55.3 Favored Glycine 0 CA--C 1.537 1.412 0 CA-C-N 118.373 0.533 . . . . 0.0 112.751 -168.496 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 11.1 mmm-85 -137.32 126.87 25.15 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 125.136 1.374 . . . . 0.0 109.965 175.71 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . 0.301 7.1 t 45.62 39.25 4.75 Favored 'General case' 0 N--CA 1.485 1.291 0 C-N-CA 126.619 1.968 . . . . 0.0 115.025 175.906 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 20.6 m-80 -139.67 152.25 46.57 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.874 1.669 . . . . 0.0 111.818 -177.954 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 3.2 t30 -139.67 102.4 4.43 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.166 1.387 . . . . 0.0 110.269 172.57 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 9.6 tp -144.2 18.46 1.74 Allowed 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 124.762 1.225 . . . . 0.0 112.898 179.766 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 16.6 ptpt -107.55 -12.54 15.26 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 126.399 1.88 . . . . 0.0 113.39 -176.242 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 15.0 t -152.91 120.84 6.12 Favored 'General case' 0 C--O 1.235 0.325 0 C-N-CA 126.072 1.749 . . . . 0.0 109.257 -176.61 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -140.33 9.04 0.54 Allowed 'Isoleucine or valine' 0 CA--C 1.548 0.888 0 C-N-CA 125.318 1.447 . . . . 0.0 112.774 -177.875 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 75.82 -13.85 6.52 Favored Glycine 0 CA--C 1.535 1.298 0 C-N-CA 124.967 1.27 . . . . 0.0 114.838 -167.423 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 4.9 mp 53.48 95.48 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.595 0 C-N-CA 127.376 2.271 . . . . 0.0 109.855 -161.858 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 24.4 tp -70.17 67.46 0.3 Allowed 'General case' 0 CA--C 1.551 1.001 0 C-N-CA 126.239 1.816 . . . . 0.0 113.531 -170.354 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 36.2 mt-30 -139.62 48.62 1.82 Allowed 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 126.107 1.763 . . . . 0.0 112.029 -176.647 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -119.96 72.9 0.95 Allowed 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 125.056 1.342 . . . . 0.0 111.852 -176.459 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -145.91 115.96 7.39 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.463 1.105 . . . . 0.0 110.888 179.449 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 59.9 t -141.12 132.02 27.47 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 C-N-CA 125.199 1.4 . . . . 0.0 110.55 179.027 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 55.1 m -96.77 -50.39 4.69 Favored 'General case' 0 N--CA 1.48 1.06 0 N-CA-C 113.463 0.912 . . . . 0.0 113.463 179.732 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 35.8 t -159.73 -50.38 0.05 Allowed 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 124.708 1.203 . . . . 0.0 112.332 179.982 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 6.0 tpt -121.09 15.74 11.55 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 125.165 1.386 . . . . 0.0 113.068 -174.3 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -83.31 48.75 1.44 Allowed 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 124.867 1.267 . . . . 0.0 112.4 -174.254 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -142.41 155.02 45.08 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.737 1.615 . . . . 0.0 112.268 -175.813 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 4.7 mmpt? -83.48 133.6 34.89 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 124.542 1.137 . . . . 0.0 111.934 178.911 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 77.7 p -152.26 152.59 32.36 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 126.282 1.833 . . . . 0.0 110.287 169.338 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 11.0 ttt -155.72 -62.94 0.11 Allowed 'General case' 0 N--CA 1.474 0.77 0 CA-C-O 121.491 0.662 . . . . 0.0 112.456 -178.569 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 12.4 t -165.35 -177.62 4.59 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 127.787 2.435 . . . . 0.0 109.195 -174.205 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 7.0 t-105 . . . . . 0 C--O 1.252 1.225 0 C-N-CA 125.823 1.649 . . . . 0.0 112.634 -173.81 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.565 0 N-CA-C 111.153 -0.779 . . . . 0.0 111.153 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 2.2 t -139.45 26.4 2.36 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 124.821 1.248 . . . . 0.0 112.528 -179.046 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 71.3 m80 -138.16 144.3 40.68 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 125.441 1.496 . . . . 0.0 111.947 -170.798 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 58.8 ttp -149.7 136.68 19.58 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 125.1 1.36 . . . . 0.0 110.766 172.6 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -146.68 169.4 19.1 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 124.865 1.266 . . . . 0.0 112.06 179.903 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 23.3 t -136.79 143.7 43.33 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 125.123 1.369 . . . . 0.0 111.152 176.008 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.7 mpt? -132.68 108.69 9.2 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 125.217 1.407 . . . . 0.0 110.068 -175.439 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 44.1 m-20 43.9 63.27 8.42 Favored Pre-proline 0 CA--C 1.555 1.162 0 C-N-CA 126.5 1.92 . . . . 0.0 114.778 176.798 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_endo -72.6 -1.78 10.82 Favored 'Trans proline' 0 C--N 1.351 0.664 0 C-N-CA 123.762 2.975 . . . . 0.0 115.266 -175.714 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 88.7 mt -106.82 38.94 1.96 Allowed 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.902 1.681 . . . . 0.0 112.671 -178.983 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -110.53 1.48 18.19 Favored 'General case' 0 N--CA 1.478 0.959 0 N-CA-C 114.574 1.324 . . . . 0.0 114.574 178.589 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.23 -56.74 1.89 Allowed 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 124.632 1.173 . . . . 0.0 113.269 -165.851 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.0 pp -129.13 13.86 2.66 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.862 0 C-N-CA 126.163 1.785 . . . . 0.0 112.9 -173.523 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 10.7 tt -41.77 126.44 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.02 0 C-N-CA 125.423 1.489 . . . . 0.0 113.402 179.322 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -145.0 16.84 1.57 Allowed 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.816 1.247 . . . . 0.0 112.942 179.981 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -82.95 11.21 6.42 Favored 'General case' 0 CA--C 1.545 0.771 0 N-CA-C 114.534 1.309 . . . . 0.0 114.534 -171.737 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 14.0 tt -141.46 24.38 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 126.473 1.909 . . . . 0.0 113.145 -176.503 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 88.9 tttt -132.1 -44.12 0.95 Allowed 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.285 1.034 . . . . 0.0 113.567 179.043 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 9.1 mtmp? 48.37 -151.29 0.13 Allowed 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 126.039 1.735 . . . . 0.0 112.495 -173.499 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -132.68 166.01 23.17 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 126.296 1.838 . . . . 0.0 111.19 172.66 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -134.53 167.83 20.07 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 125.247 1.419 . . . . 0.0 112.955 -177.956 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 20.2 t30 -143.98 146.88 33.21 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 125.699 1.6 . . . . 0.0 111.636 -178.401 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -145.9 144.34 30.13 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.24 1.416 . . . . 0.0 111.052 174.467 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 25.6 m -112.74 9.18 19.12 Favored 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 115.057 1.503 . . . . 0.0 115.057 -173.287 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 166.8 87.94 0.07 OUTLIER Glycine 0 CA--C 1.531 1.083 0 O-C-N 121.348 -0.845 . . . . 0.0 112.878 173.717 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 7.3 p -82.5 119.15 31.49 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.757 0 C-N-CA 124.064 0.946 . . . . 0.0 111.88 -179.76 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -157.09 171.24 20.81 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 124.307 1.043 . . . . 0.0 112.527 172.722 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 16.9 mt -82.03 31.73 0.38 Allowed 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 127.293 2.237 . . . . 0.0 113.492 -170.229 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -151.53 108.63 2.94 Favored Pre-proline 0 CA--C 1.548 0.888 0 C-N-CA 124.624 1.17 . . . . 0.0 112.145 -161.979 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -83.99 -30.04 0.82 Allowed 'Trans proline' 0 CA--C 1.541 0.865 0 C-N-CA 122.71 2.273 . . . . 0.0 114.03 -176.631 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 22.9 tp -151.9 66.63 0.86 Allowed 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 124.884 1.274 . . . . 0.0 111.35 -174.824 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 49.2 m 56.08 34.93 24.72 Favored 'General case' 0 N--CA 1.478 0.94 0 N-CA-C 114.639 1.348 . . . . 0.0 114.639 176.006 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 9.3 p -155.04 141.98 13.53 Favored Pre-proline 0 N--CA 1.472 0.665 0 C-N-CA 126.278 1.831 . . . . 0.0 109.424 -173.821 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 95.3 Cg_endo -77.58 65.54 8.08 Favored 'Trans proline' 0 CA--C 1.548 1.197 0 C-N-CA 123.568 2.846 . . . . 0.0 112.384 -177.843 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 38.5 tptt 61.27 113.57 0.02 OUTLIER Pre-proline 0 CA--C 1.555 1.136 0 C-N-CA 129.616 3.167 . . . . 0.0 113.523 -172.652 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -77.85 159.24 31.22 Favored 'Trans proline' 0 C--N 1.352 0.717 0 C-N-CA 123.485 2.79 . . . . 0.0 112.542 -174.726 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 5.7 mptt -73.74 141.24 46.34 Favored 'General case' 0 N--CA 1.478 0.932 0 O-C-N 121.63 -0.669 . . . . 0.0 111.991 178.7 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 54.1 tp -148.29 141.24 24.81 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 125.779 1.632 . . . . 0.0 110.709 -175.464 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -137.14 118.41 14.59 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 125.482 1.513 . . . . 0.0 108.854 165.488 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -144.02 74.39 1.42 Allowed 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 124.587 1.155 . . . . 0.0 109.89 -176.157 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.5 mt -134.74 153.94 51.79 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 126.677 1.991 . . . . 0.0 110.497 -171.393 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 19.0 t -72.1 168.33 18.37 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.088 0.555 . . . . 0.0 110.406 167.298 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -58.65 -45.62 88.92 Favored 'General case' 0 N--CA 1.473 0.695 0 O-C-N 120.25 -1.531 . . . . 0.0 112.607 -174.577 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 9.9 tt0 -71.78 -41.87 67.82 Favored 'General case' 0 N--CA 1.47 0.558 0 O-C-N 121.195 -0.941 . . . . 0.0 111.367 177.344 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 30.6 mm-40 -57.04 -45.32 83.27 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 123.959 0.903 . . . . 0.0 110.72 175.873 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt -60.75 -41.56 95.65 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 124.726 1.21 . . . . 0.0 111.3 178.277 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 51.5 mt -67.54 -41.85 86.26 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 CA-C-O 117.937 -1.03 . . . . 0.0 111.447 177.177 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 36.5 mt -63.8 -44.42 98.21 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 CA-C-N 120.832 1.651 . . . . 0.0 110.072 177.969 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -59.42 -49.21 78.69 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.711 1.204 . . . . 0.0 111.024 177.745 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -64.36 -52.18 59.64 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 124.982 1.313 . . . . 0.0 112.456 177.674 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -60.75 -27.44 67.95 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-N 119.362 0.983 . . . . 0.0 113.027 -179.572 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -69.05 -58.34 4.23 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 123.433 0.693 . . . . 0.0 110.784 174.962 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 90.8 mt -63.71 -32.68 57.85 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.471 0 C-N-CA 127.016 2.126 . . . . 0.0 111.641 179.572 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -71.48 -25.54 62.31 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.111 0.965 . . . . 0.0 112.713 175.93 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -90.64 -37.75 13.56 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.188 0.995 . . . . 0.0 112.622 176.233 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.5 m -109.98 -3.41 10.5 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.215 0 N-CA-C 114.371 1.249 . . . . 0.0 114.371 -175.039 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 88.03 10.14 69.6 Favored Glycine 0 N--CA 1.472 1.081 0 C-N-CA 126.096 1.808 . . . . 0.0 116.133 160.974 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 64.36 4.06 2.05 Favored 'General case' 0 CA--C 1.554 1.116 0 C-N-CA 127.756 2.422 . . . . 0.0 114.677 -164.53 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -85.98 -26.12 25.64 Favored 'General case' 0 N--CA 1.48 1.028 0 O-C-N 120.626 -1.296 . . . . 0.0 113.304 179.631 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 45.6 m-80 -122.63 2.95 9.58 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 113.976 1.102 . . . . 0.0 113.976 -164.85 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 20.5 pt -75.05 155.65 6.26 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.551 0 C-N-CA 123.024 0.53 . . . . 0.0 111.352 174.685 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -139.03 142.18 38.26 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 124.765 1.226 . . . . 0.0 109.304 177.486 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -61.11 -26.51 67.72 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 119.088 0.858 . . . . 0.0 112.439 -179.166 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.9 mp -64.76 -50.88 73.33 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.472 0 C-N-CA 125.555 1.542 . . . . 0.0 109.831 173.778 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 81.1 m -76.3 -41.02 50.0 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 123.849 0.86 . . . . 0.0 110.764 -176.566 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 16.3 tp -61.85 -38.46 88.29 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 125.619 1.568 . . . . 0.0 111.766 174.189 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.466 ' HA ' HG13 ' A' ' 66' ' ' ILE . 39.8 t -56.95 -28.72 62.47 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 124.921 1.288 . . . . 0.0 112.794 170.298 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -100.56 -29.07 12.55 Favored 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 124.789 1.236 . . . . 0.0 114.25 -176.196 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 9.1 mmtm -63.28 -33.61 75.89 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 125.197 1.399 . . . . 0.0 111.715 175.102 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.4 mp -114.43 4.12 15.2 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 125.472 1.509 . . . . 0.0 114.039 -176.584 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 49.2 m-80 53.51 56.66 7.02 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 126.01 1.724 . . . . 0.0 113.366 -179.232 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.466 HG13 ' HA ' ' A' ' 61' ' ' SER . 1.2 pt -125.2 -166.67 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.764 0 C-N-CA 126.885 2.074 . . . . 0.0 110.974 -171.829 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 62.2 p -94.15 155.66 16.96 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 124.514 1.126 . . . . 0.0 111.251 169.915 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 60.6 t -63.93 -24.77 36.58 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 O-C-N 121.628 -0.67 . . . . 0.0 111.086 171.865 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 15.6 mp0 -79.72 -30.33 40.93 Favored 'General case' 0 C--O 1.233 0.209 0 C-N-CA 125.148 1.379 . . . . 0.0 111.124 -174.695 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.16 -32.81 16.48 Favored 'General case' 0 C--N 1.344 0.368 0 CA-C-N 118.156 0.435 . . . . 0.0 111.738 173.978 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -62.14 -46.77 87.5 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 124.239 1.015 . . . . 0.0 111.9 173.149 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 19.9 ptmt -69.0 -24.77 64.26 Favored 'General case' 0 N--CA 1.468 0.449 0 O-C-N 121.296 -0.877 . . . . 0.0 112.121 -176.766 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -60.93 -39.76 90.67 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 120.342 -0.543 . . . . 0.0 110.445 179.247 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 26.4 m-85 -61.48 -38.88 88.88 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 124.609 1.164 . . . . 0.0 112.301 179.752 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 7.3 mt -73.4 -18.11 17.83 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.847 0 C-N-CA 125.852 1.661 . . . . 0.0 111.941 -178.951 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 61.8 tttt -103.52 -33.93 8.86 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 125.678 1.591 . . . . 0.0 110.776 -177.599 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 81.6 m-20 -75.41 -42.98 52.33 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 126.72 2.008 . . . . 0.0 109.838 175.799 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 12.4 t -122.15 129.08 51.99 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 112.789 0.662 . . . . 0.0 112.789 171.476 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 13.0 p30 -149.81 -58.43 0.2 Allowed 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 114.303 1.223 . . . . 0.0 114.303 179.111 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 1.1 mpp_? -85.12 -17.91 35.84 Favored 'General case' 0 N--CA 1.481 1.076 0 N-CA-C 113.615 0.968 . . . . 0.0 113.615 177.731 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 60.0 tp -75.93 -44.43 40.23 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 124.523 1.129 . . . . 0.0 112.738 178.111 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -83.95 113.33 3.71 Favored Glycine 0 CA--C 1.531 1.044 0 N-CA-C 111.124 -0.79 . . . . 0.0 111.124 177.991 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 21.8 mmm-85 -140.47 175.18 9.81 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 125.07 1.348 . . . . 0.0 112.486 -172.492 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 12.6 t -121.34 -5.39 9.37 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 126.427 1.891 . . . . 0.0 114.411 -171.66 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 79.3 m-20 -87.5 159.26 18.71 Favored 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 114.364 1.246 . . . . 0.0 114.364 -167.297 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 42.1 t-20 -132.34 -179.69 5.59 Favored 'General case' 0 CA--C 1.551 1.0 0 C-N-CA 126.853 2.061 . . . . 0.0 110.54 178.441 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 72.8 mt 58.47 32.41 22.08 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 125.995 1.718 . . . . 0.0 113.543 -177.845 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 17.5 ptmt -120.53 5.55 10.61 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 126.424 1.89 . . . . 0.0 114.003 -179.109 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 12.4 t -146.02 120.03 9.4 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 124.722 1.209 . . . . 0.0 110.036 171.868 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -141.5 4.63 0.46 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.784 0 C-N-CA 125.778 1.631 . . . . 0.0 113.19 -177.521 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 69.23 6.69 54.81 Favored Glycine 0 CA--C 1.539 1.566 0 O-C-N 120.693 -1.254 . . . . 0.0 114.762 -169.728 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . 0.281 4.1 mp 54.61 29.16 0.14 Allowed 'Isoleucine or valine' 0 CA--C 1.552 1.046 0 C-N-CA 126.883 2.073 . . . . 0.0 112.033 177.323 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 11.2 tp 54.72 24.0 5.24 Favored 'General case' 0 CA--C 1.553 1.071 0 C-N-CA 126.088 1.755 . . . . 0.0 114.391 -174.691 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 42.0 mt-30 -107.2 53.02 0.7 Allowed 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 126.41 1.884 . . . . 0.0 111.786 -176.605 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -79.69 147.17 32.06 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 124.604 1.162 . . . . 0.0 111.872 173.644 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -145.87 139.86 26.61 Favored 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 125.323 1.449 . . . . 0.0 111.355 175.068 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 95.9 t -138.15 135.13 44.85 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 C-N-CA 126.133 1.773 . . . . 0.0 110.306 179.453 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 19.2 t -154.73 -42.96 0.09 Allowed 'General case' 0 N--CA 1.47 0.529 0 N-CA-C 113.841 1.052 . . . . 0.0 113.841 177.513 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 23.1 p -151.3 117.29 5.54 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-O 122.181 0.991 . . . . 0.0 113.418 -176.187 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 57.9 mtt 54.74 40.97 32.22 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 126.061 1.745 . . . . 0.0 112.983 173.713 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -84.0 3.42 34.45 Favored 'General case' 0 CA--C 1.547 0.828 0 N-CA-C 115.298 1.592 . . . . 0.0 115.298 -163.162 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -133.47 155.37 49.66 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 125.587 1.555 . . . . 0.0 113.167 -174.562 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 33.5 mmtp -127.56 23.36 6.31 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 126.451 1.9 . . . . 0.0 113.515 -176.898 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 21.4 t -125.71 134.96 51.62 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 124.876 1.27 . . . . 0.0 112.282 -177.403 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 87.4 mtp -145.57 169.39 18.5 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 126.872 2.069 . . . . 0.0 111.115 177.448 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 12.1 t -134.05 162.17 32.82 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 125.162 1.385 . . . . 0.0 112.512 177.871 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 13.5 m-90 . . . . . 0 C--O 1.253 1.242 0 C-N-CA 126.808 2.043 . . . . 0.0 112.021 -177.0 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.578 0 N-CA-C 111.163 -0.775 . . . . 0.0 111.163 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 78.9 p -140.86 158.05 44.5 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 125.311 1.444 . . . . 0.0 112.384 179.355 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 34.4 t-80 -150.4 157.25 42.83 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 125.259 1.424 . . . . 0.0 111.027 -179.461 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 63.1 ttp -145.15 134.77 23.34 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 124.821 1.248 . . . . 0.0 111.413 179.585 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . 51.61 -156.93 0.13 Allowed 'General case' 0 CA--C 1.552 1.049 0 C-N-CA 125.907 1.683 . . . . 0.0 113.567 -177.03 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 5.3 t -152.27 151.05 30.44 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 124.398 1.079 . . . . 0.0 111.545 173.491 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 58.5 ttm -152.24 128.88 10.78 Favored 'General case' 0 CA--C 1.537 0.481 0 C-N-CA 124.668 1.187 . . . . 0.0 110.66 174.089 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 25.4 m-20 -127.16 97.62 31.57 Favored Pre-proline 0 CA--C 1.547 0.839 0 C-N-CA 124.922 1.289 . . . . 0.0 111.008 176.217 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 64.8 Cg_endo -83.03 6.87 5.54 Favored 'Trans proline' 0 CA--C 1.539 0.756 0 C-N-CA 123.79 2.993 . . . . 0.0 114.219 179.325 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 92.2 mt -115.55 29.72 7.82 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 125.368 1.467 . . . . 0.0 113.716 -172.734 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -98.02 -1.1 43.36 Favored 'General case' 0 N--CA 1.479 1.024 0 N-CA-C 114.087 1.144 . . . . 0.0 114.087 170.897 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 13.7 ptmt -103.86 -35.38 8.19 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 125.78 1.632 . . . . 0.0 114.78 -171.004 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.3 pp -144.44 -42.12 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.008 0 C-N-CA 125.845 1.658 . . . . 0.0 113.643 -174.324 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . 0.31 10.6 tt 38.27 35.29 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.437 0 N-CA-C 116.283 1.957 . . . . 0.0 116.283 -177.52 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 3.2 t30 55.91 29.07 13.52 Favored 'General case' 0 CA--C 1.552 1.023 0 C-N-CA 125.688 1.595 . . . . 0.0 114.279 -177.744 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 3.2 p-10 -81.2 9.61 6.65 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 116.781 2.141 . . . . 0.0 116.781 -166.11 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 7.1 tp -141.76 18.86 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.835 0 C-N-CA 125.779 1.632 . . . . 0.0 113.733 -175.704 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 13.9 tmtt? -129.34 -30.85 2.11 Favored 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 115.15 1.537 . . . . 0.0 115.15 -175.753 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 22.8 ttmm -133.81 102.73 5.56 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 126.01 1.724 . . . . 0.0 111.017 175.825 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 22.9 tt0 -148.07 25.8 1.01 Allowed 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 124.634 1.173 . . . . 0.0 112.885 179.273 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -88.19 93.71 9.59 Favored 'General case' 0 C--O 1.237 0.41 0 O-C-N 120.161 -1.587 . . . . 0.0 111.903 -177.372 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 53.0 t30 -154.37 130.0 9.96 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 123.356 0.662 . . . . 0.0 111.203 178.357 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 8.8 t0 -137.48 131.75 32.31 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.075 1.35 . . . . 0.0 111.326 177.463 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 40.5 m -121.46 27.83 8.07 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 125.535 1.534 . . . . 0.0 113.165 -179.177 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 88.11 57.86 1.85 Allowed Glycine 0 CA--C 1.528 0.872 0 C-N-CA 124.866 1.222 . . . . 0.0 113.028 178.094 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 14.5 p -116.33 8.89 7.3 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.955 0 C-N-CA 126.429 1.892 . . . . 0.0 112.996 -175.79 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -86.55 167.62 14.43 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 125.782 1.633 . . . . 0.0 113.969 -175.269 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 9.8 mt -87.19 39.51 0.87 Allowed 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 127.53 2.332 . . . . 0.0 111.962 -174.024 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -151.48 155.12 34.19 Favored Pre-proline 0 CA--C 1.549 0.923 0 C-N-CA 124.514 1.126 . . . . 0.0 112.882 -159.881 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -73.83 -26.89 12.93 Favored 'Trans proline' 0 CA--C 1.542 0.904 0 C-N-CA 122.991 2.461 . . . . 0.0 113.588 -178.304 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.483 ' HG ' ' H ' ' A' ' 26' ' ' SER . 6.0 tp -149.8 -163.21 1.72 Allowed 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 125.76 1.624 . . . . 0.0 109.818 174.479 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.483 ' H ' ' HG ' ' A' ' 25' ' ' LEU . 36.2 p -73.8 43.16 0.15 Allowed 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 127.933 2.493 . . . . 0.0 113.896 177.096 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 10.6 p -150.81 142.2 15.27 Favored Pre-proline 0 N--CA 1.47 0.557 0 C-N-CA 126.166 1.786 . . . . 0.0 110.605 -168.612 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_endo -76.82 73.81 5.18 Favored 'Trans proline' 0 CA--C 1.54 0.79 0 C-N-CA 122.796 2.33 . . . . 0.0 111.504 174.386 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 35.83 87.86 0.1 Allowed Pre-proline 0 CA--C 1.549 0.935 0 C-N-CA 128.617 2.767 . . . . 0.0 115.642 171.039 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 64.4 Cg_endo -61.23 156.99 42.28 Favored 'Trans proline' 0 CA--C 1.538 0.682 0 C-N-CA 121.958 1.772 . . . . 0.0 111.717 173.3 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 62.1 mttp -62.56 120.25 10.78 Favored 'General case' 0 N--CA 1.475 0.794 0 O-C-N 121.851 -0.531 . . . . 0.0 111.877 -173.681 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.5 pp -145.71 139.42 26.52 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 126.041 1.736 . . . . 0.0 111.886 -174.149 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 37.3 mm-40 -146.0 64.13 1.23 Allowed 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 125.759 1.624 . . . . 0.0 110.953 -177.317 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -96.22 93.97 7.22 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.322 1.049 . . . . 0.0 111.824 -176.012 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 34.5 mt -132.14 156.8 45.73 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 126.454 1.902 . . . . 0.0 111.147 -178.806 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 29.7 t -69.68 163.28 25.97 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 123.138 0.575 . . . . 0.0 110.735 168.459 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 7.1 tm-20 -53.86 -42.78 68.92 Favored 'General case' 0 N--CA 1.474 0.741 0 O-C-N 120.874 -1.141 . . . . 0.0 112.82 -179.268 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 7.9 pt20 -78.23 -34.62 49.11 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 112.359 0.503 . . . . 0.0 112.359 175.958 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 91.0 mt-30 -68.12 -37.17 80.83 Favored 'General case' 0 CA--C 1.535 0.37 0 O-C-N 121.501 -0.75 . . . . 0.0 111.578 179.517 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 40.1 ttmt -59.3 -39.52 83.28 Favored 'General case' 0 N--CA 1.47 0.568 0 O-C-N 121.272 -0.893 . . . . 0.0 111.209 172.961 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 45.2 mt -72.77 -40.64 61.33 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 CA-C-O 118.262 -0.875 . . . . 0.0 111.296 176.841 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 39.2 mt -64.4 -42.06 94.18 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 CA-C-N 120.644 1.565 . . . . 0.0 110.526 177.8 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -56.38 -52.74 63.5 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 124.336 1.054 . . . . 0.0 109.952 173.903 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -64.64 -50.68 66.13 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 123.687 0.795 . . . . 0.0 113.003 -178.816 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 18.7 mm-40 -62.35 -22.07 65.81 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 113.525 0.935 . . . . 0.0 113.525 -178.423 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.415 ' CE1' HG22 ' A' ' 55' ' ' ILE . 1.7 t80 -71.55 -60.68 2.1 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 119.038 0.836 . . . . 0.0 110.742 173.376 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 16.2 mt -63.42 -32.45 56.63 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.496 0 C-N-CA 125.939 1.695 . . . . 0.0 111.688 179.847 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -70.26 -21.56 62.96 Favored 'General case' 0 CA--C 1.545 0.754 0 O-C-N 121.255 -0.903 . . . . 0.0 113.066 175.655 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -94.19 -34.77 12.78 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.358 1.063 . . . . 0.0 112.654 177.751 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 11.7 m -116.7 -18.77 6.79 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.066 0 N-CA-C 114.121 1.156 . . . . 0.0 114.121 -174.411 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 80.62 141.05 2.74 Favored Glycine 0 CA--C 1.53 1.001 0 C-N-CA 124.58 1.086 . . . . 0.0 111.649 -171.501 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.0 tt -64.05 -19.02 64.92 Favored 'General case' 0 N--CA 1.473 0.725 0 O-C-N 121.154 -1.203 . . . . 0.0 114.015 -169.029 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 36.8 mt-30 -66.18 -17.1 64.52 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 126.1 1.76 . . . . 0.0 113.324 174.9 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 69.3 m-80 -112.86 -5.93 13.83 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 114.703 1.372 . . . . 0.0 114.703 -174.145 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.415 HG22 ' CE1' ' A' ' 46' ' ' TYR . 3.7 pt -79.72 162.8 3.72 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 C-N-CA 123.55 0.74 . . . . 0.0 112.48 173.117 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -130.83 147.06 52.44 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 124.931 1.292 . . . . 0.0 109.974 171.895 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -63.76 -25.04 68.01 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 121.429 -0.794 . . . . 0.0 112.029 174.387 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -66.42 -46.98 85.36 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.481 0 C-N-CA 125.455 1.502 . . . . 0.0 109.667 173.423 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 89.7 m -74.22 -43.53 56.75 Favored 'General case' 0 C--O 1.224 -0.27 0 C-N-CA 123.344 0.658 . . . . 0.0 110.151 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 18.7 tp -61.96 -36.04 80.24 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 124.491 1.117 . . . . 0.0 111.864 176.046 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.49 ' HA ' HG13 ' A' ' 66' ' ' ILE . 44.9 t -53.01 -33.25 50.84 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.621 1.168 . . . . 0.0 113.146 168.292 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -100.47 -22.65 14.95 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 125.087 1.355 . . . . 0.0 114.518 -175.584 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 63.9 mmtt -65.19 -38.25 89.91 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 124.709 1.204 . . . . 0.0 111.153 173.967 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.4 mp -111.62 -0.16 16.19 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 125.073 1.349 . . . . 0.0 114.335 -173.028 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 16.0 m-80 56.89 45.41 21.47 Favored 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 125.743 1.617 . . . . 0.0 112.615 -172.875 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.49 HG13 ' HA ' ' A' ' 61' ' ' SER . 10.5 pt -104.46 -166.83 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 C-N-CA 125.821 1.648 . . . . 0.0 111.227 -179.47 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 44.5 p -94.74 161.19 14.28 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 123.998 0.919 . . . . 0.0 110.889 166.767 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 82.5 t -61.85 -28.28 43.95 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 O-C-N 121.341 -0.849 . . . . 0.0 111.054 170.995 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -77.31 -40.21 45.11 Favored 'General case' 0 C--O 1.233 0.214 0 O-C-N 120.68 -1.262 . . . . 0.0 110.453 -175.913 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . 0.366 0.0 OUTLIER -91.59 8.37 37.0 Favored 'General case' 0 C--N 1.348 0.508 0 N-CA-C 113.722 1.008 . . . . 0.0 113.722 175.917 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -95.52 -44.37 7.55 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.467 1.507 . . . . 0.0 111.635 159.799 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 23.9 ttmm -74.15 -29.62 61.88 Favored 'General case' 0 CA--C 1.517 -0.29 0 C-N-CA 124.896 1.278 . . . . 0.0 111.465 -174.475 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 51.9 p-10 -55.53 -42.67 74.88 Favored 'General case' 0 CA--C 1.544 0.735 0 CA-C-O 118.631 -0.7 . . . . 0.0 111.905 176.649 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 20.9 m-85 -59.08 -44.01 91.86 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 125.718 1.607 . . . . 0.0 112.376 175.811 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 69.2 mt -68.44 -25.11 30.42 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.795 0 C-N-CA 124.984 1.314 . . . . 0.0 110.041 179.647 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 73.4 mmtt -93.56 -25.32 17.61 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 115.888 1.81 . . . . 0.0 115.888 -179.846 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 8.4 p30 -103.14 -38.69 7.18 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 120.682 1.583 . . . . 0.0 113.103 175.949 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 22.4 t -104.6 -62.08 1.38 Allowed 'General case' 0 CA--C 1.519 -0.247 0 CA-C-O 119.361 -0.352 . . . . 0.0 111.585 -167.426 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . 0.274 8.6 p30 43.72 31.31 0.45 Allowed 'General case' 0 CA--C 1.551 1.003 0 N-CA-C 116.318 1.97 . . . . 0.0 116.318 -178.18 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 53.68 14.63 0.64 Allowed 'General case' 0 N--CA 1.49 1.562 0 C-N-CA 125.171 1.389 . . . . 0.0 112.874 -170.905 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . 0.279 0.5 OUTLIER 44.22 33.83 0.9 Allowed 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 129.638 3.175 . . . . 0.0 113.601 -166.096 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -73.89 114.61 4.64 Favored Glycine 0 CA--C 1.535 1.282 0 O-C-N 120.799 -1.188 . . . . 0.0 111.759 176.943 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 94.3 mtt-85 -135.21 162.56 32.18 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 125.736 1.614 . . . . 0.0 112.419 -175.013 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 7.6 t -80.72 -17.17 51.91 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 125.334 1.454 . . . . 0.0 114.824 -174.165 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 68.5 m-80 -73.3 129.06 37.21 Favored 'General case' 0 CA--C 1.543 0.691 0 O-C-N 121.032 -1.042 . . . . 0.0 113.139 -172.369 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 8.9 t30 -151.26 120.53 6.8 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.125 1.77 . . . . 0.0 109.509 174.022 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 7.0 tp -156.26 172.3 18.7 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.462 1.505 . . . . 0.0 110.421 -178.049 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 19.1 ptpt -121.6 14.16 10.97 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 126.377 1.871 . . . . 0.0 113.338 -173.6 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 13.3 t -153.12 130.41 11.27 Favored 'General case' 0 C--O 1.233 0.191 0 C-N-CA 125.531 1.532 . . . . 0.0 109.769 173.744 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -146.94 11.57 0.15 Allowed 'Isoleucine or valine' 0 CA--C 1.549 0.92 0 C-N-CA 125.481 1.513 . . . . 0.0 113.683 -171.98 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 80.74 -6.75 60.81 Favored Glycine 0 N--CA 1.476 1.329 0 O-C-N 120.584 -1.322 . . . . 0.0 114.854 -170.221 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 4.8 mp 55.88 85.75 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 C-N-CA 126.756 2.023 . . . . 0.0 109.751 -168.759 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 88.7 mt -63.6 92.38 0.07 Allowed 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 126.186 1.794 . . . . 0.0 112.196 -168.151 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 8.4 pt20 -108.11 2.67 23.15 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 125.496 1.519 . . . . 0.0 114.558 -174.121 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 26.1 tt0 -86.49 144.9 27.03 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 124.724 1.21 . . . . 0.0 113.027 -171.645 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -106.54 98.06 7.78 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 125.071 1.349 . . . . 0.0 111.751 -174.275 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 8.7 m -135.0 31.81 0.79 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.649 0 C-N-CA 125.939 1.696 . . . . 0.0 113.365 -170.995 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 72.2 m -131.4 -62.19 0.89 Allowed 'General case' 0 N--CA 1.475 0.824 0 N-CA-C 113.524 0.935 . . . . 0.0 113.524 -163.07 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 55.7 p -78.87 -23.74 44.7 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 124.043 0.937 . . . . 0.0 112.963 175.27 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 77.1 mtm -134.69 140.49 46.02 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 126.817 2.047 . . . . 0.0 109.162 169.28 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 6.1 tt0 -145.46 24.31 1.41 Allowed 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 123.865 0.866 . . . . 0.0 112.642 -179.387 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -65.22 127.29 31.11 Favored 'General case' 0 CA--C 1.542 0.65 0 O-C-N 120.701 -1.25 . . . . 0.0 112.55 -173.941 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 47.5 mtmt -138.63 146.2 41.41 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 126.491 1.916 . . . . 0.0 110.778 -177.701 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 78.0 p -138.12 161.96 35.45 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 125.784 1.634 . . . . 0.0 112.985 -178.043 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 98.6 mtp -103.22 160.28 14.81 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 125.382 1.473 . . . . 0.0 112.556 178.234 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 14.5 t -147.47 155.73 42.18 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 125.018 1.327 . . . . 0.0 112.217 178.787 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 22.8 m-90 . . . . . 0 C--O 1.254 1.29 0 C-N-CA 126.561 1.945 . . . . 0.0 111.92 -176.907 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.513 0 N-CA-C 111.711 -0.555 . . . . 0.0 111.711 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 51.0 m -118.51 157.18 27.77 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 125.455 1.502 . . . . 0.0 112.158 -178.58 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 38.0 t-80 -142.09 153.85 44.48 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 125.129 1.372 . . . . 0.0 111.707 179.205 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 28.1 ttt -143.31 99.77 3.5 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.803 1.241 . . . . 0.0 110.993 -177.536 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -156.08 163.2 39.95 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 125.29 1.436 . . . . 0.0 112.042 172.818 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 80.4 p -145.13 120.67 10.39 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.78 1.232 . . . . 0.0 111.486 -176.466 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.4 ttp -152.34 13.4 0.57 Allowed 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 124.196 0.999 . . . . 0.0 113.646 -172.394 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 20.6 m-20 -133.45 79.03 61.36 Favored Pre-proline 0 CA--C 1.549 0.916 0 C-N-CA 124.744 1.217 . . . . 0.0 112.227 -169.472 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo -80.95 -3.08 12.14 Favored 'Trans proline' 0 C--N 1.351 0.682 0 C-N-CA 123.88 3.053 . . . . 0.0 115.081 -177.74 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 97.7 mt -112.84 44.46 1.49 Allowed 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 125.938 1.695 . . . . 0.0 112.256 -175.312 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -116.28 1.75 13.14 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 125.08 1.352 . . . . 0.0 114.506 177.831 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.74 -56.0 2.23 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 124.627 1.171 . . . . 0.0 112.899 -167.458 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.0 pp -130.93 14.09 1.99 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 126.236 1.815 . . . . 0.0 112.82 -174.657 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 8.6 tt -43.82 123.46 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 C-N-CA 124.921 1.288 . . . . 0.0 112.537 178.693 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -146.69 10.15 1.05 Allowed 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 124.399 1.08 . . . . 0.0 113.401 179.82 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -81.41 6.39 14.66 Favored 'General case' 0 CA--C 1.546 0.794 0 N-CA-C 114.939 1.459 . . . . 0.0 114.939 -167.626 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 7.0 tp -146.1 23.05 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 C-N-CA 125.916 1.686 . . . . 0.0 113.609 -173.825 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 40.7 ttmt -124.24 -44.94 1.99 Allowed 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 114.081 1.141 . . . . 0.0 114.081 178.802 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 77.2 tttt -159.26 139.21 11.86 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 125.042 1.337 . . . . 0.0 111.618 -176.056 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -154.39 150.38 27.85 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 125.219 1.408 . . . . 0.0 111.292 -179.382 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -141.88 157.69 44.69 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.039 1.336 . . . . 0.0 112.051 171.94 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -104.45 62.26 0.72 Allowed 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 125.411 1.484 . . . . 0.0 111.725 -172.913 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 24.0 m-20 -109.86 108.47 18.79 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 124.773 1.229 . . . . 0.0 111.064 177.874 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 67.0 m -138.16 104.04 5.1 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 125.368 1.467 . . . . 0.0 110.575 -179.308 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 138.79 -25.75 2.8 Favored Glycine 0 N--CA 1.474 1.217 0 C-N-CA 125.273 1.416 . . . . 0.0 114.416 174.464 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 8.6 p -141.77 121.02 10.36 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 C-N-CA 125.494 1.518 . . . . 0.0 110.394 171.995 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -159.68 161.62 34.94 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 123.793 0.837 . . . . 0.0 113.146 -179.602 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -86.29 29.47 0.76 Allowed 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.962 1.705 . . . . 0.0 115.249 -175.902 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -144.34 125.41 7.82 Favored Pre-proline 0 CA--C 1.548 0.869 0 C-N-CA 125.653 1.581 . . . . 0.0 110.811 -175.878 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 91.6 Cg_endo -80.82 -33.78 0.78 Allowed 'Trans proline' 0 CA--C 1.54 0.821 0 C-N-CA 122.239 1.959 . . . . 0.0 113.93 -173.767 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 30.6 tp -152.91 61.28 0.79 Allowed 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 125.228 1.411 . . . . 0.0 109.8 -179.406 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 5.3 t 59.0 -177.18 0.09 Allowed 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.57 1.148 . . . . 0.0 113.09 -163.588 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 55.5 t 63.93 149.33 0.11 Allowed Pre-proline 0 N--CA 1.482 1.142 0 C-N-CA 127.907 2.483 . . . . 0.0 113.416 -178.317 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -69.88 67.61 1.8 Allowed 'Trans proline' 0 CA--C 1.55 1.286 0 C-N-CA 123.872 3.048 . . . . 0.0 111.935 170.151 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 20.7 tptp 50.17 103.31 0.03 OUTLIER Pre-proline 0 CA--C 1.549 0.941 0 C-N-CA 130.193 3.397 . . . . 0.0 114.259 -169.838 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -70.11 156.63 61.96 Favored 'Trans proline' 0 C--N 1.351 0.679 0 C-N-CA 122.333 2.022 . . . . 0.0 112.053 173.973 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.53 144.81 55.45 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.207 1.003 . . . . 0.0 112.238 176.684 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 48.4 tp -151.2 131.68 13.81 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.026 1.33 . . . . 0.0 110.332 -175.27 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -138.55 83.86 1.99 Allowed 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.317 1.447 . . . . 0.0 110.17 178.583 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -133.0 92.1 2.98 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.777 1.231 . . . . 0.0 110.729 -177.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.8 mt -133.52 154.44 50.83 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 127.159 2.184 . . . . 0.0 110.055 178.798 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 30.1 t -68.81 163.55 23.93 Favored 'General case' 0 N--CA 1.477 0.911 0 O-C-N 121.81 -0.557 . . . . 0.0 110.636 166.882 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -57.93 -42.0 83.91 Favored 'General case' 0 N--CA 1.477 0.884 0 O-C-N 120.335 -1.478 . . . . 0.0 112.875 -176.595 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 6.9 pt20 -74.96 -35.79 62.09 Favored 'General case' 0 N--CA 1.47 0.544 0 O-C-N 121.71 -0.619 . . . . 0.0 112.323 173.9 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 93.4 mt-30 -66.07 -38.22 87.77 Favored 'General case' 0 CA--C 1.532 0.276 0 O-C-N 121.563 -0.711 . . . . 0.0 111.261 178.823 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 40.7 ttmt -58.83 -41.13 86.15 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 124.228 1.011 . . . . 0.0 111.066 174.941 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 39.4 mt -71.65 -42.44 71.32 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 CA-C-O 118.441 -0.79 . . . . 0.0 110.993 178.106 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 40.1 mt -63.65 -43.04 97.99 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.988 0 CA-C-N 120.282 1.401 . . . . 0.0 110.19 177.851 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -57.4 -51.39 69.6 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 125.043 1.337 . . . . 0.0 110.129 176.097 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -65.14 -46.66 80.03 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.367 1.067 . . . . 0.0 113.508 179.685 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 17.7 mm-40 -67.35 -25.22 65.88 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 123.931 0.892 . . . . 0.0 112.96 179.8 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.435 ' CE1' HG22 ' A' ' 55' ' ' ILE . 1.9 t80 -72.35 -51.51 20.28 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 118.811 0.732 . . . . 0.0 110.589 175.642 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 42.6 mt -61.51 -32.51 53.67 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.596 0 C-N-CA 124.789 1.236 . . . . 0.0 111.229 173.591 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -66.3 -24.08 66.49 Favored 'General case' 0 CA--C 1.546 0.802 0 O-C-N 121.091 -1.005 . . . . 0.0 113.288 173.953 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -92.43 -31.48 15.28 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.543 1.137 . . . . 0.0 112.828 179.4 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 6.4 m -127.57 -22.39 1.73 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.94 0 N-CA-C 114.209 1.189 . . . . 0.0 114.209 -172.137 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 88.67 148.16 16.39 Favored Glycine 0 CA--C 1.533 1.206 0 C-N-CA 125.422 1.486 . . . . 0.0 113.458 -172.455 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -57.23 -25.63 59.44 Favored 'General case' 0 N--CA 1.481 1.08 0 CA-C-O 123.569 1.652 . . . . 0.0 112.544 -176.833 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 7.2 pt20 -81.16 -13.32 58.75 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 126.738 2.015 . . . . 0.0 114.622 -179.7 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 76.0 m-20 -118.07 -11.93 10.12 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 114.759 1.392 . . . . 0.0 114.759 -177.894 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.435 HG22 ' CE1' ' A' ' 46' ' ' TYR . 46.0 pt -64.21 152.61 8.21 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 CA-C-O 120.899 0.38 . . . . 0.0 110.678 163.418 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -130.15 143.53 50.84 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 124.452 1.101 . . . . 0.0 109.991 178.363 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -62.17 -24.77 67.38 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 118.931 0.787 . . . . 0.0 112.49 -179.65 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.9 mp -70.29 -42.11 78.73 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 C-N-CA 125.868 1.667 . . . . 0.0 110.747 174.629 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 88.8 m -79.09 -42.87 25.31 Favored 'General case' 0 C--N 1.33 -0.276 0 O-C-N 121.675 -0.64 . . . . 0.0 109.62 -179.411 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 17.3 tp -64.86 -35.97 82.83 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 125.701 1.6 . . . . 0.0 112.329 177.022 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.466 ' HA ' HG13 ' A' ' 66' ' ' ILE . 60.5 p -58.29 -26.47 63.05 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 118.995 0.816 . . . . 0.0 112.397 170.982 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -99.49 -30.1 12.35 Favored 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 124.794 1.238 . . . . 0.0 114.22 -178.913 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 11.1 mmtm -63.19 -34.44 77.63 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 125.077 1.351 . . . . 0.0 112.196 177.586 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.1 mp -118.06 8.78 12.53 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 124.981 1.312 . . . . 0.0 113.998 -177.585 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 14.2 t30 55.38 61.82 2.72 Favored 'General case' 0 CA--C 1.552 1.044 0 C-N-CA 125.091 1.357 . . . . 0.0 111.854 177.165 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.466 HG13 ' HA ' ' A' ' 61' ' ' SER . 1.6 pt -136.5 175.87 9.31 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 C-N-CA 126.428 1.891 . . . . 0.0 111.476 -171.148 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 32.4 p -74.99 160.27 30.76 Favored 'General case' 0 N--CA 1.472 0.639 0 O-C-N 120.964 -1.085 . . . . 0.0 111.073 171.987 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 90.6 t -66.61 -26.39 37.27 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.02 0 O-C-N 121.364 -0.835 . . . . 0.0 110.987 169.938 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -77.53 -30.79 52.98 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 124.822 1.249 . . . . 0.0 111.204 -176.916 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . 0.352 0.0 OUTLIER -102.49 18.01 22.23 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 125.254 1.422 . . . . 0.0 113.395 171.254 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -104.05 -43.82 5.17 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.134 1.374 . . . . 0.0 111.616 158.029 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 9.2 ptmm? -73.61 -24.66 60.08 Favored 'General case' 0 N--CA 1.472 0.629 0 O-C-N 120.877 -1.14 . . . . 0.0 112.478 -176.202 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 28.3 p-10 -54.15 -39.63 66.69 Favored 'General case' 0 CA--C 1.545 0.755 0 N-CA-C 113.246 0.832 . . . . 0.0 113.246 173.444 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 28.2 m-85 -69.68 -47.23 63.97 Favored 'General case' 0 C--O 1.226 -0.164 0 C-N-CA 126.902 2.081 . . . . 0.0 110.167 179.314 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 67.7 mt -65.25 -42.76 94.74 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.497 0 C-N-CA 123.974 0.91 . . . . 0.0 109.821 -179.355 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 2.7 tppp? -70.03 -31.54 69.24 Favored 'General case' 0 N--CA 1.467 0.419 0 O-C-N 120.809 -1.182 . . . . 0.0 112.533 -176.17 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 3.6 p30 -88.42 -39.49 14.23 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 119.202 0.91 . . . . 0.0 112.032 175.443 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 7.1 t -88.08 -16.64 32.99 Favored 'General case' 0 CA--C 1.542 0.672 0 N-CA-C 115.287 1.588 . . . . 0.0 115.287 -165.001 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 9.8 p30 -63.98 -17.1 62.97 Favored 'General case' 0 N--CA 1.477 0.911 0 N-CA-C 116.537 2.051 . . . . 0.0 116.537 -167.726 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 6.3 mpt_? -96.76 1.09 50.45 Favored 'General case' 0 N--CA 1.482 1.175 0 N-CA-C 114.623 1.342 . . . . 0.0 114.623 172.735 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 54.2 tp -114.63 -55.25 2.51 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 125.286 1.434 . . . . 0.0 112.218 175.154 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 72.13 -78.27 0.67 Allowed Glycine 0 CA--C 1.536 1.351 0 C-N-CA 123.335 0.493 . . . . 0.0 112.52 -169.029 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 87.9 mtt-85 -139.9 167.81 21.25 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 125.983 1.713 . . . . 0.0 112.366 177.828 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 13.2 t -106.57 60.78 0.64 Allowed 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 126.314 1.846 . . . . 0.0 113.082 -164.97 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 68.7 m-80 -128.28 28.83 5.43 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 124.81 1.244 . . . . 0.0 114.064 -175.783 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 52.3 t30 -137.53 155.41 49.28 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 124.936 1.294 . . . . 0.0 111.418 176.404 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 78.5 mt 51.17 40.75 26.66 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 126.141 1.776 . . . . 0.0 113.792 178.327 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 65.8 pttt -107.56 -5.66 17.42 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 125.819 1.648 . . . . 0.0 114.107 -177.631 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 15.0 t -152.68 125.12 8.2 Favored 'General case' 0 N--CA 1.465 0.281 0 C-N-CA 124.867 1.267 . . . . 0.0 110.35 168.179 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -140.61 4.11 0.52 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.833 0 C-N-CA 125.848 1.659 . . . . 0.0 113.457 -179.003 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 67.57 10.22 57.29 Favored Glycine 0 CA--C 1.54 1.61 0 O-C-N 120.669 -1.27 . . . . 0.0 114.523 -169.878 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . 0.288 4.2 mp 55.29 29.35 0.14 Allowed 'Isoleucine or valine' 0 CA--C 1.552 1.053 0 C-N-CA 126.56 1.944 . . . . 0.0 111.973 177.768 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 53.55 26.26 5.5 Favored 'General case' 0 CA--C 1.553 1.085 0 C-N-CA 125.964 1.706 . . . . 0.0 114.125 -175.277 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 83.5 mt-30 -111.41 93.8 4.65 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 125.695 1.598 . . . . 0.0 110.313 179.932 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -121.43 162.51 20.3 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 125.991 1.716 . . . . 0.0 111.393 176.759 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -135.52 122.87 21.82 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 124.94 1.296 . . . . 0.0 110.848 -179.004 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 67.9 t -133.94 127.82 52.45 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 C-N-CA 125.513 1.525 . . . . 0.0 109.933 176.835 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 44.2 t -161.29 -56.61 0.05 OUTLIER 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 123.978 0.911 . . . . 0.0 112.635 174.447 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 13.2 t -80.09 -29.6 39.08 Favored 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 113.553 0.945 . . . . 0.0 113.553 -174.517 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 13.3 ttt -135.34 115.08 12.84 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 125.283 1.433 . . . . 0.0 109.991 -178.875 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -117.76 -10.07 10.58 Favored 'General case' 0 N--CA 1.479 0.988 0 N-CA-C 113.89 1.071 . . . . 0.0 113.89 -169.291 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -87.42 124.65 33.64 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 124.866 1.266 . . . . 0.0 112.005 -178.043 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 59.4 mtmt -140.91 135.2 31.02 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 126.098 1.759 . . . . 0.0 110.489 174.957 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 39.9 m -142.89 -47.79 0.32 Allowed 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 124.352 1.061 . . . . 0.0 113.011 -178.51 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -131.27 156.84 44.73 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 125.614 1.565 . . . . 0.0 111.771 -177.364 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 10.1 t -102.13 165.43 11.16 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 125.273 1.429 . . . . 0.0 111.962 171.794 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 13.0 t-105 . . . . . 0 C--O 1.253 1.265 0 C-N-CA 125.82 1.648 . . . . 0.0 112.894 -170.247 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.589 0 N-CA-C 111.74 -0.544 . . . . 0.0 111.74 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 50.9 m -78.23 87.27 4.31 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.54 1.136 . . . . 0.0 112.557 -175.421 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 49.7 t-80 -144.75 138.45 27.19 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 125.322 1.449 . . . . 0.0 110.72 175.372 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 11.0 tpt -149.9 78.35 1.35 Allowed 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 123.852 0.861 . . . . 0.0 111.744 -171.52 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -149.21 164.52 34.54 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 124.853 1.261 . . . . 0.0 112.533 176.361 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 4.4 t -148.9 162.22 40.3 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 125.178 1.391 . . . . 0.0 112.057 175.338 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.1 mtt -140.4 136.51 33.17 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 125.562 1.545 . . . . 0.0 110.765 174.077 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 -135.88 148.44 65.1 Favored Pre-proline 0 CA--C 1.548 0.872 0 C-N-CA 125.11 1.364 . . . . 0.0 112.09 176.67 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -81.43 -7.85 12.72 Favored 'Trans proline' 0 CA--C 1.538 0.678 0 C-N-CA 123.643 2.895 . . . . 0.0 115.097 -177.0 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -130.94 31.4 4.48 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 125.787 1.635 . . . . 0.0 114.206 -174.194 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -101.29 -4.11 27.68 Favored 'General case' 0 N--CA 1.478 0.971 0 N-CA-C 114.67 1.359 . . . . 0.0 114.67 179.589 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -129.79 -57.63 1.11 Allowed 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 124.647 1.179 . . . . 0.0 113.424 -160.62 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.8 pp -107.05 9.5 9.39 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.761 0 C-N-CA 125.925 1.69 . . . . 0.0 112.869 -177.157 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 18.0 tt -48.61 114.4 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.841 0 C-N-CA 125.045 1.338 . . . . 0.0 113.791 -175.219 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 7.7 t30 -161.14 130.15 4.64 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 126.942 2.097 . . . . 0.0 108.586 171.652 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 29.2 t0 -150.42 47.87 0.89 Allowed 'General case' 0 N--CA 1.476 0.835 0 CA-C-O 122.556 1.17 . . . . 0.0 111.106 178.409 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 58.5 mt 48.69 96.7 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 C-N-CA 128.83 2.852 . . . . 0.0 112.539 -168.362 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.441 ' HA ' ' HE2' ' A' ' 12' ' ' LYS . 11.3 mmpt? 56.02 39.47 30.47 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 125.136 1.374 . . . . 0.0 113.321 172.463 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 22.5 mmtm -100.55 10.07 41.69 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 127.766 2.426 . . . . 0.0 113.364 176.937 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 6.9 mp0 -90.95 152.11 20.83 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 125.517 1.527 . . . . 0.0 111.839 -171.843 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -81.66 48.25 1.17 Allowed 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 125.234 1.414 . . . . 0.0 114.171 -169.959 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 51.5 t-20 -136.63 107.51 6.66 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 124.904 1.282 . . . . 0.0 111.172 -175.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -110.56 145.27 38.1 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.484 1.514 . . . . 0.0 111.998 174.827 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 3.8 t -135.58 43.42 2.61 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 124.888 1.275 . . . . 0.0 112.707 -179.771 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -142.91 40.28 1.26 Allowed Glycine 0 N--CA 1.471 0.969 0 C-N-CA 124.201 0.905 . . . . 0.0 115.235 179.962 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 91.3 t -97.5 143.38 12.72 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 C-N-CA 125.346 1.459 . . . . 0.0 110.941 178.265 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 5.2 t -133.59 -168.04 2.04 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 126.035 1.734 . . . . 0.0 111.497 177.077 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -76.54 29.32 0.12 Allowed 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 126.27 1.828 . . . . 0.0 114.449 -171.891 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -155.82 130.51 5.05 Favored Pre-proline 0 CA--C 1.547 0.835 0 C-N-CA 126.038 1.735 . . . . 0.0 110.066 -161.983 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -77.73 -39.05 0.55 Allowed 'Trans proline' 0 CA--C 1.538 0.698 0 C-N-CA 122.077 1.851 . . . . 0.0 113.847 -169.378 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 18.4 tp -154.61 62.51 0.67 Allowed 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 124.13 0.972 . . . . 0.0 111.967 -175.761 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.9 t 56.12 43.46 26.85 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 124.735 1.214 . . . . 0.0 113.936 179.041 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 12.7 p -154.55 144.81 15.78 Favored Pre-proline 0 N--CA 1.473 0.709 0 C-N-CA 125.764 1.626 . . . . 0.0 109.915 -172.22 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 91.3 Cg_endo -77.53 60.27 7.04 Favored 'Trans proline' 0 CA--C 1.548 1.2 0 C-N-CA 123.56 2.84 . . . . 0.0 112.349 178.0 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 27.9 tptt 58.4 110.74 0.02 OUTLIER Pre-proline 0 N--CA 1.483 1.176 0 C-N-CA 129.654 3.182 . . . . 0.0 114.263 -176.902 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_endo -79.83 149.52 20.57 Favored 'Trans proline' 0 CA--C 1.538 0.692 0 C-N-CA 123.015 2.477 . . . . 0.0 112.07 -174.226 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 48.9 pttt -60.8 129.72 42.91 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 124.447 1.099 . . . . 0.0 112.588 -178.455 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 14.8 tp -147.62 139.22 23.9 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.316 1.446 . . . . 0.0 111.102 -170.753 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -150.65 60.07 0.94 Allowed 'General case' 0 N--CA 1.476 0.869 0 CA-C-O 122.643 1.211 . . . . 0.0 113.221 -176.286 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -95.07 87.7 4.99 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 125.232 1.413 . . . . 0.0 112.875 -173.986 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 63.7 mt -138.38 163.19 32.51 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 126.436 1.895 . . . . 0.0 112.988 -176.692 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 67.4 m -76.33 165.0 25.48 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.73 0.812 . . . . 0.0 110.299 171.144 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -55.22 -45.91 75.95 Favored 'General case' 0 N--CA 1.48 1.027 0 O-C-N 120.746 -1.222 . . . . 0.0 113.185 -174.348 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 10.5 tt0 -67.69 -43.43 80.13 Favored 'General case' 0 N--CA 1.469 0.522 0 O-C-N 121.496 -0.752 . . . . 0.0 111.063 176.758 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 88.7 mt-30 -62.95 -41.48 99.52 Favored 'General case' 0 CA--C 1.536 0.412 0 O-C-N 121.916 -0.49 . . . . 0.0 111.819 178.935 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 22.6 ttmm -59.74 -40.98 89.89 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 124.27 1.028 . . . . 0.0 110.982 174.742 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 50.6 mt -67.38 -41.53 86.4 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 CA-C-O 118.077 -0.963 . . . . 0.0 111.474 175.583 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 45.6 mt -64.5 -44.91 96.95 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.904 0 CA-C-N 120.773 1.624 . . . . 0.0 110.29 178.074 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -58.29 -48.38 80.66 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.774 1.23 . . . . 0.0 110.587 177.434 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -63.56 -53.11 56.92 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.625 1.17 . . . . 0.0 112.599 176.529 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.3 mm-40 -60.01 -29.99 68.85 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-N 118.998 0.817 . . . . 0.0 112.822 -179.696 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.417 ' CE2' HG22 ' A' ' 55' ' ' ILE . 1.3 t80 -68.04 -56.95 7.02 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 118.806 0.73 . . . . 0.0 110.93 176.311 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 80.1 mt -64.98 -33.65 65.14 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.333 0 C-N-CA 126.526 1.931 . . . . 0.0 111.195 -179.323 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -72.25 -27.96 62.84 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.892 0.877 . . . . 0.0 112.568 176.309 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -85.53 -39.67 17.16 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 123.861 0.865 . . . . 0.0 112.503 176.337 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.9 m -105.21 -6.95 9.83 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.047 0 N-CA-C 113.654 0.983 . . . . 0.0 113.654 -175.497 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 81.48 33.23 28.72 Favored Glycine 0 N--CA 1.471 0.985 0 C-N-CA 124.263 0.935 . . . . 0.0 114.176 164.207 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 20.0 tp 60.86 -26.77 0.04 OUTLIER 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 129.945 3.298 . . . . 0.0 117.708 -174.148 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 29.5 mt-30 -77.27 -13.0 60.02 Favored 'General case' 0 C--N 1.32 -0.684 0 C-N-CA 126.922 2.089 . . . . 0.0 113.752 -169.277 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 60.5 m-80 -123.31 1.16 9.03 Favored 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 114.336 1.236 . . . . 0.0 114.336 -169.736 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.417 HG22 ' CE2' ' A' ' 46' ' ' TYR . 18.3 pt -75.91 155.46 5.95 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 CA-C-O 121.072 0.463 . . . . 0.0 111.705 175.006 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -137.85 143.94 41.19 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 124.658 1.183 . . . . 0.0 110.018 178.794 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -61.33 -26.62 67.93 Favored 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 123.634 0.773 . . . . 0.0 112.316 -179.758 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -67.47 -51.21 54.37 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.327 0 C-N-CA 125.343 1.457 . . . . 0.0 109.631 174.538 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 83.6 m -73.81 -43.82 57.66 Favored 'General case' 0 C--N 1.33 -0.239 0 O-C-N 121.749 -0.594 . . . . 0.0 109.918 -176.719 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 17.2 tp -60.61 -35.09 75.29 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 125.53 1.532 . . . . 0.0 112.343 174.384 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.485 ' HA ' HG13 ' A' ' 66' ' ' ILE . 12.0 t -54.99 -30.43 59.3 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 124.975 1.31 . . . . 0.0 112.581 169.485 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 1.5 mptp? -105.19 -22.78 13.01 Favored 'General case' 0 N--CA 1.468 0.474 0 N-CA-C 114.491 1.293 . . . . 0.0 114.491 -176.464 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 68.4 mmtt -62.9 -34.57 77.69 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 119.797 1.18 . . . . 0.0 111.636 174.074 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.2 mp -120.92 13.65 11.44 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.923 1.289 . . . . 0.0 114.05 -176.401 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . 0.273 0.9 OUTLIER 48.2 53.68 11.4 Favored 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 126.614 1.965 . . . . 0.0 114.218 -177.14 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.485 HG13 ' HA ' ' A' ' 61' ' ' SER . 2.7 pt -117.42 -176.05 0.92 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 C-N-CA 126.781 2.032 . . . . 0.0 111.483 -174.626 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 36.8 p -83.94 156.76 22.19 Favored 'General case' 0 N--CA 1.474 0.734 0 O-C-N 121.214 -0.929 . . . . 0.0 111.084 170.791 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 66.7 t -62.27 -28.94 45.54 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 O-C-N 121.672 -0.643 . . . . 0.0 111.132 170.914 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -74.91 -42.71 57.24 Favored 'General case' 0 C--O 1.234 0.263 0 O-C-N 120.988 -1.07 . . . . 0.0 109.879 -176.597 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . 0.262 0.0 OUTLIER -77.69 -30.17 51.79 Favored 'General case' 0 C--N 1.344 0.348 0 CA-C-N 118.137 0.426 . . . . 0.0 111.88 -178.993 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -65.04 -47.32 77.81 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 124.678 1.191 . . . . 0.0 112.324 169.322 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 38.1 ttmt -68.1 -28.91 67.75 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 124.32 1.048 . . . . 0.0 111.492 -178.258 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -55.17 -36.54 65.96 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 123.494 0.718 . . . . 0.0 112.361 175.729 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 31.5 m-85 -69.54 -42.7 74.28 Favored 'General case' 0 C--O 1.223 -0.324 0 C-N-CA 125.569 1.548 . . . . 0.0 111.02 177.136 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 75.2 mt -68.45 -37.27 77.56 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.468 0 C-N-CA 124.173 0.989 . . . . 0.0 110.264 -178.626 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 88.5 mttt -65.19 -34.91 79.49 Favored 'General case' 0 N--CA 1.471 0.594 0 O-C-N 120.853 -1.154 . . . . 0.0 113.448 178.538 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 9.6 p30 -87.57 -40.26 14.39 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 119.315 0.961 . . . . 0.0 111.105 174.202 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 8.5 t -114.45 91.15 3.53 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-O 121.696 0.76 . . . . 0.0 111.458 -174.746 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 9.4 p30 -144.64 138.93 27.7 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.497 1.119 . . . . 0.0 109.885 167.493 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 2.6 mpt_? 57.8 -23.17 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.624 0 C-N-CA 128.044 2.537 . . . . 0.0 116.71 -172.421 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 56.0 tp -96.37 -34.56 11.51 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 126.63 1.972 . . . . 0.0 113.452 -174.206 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -75.23 146.64 34.94 Favored Glycine 0 CA--C 1.535 1.295 0 CA-C-N 118.008 0.367 . . . . 0.0 112.833 178.647 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 84.9 mtt-85 -135.61 -82.87 0.4 Allowed 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 124.839 1.256 . . . . 0.0 111.637 -178.099 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 3.9 t -159.75 119.58 2.95 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 125.361 1.465 . . . . 0.0 109.486 177.508 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 7.1 m120 -138.84 135.69 34.82 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 123.928 0.891 . . . . 0.0 110.393 -171.588 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 11.9 p-10 -153.31 166.7 31.79 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 124.835 1.254 . . . . 0.0 112.12 -175.524 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER 56.62 29.04 14.95 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 125.76 1.624 . . . . 0.0 114.42 176.901 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 17.9 ptpt -129.26 5.46 5.27 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 125.643 1.577 . . . . 0.0 114.848 -178.221 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 13.6 t -148.22 122.66 9.71 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 124.421 1.088 . . . . 0.0 110.299 173.919 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -140.52 4.94 0.53 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.812 0 C-N-CA 126.241 1.816 . . . . 0.0 113.025 -179.133 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 69.17 6.66 54.46 Favored Glycine 0 CA--C 1.538 1.475 0 O-C-N 120.751 -1.218 . . . . 0.0 114.753 -170.145 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . 0.287 4.6 mp 56.87 24.19 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.061 0 C-N-CA 126.532 1.933 . . . . 0.0 112.403 177.219 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 10.7 tp 53.68 23.39 3.63 Favored 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 126.28 1.832 . . . . 0.0 114.238 -172.085 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -95.39 93.21 7.1 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.655 1.582 . . . . 0.0 110.215 -179.407 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -121.21 144.64 48.49 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 125.303 1.441 . . . . 0.0 111.72 179.377 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -121.43 74.25 1.1 Allowed 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 125.166 1.386 . . . . 0.0 110.692 -175.394 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 18.6 m -135.12 21.92 1.05 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.615 0 C-N-CA 125.588 1.555 . . . . 0.0 114.229 -170.76 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 22.9 t -146.45 -56.59 0.28 Allowed 'General case' 0 N--CA 1.476 0.831 0 N-CA-C 113.517 0.932 . . . . 0.0 113.517 -176.625 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 45.6 m -88.15 -40.27 13.87 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 123.261 0.624 . . . . 0.0 112.441 -175.509 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 1.8 mpt? -125.05 141.66 51.98 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 126.473 1.909 . . . . 0.0 108.827 169.75 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -148.04 94.49 2.34 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.752 1.221 . . . . 0.0 109.259 178.31 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -138.2 156.18 47.95 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.195 1.398 . . . . 0.0 112.304 -178.863 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 2.0 mmmp? -128.16 139.97 52.18 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 125.996 1.718 . . . . 0.0 110.831 179.894 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 55.0 m -143.61 154.8 43.93 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 125.401 1.48 . . . . 0.0 111.886 -177.5 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 27.2 mmt -78.51 158.41 28.59 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 124.03 0.932 . . . . 0.0 112.681 171.011 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 7.1 t -78.12 171.32 15.2 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 124.738 1.215 . . . . 0.0 112.377 170.534 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 21.7 m-90 . . . . . 0 C--O 1.253 1.269 0 C-N-CA 126.453 1.901 . . . . 0.0 112.883 -173.557 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.512 0 N-CA-C 111.345 -0.702 . . . . 0.0 111.345 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 13.3 t -150.11 156.39 41.55 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 125.368 1.467 . . . . 0.0 111.176 177.121 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 1.5 t-160 -149.07 163.93 36.11 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 124.896 1.279 . . . . 0.0 111.726 -179.686 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 20.7 ttt -103.78 140.52 37.52 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 124.719 1.207 . . . . 0.0 112.393 -174.179 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -80.52 156.93 26.29 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 124.301 1.04 . . . . 0.0 113.382 -178.131 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 22.9 t -151.19 157.22 42.39 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 125.295 1.438 . . . . 0.0 111.651 174.973 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 36.9 ttm -135.34 9.89 3.47 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 125.532 1.533 . . . . 0.0 112.926 -178.732 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 -84.76 147.81 49.76 Favored Pre-proline 0 CA--C 1.547 0.847 0 C-N-CA 124.628 1.171 . . . . 0.0 112.481 -179.141 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_endo -71.03 -19.18 30.44 Favored 'Trans proline' 0 C--N 1.35 0.655 0 C-N-CA 122.935 2.424 . . . . 0.0 114.963 -173.634 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.478 HD23 ' H ' ' A' ' 4' ' ' LEU . 2.6 pt? -112.63 25.68 11.24 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 126.828 2.051 . . . . 0.0 114.402 -172.353 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -103.01 0.52 32.22 Favored 'General case' 0 N--CA 1.477 0.876 0 N-CA-C 114.815 1.413 . . . . 0.0 114.815 -178.167 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -122.46 -55.36 1.84 Allowed 'General case' 0 N--CA 1.484 1.234 0 N-CA-C 113.894 1.072 . . . . 0.0 113.894 -165.168 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.0 pp -129.84 15.15 2.39 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 C-N-CA 125.652 1.581 . . . . 0.0 112.81 -171.784 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 14.2 tt -39.79 133.33 0.49 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.847 0 C-N-CA 126.407 1.883 . . . . 0.0 114.407 178.724 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 25.8 t30 -148.54 148.85 30.66 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 126.242 1.817 . . . . 0.0 110.732 170.63 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 20.2 m-20 -132.63 71.47 1.47 Allowed 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 125.389 1.475 . . . . 0.0 111.004 170.41 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . 0.34 6.7 tp 52.21 26.26 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.069 0 C-N-CA 128.262 2.625 . . . . 0.0 115.571 175.098 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -130.98 -33.6 1.54 Allowed 'General case' 0 N--CA 1.476 0.867 0 N-CA-C 114.818 1.414 . . . . 0.0 114.818 177.612 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 45.7 tttm 50.73 38.45 19.42 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 125.982 1.713 . . . . 0.0 113.252 -174.381 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -77.17 122.73 25.42 Favored 'General case' 0 CA--C 1.541 0.617 0 O-C-N 121.321 -0.862 . . . . 0.0 111.368 -177.251 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -153.32 166.39 32.75 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 125.747 1.619 . . . . 0.0 111.433 178.925 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -111.4 126.69 55.21 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 124.798 1.239 . . . . 0.0 111.791 179.153 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 20.7 m-20 -144.56 145.69 31.95 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 126.144 1.777 . . . . 0.0 110.54 175.341 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 83.6 p -139.07 10.8 2.6 Favored 'General case' 0 N--CA 1.479 0.998 0 N-CA-C 115.444 1.646 . . . . 0.0 115.444 -173.917 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -168.56 109.06 0.32 Allowed Glycine 0 CA--C 1.529 0.929 0 O-C-N 121.561 -0.712 . . . . 0.0 112.043 172.33 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 4.4 t -132.65 40.15 0.69 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.125 0 C-N-CA 125.432 1.493 . . . . 0.0 110.736 -175.717 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -150.22 159.87 44.11 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 114.949 1.463 . . . . 0.0 114.949 -175.623 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.448 HD23 ' H ' ' A' ' 22' ' ' LEU . 1.4 pt? -93.17 29.17 1.95 Allowed 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 126.747 2.019 . . . . 0.0 114.937 -171.071 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -135.54 143.14 43.83 Favored Pre-proline 0 CA--C 1.55 0.95 0 C-N-CA 125.443 1.497 . . . . 0.0 112.258 -170.736 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_endo -79.61 -29.38 2.93 Favored 'Trans proline' 0 CA--C 1.541 0.866 0 C-N-CA 123.201 2.601 . . . . 0.0 112.851 -177.949 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 8.1 tp -150.08 -158.16 0.89 Allowed 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 126.971 2.108 . . . . 0.0 108.305 174.641 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 5.2 t -78.06 54.37 1.32 Allowed 'General case' 0 N--CA 1.479 0.992 0 O-C-N 120.751 -1.218 . . . . 0.0 112.604 176.626 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 13.1 p -159.14 140.45 9.51 Favored Pre-proline 0 N--CA 1.474 0.771 0 C-N-CA 126.23 1.812 . . . . 0.0 110.859 -171.631 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -79.44 64.06 8.8 Favored 'Trans proline' 0 CA--C 1.546 1.124 0 C-N-CA 123.789 2.993 . . . . 0.0 112.341 178.26 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 17.8 tptt 59.47 107.11 0.03 OUTLIER Pre-proline 0 N--CA 1.483 1.202 0 C-N-CA 129.038 2.935 . . . . 0.0 114.043 -177.51 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 86.3 Cg_endo -77.36 137.23 16.59 Favored 'Trans proline' 0 CA--C 1.539 0.731 0 C-N-CA 122.843 2.362 . . . . 0.0 112.153 -173.232 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 13.4 ptmm? -72.85 130.71 41.04 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 124.712 1.205 . . . . 0.0 113.092 -175.556 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.1 pp -147.94 151.74 36.33 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 124.945 1.298 . . . . 0.0 113.319 -179.979 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -138.31 50.53 1.89 Allowed 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 125.139 1.375 . . . . 0.0 111.922 -175.827 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -82.73 78.51 9.33 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 124.967 1.307 . . . . 0.0 111.638 -174.543 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 11.2 mt -134.0 148.64 51.14 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 126.953 2.101 . . . . 0.0 110.398 -173.195 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 68.3 m -69.06 167.19 16.52 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.006 0.522 . . . . 0.0 110.47 171.158 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -56.26 -45.48 80.07 Favored 'General case' 0 N--CA 1.478 0.927 0 O-C-N 120.463 -1.398 . . . . 0.0 112.651 -176.327 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 10.3 tt0 -70.16 -44.25 69.18 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 123.527 0.731 . . . . 0.0 111.347 176.338 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 82.9 mt-30 -59.71 -41.66 91.3 Favored 'General case' 0 N--CA 1.468 0.453 0 O-C-N 121.805 -0.559 . . . . 0.0 111.693 178.16 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 3.4 ttmp? -62.34 -40.05 95.11 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 124.206 1.002 . . . . 0.0 111.215 177.542 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 52.4 mt -70.53 -39.46 76.18 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.558 0 CA-C-O 117.958 -1.02 . . . . 0.0 111.585 175.655 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 50.7 mt -62.87 -45.64 98.36 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.99 0 CA-C-N 120.942 1.701 . . . . 0.0 109.733 176.676 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -58.58 -49.44 77.45 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.829 1.251 . . . . 0.0 110.924 178.56 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -63.94 -52.21 60.8 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 124.784 1.234 . . . . 0.0 112.766 177.086 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -60.22 -30.36 69.34 Favored 'General case' 0 N--CA 1.472 0.625 0 CA-C-N 118.99 0.814 . . . . 0.0 112.724 179.867 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -67.02 -56.84 8.38 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 118.631 0.65 . . . . 0.0 110.605 176.659 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 87.1 mt -62.81 -34.14 64.14 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 C-N-CA 126.383 1.873 . . . . 0.0 111.287 178.126 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -70.91 -28.08 64.26 Favored 'General case' 0 CA--C 1.542 0.663 0 O-C-N 121.267 -0.896 . . . . 0.0 112.654 177.169 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -85.67 -40.26 16.37 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.127 0.971 . . . . 0.0 112.208 175.689 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.5 m -108.75 -5.04 10.73 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.159 0 N-CA-C 114.32 1.23 . . . . 0.0 114.32 -172.275 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 84.96 25.25 41.66 Favored Glycine 0 CA--C 1.529 0.96 0 C-N-CA 125.111 1.339 . . . . 0.0 115.263 161.318 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 58.01 6.64 0.51 Allowed 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 127.267 2.227 . . . . 0.0 115.155 -172.923 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 29.2 mt-30 -105.71 -18.01 14.21 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 125.856 1.663 . . . . 0.0 113.098 -172.139 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 47.0 m-80 -124.06 3.79 8.64 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 124.257 1.023 . . . . 0.0 113.542 -172.631 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 24.6 pt -74.36 154.31 6.68 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 CA-C-O 121.085 0.469 . . . . 0.0 111.116 172.666 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -138.85 142.65 38.63 Favored 'General case' 0 N--CA 1.466 0.375 0 C-N-CA 124.824 1.25 . . . . 0.0 109.525 178.68 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -61.01 -27.87 68.63 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 118.838 0.745 . . . . 0.0 112.274 -179.772 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -63.84 -49.29 82.58 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.466 0 C-N-CA 125.576 1.55 . . . . 0.0 109.922 174.626 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 83.9 m -78.98 -43.0 25.35 Favored 'General case' 0 C--O 1.223 -0.32 0 C-N-CA 123.806 0.842 . . . . 0.0 110.302 -175.904 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 14.0 tp -60.01 -36.75 77.89 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 125.078 1.351 . . . . 0.0 111.745 174.098 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.443 ' HA ' HG13 ' A' ' 66' ' ' ILE . 30.4 t -56.44 -31.41 63.93 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 124.839 1.255 . . . . 0.0 112.632 170.601 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -101.24 -26.36 13.67 Favored 'General case' 0 N--CA 1.467 0.39 0 N-CA-C 114.643 1.349 . . . . 0.0 114.643 -175.81 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 58.7 mmtt -64.41 -33.01 74.87 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 125.135 1.374 . . . . 0.0 111.577 175.387 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.7 mp -117.84 3.92 12.22 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.213 1.405 . . . . 0.0 114.353 -175.086 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 24.7 m-80 57.0 57.52 4.57 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 126.388 1.875 . . . . 0.0 113.415 -178.659 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.443 HG13 ' HA ' ' A' ' 61' ' ' SER . 1.2 pt -124.74 -163.99 0.38 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.849 0 C-N-CA 127.243 2.217 . . . . 0.0 110.554 -174.641 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 2.4 p -100.8 162.24 13.04 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 124.296 1.039 . . . . 0.0 111.126 170.284 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 69.2 t -61.65 -28.9 45.05 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 C-N-CA 123.545 0.738 . . . . 0.0 111.391 173.242 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -80.87 -38.17 28.59 Favored 'General case' 0 N--CA 1.471 0.613 0 O-C-N 120.893 -1.129 . . . . 0.0 110.394 -178.971 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 9.5 tmtt? -64.67 -45.5 86.45 Favored 'General case' 0 C--O 1.224 -0.237 0 C-N-CA 125.632 1.573 . . . . 0.0 110.518 176.961 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -60.34 -48.62 80.97 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 126.275 1.83 . . . . 0.0 113.444 170.71 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 36.5 ttmt -71.62 -23.03 61.64 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 124.227 1.011 . . . . 0.0 111.758 -174.417 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -52.02 -47.73 64.86 Favored 'General case' 0 CA--C 1.545 0.76 0 CA-C-N 118.137 0.426 . . . . 0.0 110.527 171.421 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 33.9 m-85 -64.6 -43.28 94.29 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 123.845 0.858 . . . . 0.0 111.982 179.776 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 55.8 mt -63.91 -25.38 38.04 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.629 0 C-N-CA 123.978 0.911 . . . . 0.0 111.099 179.15 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -91.06 -31.85 16.11 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 125.176 1.39 . . . . 0.0 114.686 179.724 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 23.5 p30 -105.17 -28.56 10.9 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 120.247 1.385 . . . . 0.0 114.224 -179.258 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 4.3 t -91.78 -14.63 29.54 Favored 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 113.865 1.061 . . . . 0.0 113.865 -171.392 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 20.7 p30 -59.18 -18.33 35.33 Favored 'General case' 0 CA--C 1.546 0.817 0 N-CA-C 115.394 1.627 . . . . 0.0 115.394 -175.329 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 2.7 mpt_? -71.77 -22.28 61.62 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 124.758 1.223 . . . . 0.0 112.649 -179.82 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 12.9 tp -78.75 -48.75 14.28 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 124.839 1.255 . . . . 0.0 112.815 -169.347 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -86.82 50.63 4.21 Favored Glycine 0 CA--C 1.534 1.234 0 C-N-CA 125.093 1.33 . . . . 0.0 113.867 -176.326 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 28.2 mtt85 -129.88 -60.83 1.02 Allowed 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 124.899 1.28 . . . . 0.0 112.61 -174.269 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 2.7 t -161.17 132.4 5.46 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 124.371 1.068 . . . . 0.0 109.736 -178.5 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 7.5 m120 -133.97 149.76 51.25 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 124.85 1.26 . . . . 0.0 110.91 -173.053 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 58.3 t30 -113.13 143.56 44.15 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.671 1.188 . . . . 0.0 111.687 178.191 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 5.3 tp 56.33 -178.85 0.04 OUTLIER 'General case' 0 CA--C 1.553 1.096 0 C-N-CA 126.557 1.943 . . . . 0.0 112.799 -170.009 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -133.3 7.25 3.9 Favored 'General case' 0 N--CA 1.482 1.159 0 N-CA-C 115.791 1.774 . . . . 0.0 115.791 -171.174 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 1.5 t -135.64 8.46 3.33 Favored 'General case' 0 N--CA 1.484 1.253 0 N-CA-C 116.381 1.993 . . . . 0.0 116.381 -165.652 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.543 HG23 ' CA ' ' A' ' 92' ' ' ILE . 1.6 tp -114.1 7.64 7.72 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.671 0 N-CA-C 115.1 1.518 . . . . 0.0 115.1 -141.955 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 61.75 7.2 10.82 Favored Glycine 0 CA--C 1.532 1.129 0 CA-C-N 114.338 -1.301 . . . . 0.0 113.855 -152.227 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.543 ' CA ' HG23 ' A' ' 90' ' ' ILE 0.29 3.7 mp 59.66 35.68 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.377 0 CA-C-O 122.449 1.119 . . . . 0.0 109.223 -166.86 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 10.9 tp 50.49 25.47 1.97 Allowed 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 127.978 2.511 . . . . 0.0 114.963 -174.303 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 37.2 mt-30 -136.64 85.54 2.15 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 125.718 1.607 . . . . 0.0 110.8 -172.035 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -125.42 145.21 50.16 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 124.883 1.273 . . . . 0.0 111.276 172.28 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -144.64 96.8 2.93 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 124.833 1.253 . . . . 0.0 110.345 -175.535 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 71.7 t -136.59 137.99 46.99 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 C-N-CA 125.577 1.551 . . . . 0.0 110.683 -177.33 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 67.5 p -161.92 -66.26 0.05 Allowed 'General case' 0 N--CA 1.476 0.837 0 N-CA-C 113.609 0.966 . . . . 0.0 113.609 172.632 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 77.9 p -82.43 -23.54 34.77 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 124.977 1.311 . . . . 0.0 114.291 -173.157 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 93.1 mtp -133.5 130.93 39.21 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 126.023 1.729 . . . . 0.0 109.495 174.551 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -138.69 65.63 1.45 Allowed 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 125.074 1.35 . . . . 0.0 109.93 -174.683 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 53.4 -155.62 0.2 Allowed 'General case' 0 CA--C 1.555 1.147 0 C-N-CA 125.855 1.662 . . . . 0.0 113.886 -174.94 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 71.2 mmtt -131.56 155.82 46.82 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 126.287 1.835 . . . . 0.0 111.947 177.851 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 66.7 p -116.01 15.29 16.17 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 126.455 1.902 . . . . 0.0 114.148 -172.985 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 67.9 mtt -67.73 160.71 27.55 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 124.732 1.213 . . . . 0.0 113.407 -178.136 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 14.8 t -137.53 156.23 48.35 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 125.377 1.471 . . . . 0.0 112.314 179.004 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 25.0 m-90 . . . . . 0 C--O 1.252 1.222 0 C-N-CA 126.59 1.956 . . . . 0.0 112.094 -175.114 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.574 0 N-CA-C 111.795 -0.522 . . . . 0.0 111.795 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 78.9 p -146.52 160.43 42.13 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 125.177 1.391 . . . . 0.0 112.669 -179.605 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 73.1 m80 -137.82 161.8 35.63 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 125.855 1.662 . . . . 0.0 111.803 -178.164 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 64.9 ttp -138.38 137.56 37.42 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 125.299 1.439 . . . . 0.0 110.992 177.827 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . 42.93 76.34 0.08 Allowed 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 127.341 2.256 . . . . 0.0 115.249 172.855 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 23.7 t -126.23 117.52 23.25 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 125.293 1.437 . . . . 0.0 111.514 -171.32 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 21.0 ttt -147.66 18.14 1.15 Allowed 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 125.283 1.433 . . . . 0.0 112.298 -174.808 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -120.82 98.39 47.81 Favored Pre-proline 0 CA--C 1.546 0.809 0 O-C-N 120.639 -1.288 . . . . 0.0 111.981 -168.796 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 95.5 Cg_endo -83.66 -8.59 10.31 Favored 'Trans proline' 0 C--N 1.351 0.665 0 C-N-CA 123.205 2.603 . . . . 0.0 114.699 178.145 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 94.3 mt -102.69 44.22 1.03 Allowed 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.626 1.57 . . . . 0.0 113.683 -170.582 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -106.91 -1.77 21.98 Favored 'General case' 0 N--CA 1.479 1.004 0 N-CA-C 114.907 1.447 . . . . 0.0 114.907 172.073 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -128.49 -56.46 1.23 Allowed 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 124.174 0.99 . . . . 0.0 113.363 -166.833 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.7 pp -109.54 9.07 8.96 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 C-N-CA 126.029 1.732 . . . . 0.0 112.888 -175.912 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 13.3 tt -49.85 120.31 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 124.223 1.009 . . . . 0.0 112.559 -179.252 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 53.85 21.48 2.79 Favored 'General case' 0 CA--C 1.55 0.965 0 C-N-CA 126.536 1.935 . . . . 0.0 115.244 179.937 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -86.32 13.83 7.5 Favored 'General case' 0 CA--C 1.547 0.832 0 N-CA-C 114.794 1.405 . . . . 0.0 114.794 -168.636 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 12.7 tt -143.69 21.35 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.879 0 C-N-CA 125.325 1.45 . . . . 0.0 114.201 -174.076 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 54.3 mtpt -126.86 -36.82 2.17 Favored 'General case' 0 N--CA 1.479 0.979 0 N-CA-C 115.572 1.693 . . . . 0.0 115.572 178.895 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 45.8 tttm -157.61 149.48 22.16 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 124.462 1.105 . . . . 0.0 112.788 -174.53 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -83.37 144.82 29.39 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.336 1.054 . . . . 0.0 111.86 167.553 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -140.54 27.11 2.09 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 125.019 1.327 . . . . 0.0 113.892 -163.601 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -110.49 -26.45 9.5 Favored 'General case' 0 CA--C 1.549 0.911 0 N-CA-C 114.834 1.42 . . . . 0.0 114.834 -169.387 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 -139.75 138.7 36.12 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 124.914 1.286 . . . . 0.0 111.751 -175.901 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 42.9 m -140.91 44.45 1.8 Allowed 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 125.035 1.334 . . . . 0.0 112.803 -170.759 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -148.56 36.7 1.07 Allowed Glycine 0 CA--C 1.53 1.001 0 N-CA-C 115.202 0.841 . . . . 0.0 115.202 -175.202 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 39.7 t -129.67 39.34 0.84 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 C-N-CA 125.751 1.62 . . . . 0.0 110.199 -170.363 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -147.61 164.05 34.69 Favored 'General case' 0 N--CA 1.476 0.85 0 O-C-N 120.333 -1.479 . . . . 0.0 114.384 -178.127 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 6.0 mt -91.04 38.89 0.97 Allowed 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 127.17 2.188 . . . . 0.0 112.229 -163.695 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -141.78 103.65 5.82 Favored Pre-proline 0 CA--C 1.549 0.924 0 C-N-CA 124.106 0.962 . . . . 0.0 112.238 -157.52 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo -79.63 -26.28 4.85 Favored 'Trans proline' 0 CA--C 1.541 0.848 0 C-N-CA 122.843 2.362 . . . . 0.0 113.921 -175.532 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 6.2 mt -138.37 47.49 1.98 Allowed 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 125.476 1.511 . . . . 0.0 112.267 -176.296 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 1.3 t 57.87 31.21 20.23 Favored 'General case' 0 N--CA 1.477 0.892 0 CA-C-O 123.084 1.421 . . . . 0.0 114.655 -179.972 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 16.8 t -149.32 138.54 12.61 Favored Pre-proline 0 N--CA 1.469 0.475 0 C-N-CA 128.887 2.875 . . . . 0.0 106.905 -172.567 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_endo -73.77 71.82 3.97 Favored 'Trans proline' 0 CA--C 1.544 0.976 0 C-N-CA 123.986 3.124 . . . . 0.0 111.847 -179.316 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 60.34 101.63 0.04 OUTLIER Pre-proline 0 N--CA 1.476 0.87 0 C-N-CA 128.137 2.575 . . . . 0.0 112.819 -175.469 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 77.2 Cg_endo -71.01 164.41 35.84 Favored 'Trans proline' 0 CA--C 1.54 0.781 0 C-N-CA 122.478 2.119 . . . . 0.0 112.045 170.395 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 22.2 pttp -112.75 124.17 51.96 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 125.256 1.422 . . . . 0.0 111.829 173.149 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -154.04 157.88 39.69 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.558 1.543 . . . . 0.0 113.741 -171.009 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 65.0 mm-40 -139.02 55.28 1.71 Allowed 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 126.045 1.738 . . . . 0.0 111.605 179.414 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -105.47 95.17 5.63 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 125.48 1.512 . . . . 0.0 112.036 -173.894 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 8.1 mt -133.87 155.87 49.09 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 127.272 2.229 . . . . 0.0 110.224 177.973 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 22.8 t -70.93 164.46 25.39 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 122.93 0.492 . . . . 0.0 110.747 169.83 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -57.24 -44.17 83.58 Favored 'General case' 0 N--CA 1.476 0.836 0 O-C-N 120.531 -1.355 . . . . 0.0 112.965 -175.3 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 8.1 pt20 -75.9 -33.88 59.93 Favored 'General case' 0 N--CA 1.471 0.6 0 O-C-N 121.693 -0.63 . . . . 0.0 112.155 174.769 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 93.2 mt-30 -67.52 -39.5 85.11 Favored 'General case' 0 CA--C 1.532 0.264 0 O-C-N 121.662 -0.649 . . . . 0.0 111.52 -179.691 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 23.7 ttmm -59.36 -41.0 88.24 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 124.213 1.005 . . . . 0.0 110.81 174.682 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 46.2 mt -69.65 -42.2 80.38 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.656 0 CA-C-O 118.136 -0.935 . . . . 0.0 111.283 177.026 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 42.4 mt -63.86 -44.5 98.11 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.069 0 CA-C-N 120.702 1.592 . . . . 0.0 110.361 178.357 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -59.69 -47.52 85.33 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 125.033 1.333 . . . . 0.0 110.865 176.74 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -63.92 -51.83 62.67 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 124.634 1.173 . . . . 0.0 112.67 176.703 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -58.95 -31.62 68.87 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-N 119.261 0.937 . . . . 0.0 112.689 179.124 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -66.07 -57.41 7.78 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 118.621 0.646 . . . . 0.0 110.587 176.869 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 71.0 mt -62.7 -35.13 69.17 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.352 0 C-N-CA 127.199 2.2 . . . . 0.0 111.896 178.631 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -71.97 -29.03 63.83 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.023 0.929 . . . . 0.0 112.408 178.138 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -86.27 -38.76 17.22 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 123.988 0.915 . . . . 0.0 112.312 176.236 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.3 m -106.55 -5.91 10.19 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.191 0 N-CA-C 114.285 1.217 . . . . 0.0 114.285 -174.372 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 86.32 25.85 35.27 Favored Glycine 0 N--CA 1.472 1.085 0 C-N-CA 124.967 1.27 . . . . 0.0 115.306 161.594 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 54.3 14.24 0.74 Allowed 'General case' 0 CA--C 1.554 1.116 0 C-N-CA 127.381 2.272 . . . . 0.0 115.129 -173.538 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 5.2 pt20 -124.6 -3.17 7.84 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 124.854 1.262 . . . . 0.0 113.662 -171.589 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 50.4 m-80 -124.55 3.52 8.31 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 124.935 1.294 . . . . 0.0 113.411 174.419 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 33.0 pt -74.51 152.95 6.76 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.648 0 O-C-N 121.68 -0.638 . . . . 0.0 112.192 177.007 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -135.49 146.13 47.83 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 125.237 1.415 . . . . 0.0 109.864 174.522 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -65.0 -24.99 67.67 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.884 0.874 . . . . 0.0 112.125 177.397 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -68.02 -38.5 79.99 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.488 0 C-N-CA 125.905 1.682 . . . . 0.0 110.419 173.464 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 90.7 m -83.06 -43.67 16.04 Favored 'General case' 0 C--N 1.33 -0.25 0 O-C-N 121.661 -0.649 . . . . 0.0 109.668 -178.643 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 8.0 mt -60.44 -36.86 79.18 Favored 'General case' 0 N--CA 1.468 0.439 0 O-C-N 121.442 -0.786 . . . . 0.0 112.571 171.297 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.452 ' HA ' HG13 ' A' ' 66' ' ' ILE . 62.1 p -59.98 -24.69 64.64 Favored 'General case' 0 N--CA 1.477 0.921 0 CA-C-N 119.509 1.049 . . . . 0.0 112.669 175.938 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -103.13 -28.23 12.07 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 125.277 1.431 . . . . 0.0 114.246 -177.625 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 19.7 mmmt -64.31 -31.0 72.03 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.841 1.257 . . . . 0.0 112.775 176.889 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.3 mp -126.71 9.5 7.03 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 114.158 1.17 . . . . 0.0 114.158 -175.378 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 16.4 m-80 56.04 59.8 3.55 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 125.932 1.693 . . . . 0.0 113.222 -178.541 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.452 HG13 ' HA ' ' A' ' 61' ' ' SER . 1.1 pt -128.41 173.83 12.81 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 C-N-CA 126.747 2.019 . . . . 0.0 111.679 -173.986 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.2 p -77.17 158.16 30.53 Favored 'General case' 0 N--CA 1.477 0.905 0 O-C-N 120.998 -1.064 . . . . 0.0 111.054 173.931 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 87.6 t -63.69 -28.88 45.89 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.909 0 O-C-N 121.632 -0.667 . . . . 0.0 111.25 172.752 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -77.63 -37.83 49.27 Favored 'General case' 0 N--CA 1.47 0.551 0 O-C-N 120.711 -1.243 . . . . 0.0 110.19 -179.757 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 5.0 tmtm? -65.01 -48.52 73.62 Favored 'General case' 0 C--O 1.225 -0.227 0 C-N-CA 125.489 1.515 . . . . 0.0 110.402 176.423 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -59.61 -42.9 93.67 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 126.107 1.763 . . . . 0.0 113.213 172.808 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 36.3 ttmt -74.16 -29.37 61.75 Favored 'General case' 0 CA--C 1.516 -0.342 0 C-N-CA 124.477 1.111 . . . . 0.0 111.838 -175.958 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -50.5 -45.98 56.86 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 118.415 0.552 . . . . 0.0 110.405 176.837 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 35.6 m-85 -64.58 -39.17 93.25 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.75 0.82 . . . . 0.0 111.559 -176.453 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 20.2 mt -71.91 -28.07 29.23 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.623 0 C-N-CA 124.594 1.157 . . . . 0.0 110.955 -179.952 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 25.4 mmmt -76.98 -39.93 48.69 Favored 'General case' 0 N--CA 1.466 0.33 0 O-C-N 120.878 -1.138 . . . . 0.0 112.251 178.032 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 24.2 p30 -97.09 -39.98 9.05 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 119.123 0.874 . . . . 0.0 112.63 -174.771 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 8.0 t -111.29 86.4 2.32 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.778 0.831 . . . . 0.0 111.566 -175.055 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 25.8 p30 -135.78 -40.75 0.69 Allowed 'General case' 0 CA--C 1.545 0.788 0 N-CA-C 116.121 1.897 . . . . 0.0 116.121 -173.805 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 1.2 mpt_? -90.17 -18.93 24.87 Favored 'General case' 0 N--CA 1.484 1.232 0 CA-C-N 119.737 1.153 . . . . 0.0 113.244 168.018 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 8.2 tt -65.56 -42.52 91.74 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 124.559 1.144 . . . . 0.0 111.899 179.302 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -92.88 22.15 35.59 Favored Glycine 0 CA--C 1.535 1.298 0 CA-C-O 119.202 -0.777 . . . . 0.0 114.623 179.873 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 42.1 ttt-85 -108.45 -71.93 0.74 Allowed 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 124.658 1.183 . . . . 0.0 111.786 -173.263 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 2.6 t -166.1 124.8 1.55 Allowed 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 124.977 1.311 . . . . 0.0 110.625 174.419 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 65.3 m-80 -144.79 162.0 37.86 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.647 1.579 . . . . 0.0 111.55 -177.902 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 54.75 38.44 30.12 Favored 'General case' 0 CA--C 1.553 1.08 0 C-N-CA 125.68 1.592 . . . . 0.0 113.622 179.9 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 12.0 tp -147.15 40.35 1.04 Allowed 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 125.084 1.353 . . . . 0.0 111.416 -175.655 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 54.3 tptt -85.24 -26.52 26.64 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 125.559 1.544 . . . . 0.0 111.473 -179.092 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 8.8 t -162.55 128.81 3.49 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 126.721 2.009 . . . . 0.0 109.662 176.895 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -142.72 2.14 0.38 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.743 0 C-N-CA 125.131 1.372 . . . . 0.0 114.621 -178.037 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 66.28 12.62 58.62 Favored Glycine 0 CA--C 1.541 1.677 0 O-C-N 120.734 -1.229 . . . . 0.0 114.229 -169.638 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . 0.276 3.4 mp 51.03 40.77 0.35 Allowed 'Isoleucine or valine' 0 CA--C 1.549 0.924 0 C-N-CA 127.307 2.243 . . . . 0.0 111.984 176.689 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER 52.56 27.12 4.79 Favored 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 126.622 1.969 . . . . 0.0 114.607 178.818 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 31.9 mt-30 -132.35 76.57 1.7 Allowed 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 125.54 1.536 . . . . 0.0 110.566 -170.308 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -121.44 -50.44 2.11 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.801 1.24 . . . . 0.0 112.549 -178.21 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -132.17 43.07 3.06 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 125.092 1.357 . . . . 0.0 112.291 -179.911 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 7.2 p -152.37 142.83 15.38 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.442 0 C-N-CA 124.916 1.286 . . . . 0.0 111.321 -173.369 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 43.9 m 53.17 28.26 6.84 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 125.859 1.664 . . . . 0.0 115.361 177.618 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 35.4 t -153.57 -49.42 0.09 Allowed 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 124.916 1.286 . . . . 0.0 112.145 -179.029 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 78.1 mtm -131.16 69.08 1.48 Allowed 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 125.401 1.48 . . . . 0.0 110.556 178.648 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -77.1 74.7 3.67 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 124.836 1.255 . . . . 0.0 110.318 176.376 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 56.27 -170.98 0.08 Allowed 'General case' 0 CA--C 1.554 1.133 0 C-N-CA 126.479 1.912 . . . . 0.0 113.899 -167.887 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -133.53 149.78 51.68 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 126.028 1.731 . . . . 0.0 111.712 178.757 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 23.1 t -94.55 133.07 38.57 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.546 1.139 . . . . 0.0 110.646 170.263 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 25.0 ptp -157.6 170.43 22.42 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 125.169 1.388 . . . . 0.0 112.324 -178.211 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 13.7 t -142.78 158.16 43.91 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 125.147 1.379 . . . . 0.0 111.024 167.234 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 17.3 t-105 . . . . . 0 C--O 1.254 1.298 0 C-N-CA 126.083 1.753 . . . . 0.0 112.637 -168.479 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.57 0 N-CA-C 111.557 -0.617 . . . . 0.0 111.557 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 77.4 p -146.85 158.0 43.8 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 125.065 1.346 . . . . 0.0 112.719 -178.466 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 7.6 m-70 -115.64 161.89 18.02 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 125.993 1.717 . . . . 0.0 111.164 174.918 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 42.0 ttm 53.0 51.72 15.27 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 125.286 1.435 . . . . 0.0 112.943 -177.777 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -151.3 169.16 22.64 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.826 1.25 . . . . 0.0 112.883 -175.141 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 40.9 m -121.67 152.24 39.57 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 125.974 1.71 . . . . 0.0 112.266 -172.704 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 98.8 mmm -108.94 145.75 34.93 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 125.407 1.483 . . . . 0.0 111.437 177.291 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 22.2 m-20 -122.42 102.18 39.79 Favored Pre-proline 0 CA--C 1.547 0.834 0 C-N-CA 125.225 1.41 . . . . 0.0 111.008 177.902 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 65.1 Cg_endo -86.29 2.82 7.18 Favored 'Trans proline' 0 C--N 1.35 0.607 0 C-N-CA 123.66 2.906 . . . . 0.0 114.559 -179.336 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 84.6 mt -111.32 41.69 1.81 Allowed 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 125.449 1.5 . . . . 0.0 113.176 -171.575 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -110.02 1.02 18.72 Favored 'General case' 0 N--CA 1.48 1.031 0 N-CA-C 114.985 1.476 . . . . 0.0 114.985 176.572 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -117.13 -55.51 2.33 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 124.142 0.977 . . . . 0.0 113.418 -168.443 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.9 pp -129.22 12.23 2.61 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 C-N-CA 126.238 1.815 . . . . 0.0 112.996 -171.975 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 11.7 tt -41.98 126.81 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.908 0 C-N-CA 125.569 1.547 . . . . 0.0 113.794 -176.854 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 49.5 t30 -153.93 138.93 17.26 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.497 1.519 . . . . 0.0 110.516 165.515 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 33.5 t0 -152.59 62.07 0.81 Allowed 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.765 1.226 . . . . 0.0 110.204 171.509 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 86.8 mt 54.95 106.57 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.543 0 C-N-CA 128.363 2.665 . . . . 0.0 112.153 -162.013 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 11.6 mmpt? 53.29 34.9 18.83 Favored 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 125.57 1.548 . . . . 0.0 113.438 175.611 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 61.3 mttp 48.95 48.12 20.94 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 126.728 2.011 . . . . 0.0 113.672 -175.481 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -58.95 118.77 6.16 Favored 'General case' 0 CA--C 1.545 0.762 0 O-C-N 121.569 -0.707 . . . . 0.0 111.571 177.126 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -155.54 171.78 19.36 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.857 1.663 . . . . 0.0 111.403 -177.353 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 1.9 t30 -135.71 93.04 2.89 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 124.74 1.216 . . . . 0.0 111.04 -179.078 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 18.8 m-20 -134.85 120.12 18.93 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 125.461 1.504 . . . . 0.0 109.953 174.454 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 37.9 m -137.53 41.21 2.39 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 124.594 1.157 . . . . 0.0 112.918 -167.834 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 79.82 74.11 1.11 Allowed Glycine 0 CA--C 1.531 1.076 0 C-N-CA 124.464 1.031 . . . . 0.0 112.56 -179.313 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 9.9 p -111.62 5.19 8.44 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.108 0 C-N-CA 126.119 1.768 . . . . 0.0 113.853 -170.776 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 3.8 m -106.94 143.75 34.58 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 124.677 1.191 . . . . 0.0 113.06 -162.55 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.584 HD23 ' H ' ' A' ' 22' ' ' LEU . 2.4 pt? -82.97 30.64 0.44 Allowed 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 126.235 1.814 . . . . 0.0 115.303 -178.157 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -143.63 145.88 33.01 Favored Pre-proline 0 CA--C 1.547 0.845 0 C-N-CA 125.311 1.445 . . . . 0.0 112.201 -174.745 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 95.0 Cg_endo -78.19 -39.65 0.43 Allowed 'Trans proline' 0 CA--C 1.538 0.722 0 C-N-CA 122.859 2.373 . . . . 0.0 113.003 -178.251 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 24.3 tp -154.45 56.58 0.7 Allowed 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.202 1.401 . . . . 0.0 110.282 -177.309 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 5.0 t 61.21 176.73 0.11 Allowed 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 124.916 1.286 . . . . 0.0 113.653 -165.374 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 72.7 t 62.35 148.99 0.09 OUTLIER Pre-proline 0 N--CA 1.481 1.096 0 C-N-CA 128.114 2.565 . . . . 0.0 113.062 -172.257 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -67.47 75.16 0.55 Allowed 'Trans proline' 0 CA--C 1.548 1.188 0 C-N-CA 123.357 2.704 . . . . 0.0 112.163 171.3 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 49.9 tptt 50.7 82.09 0.25 Allowed Pre-proline 0 CA--C 1.549 0.925 0 C-N-CA 129.291 3.036 . . . . 0.0 113.638 175.299 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_endo -71.33 130.41 17.38 Favored 'Trans proline' 0 C--N 1.35 0.649 0 C-N-CA 122.982 2.454 . . . . 0.0 113.66 -174.588 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 21.2 ptmt -47.96 147.91 1.88 Allowed 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 127.685 2.394 . . . . 0.0 115.48 -172.595 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 22.5 tp -137.69 148.95 46.12 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 126.255 1.822 . . . . 0.0 111.533 -172.052 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -139.9 74.18 1.46 Allowed 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 125.37 1.468 . . . . 0.0 111.788 174.641 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 25.2 tt0 -126.44 72.8 1.34 Allowed 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 125.291 1.436 . . . . 0.0 112.49 -171.623 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.1 mt -129.43 150.36 50.81 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 126.224 1.81 . . . . 0.0 111.081 179.649 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 23.2 t -73.45 166.34 23.4 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.452 0.701 . . . . 0.0 110.768 169.015 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -56.98 -44.29 82.52 Favored 'General case' 0 N--CA 1.476 0.83 0 O-C-N 120.343 -1.473 . . . . 0.0 113.106 -174.732 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 6.7 pt20 -76.3 -35.88 58.63 Favored 'General case' 0 N--CA 1.47 0.542 0 O-C-N 121.642 -0.661 . . . . 0.0 112.233 175.028 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 92.7 mt-30 -65.35 -38.98 91.75 Favored 'General case' 0 N--CA 1.464 0.271 0 O-C-N 121.595 -0.69 . . . . 0.0 111.21 179.254 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 40.9 ttmt -58.87 -41.44 87.06 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 124.522 1.129 . . . . 0.0 110.814 175.569 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 42.5 mt -71.24 -41.21 74.85 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.638 0 CA-C-O 118.358 -0.829 . . . . 0.0 111.219 177.911 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 37.9 mt -65.15 -41.44 91.77 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.964 0 CA-C-N 120.166 1.348 . . . . 0.0 110.363 177.416 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -60.72 -48.45 81.72 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.541 1.137 . . . . 0.0 110.737 176.763 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -66.04 -50.21 64.96 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 124.472 1.109 . . . . 0.0 112.141 178.608 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -65.56 -22.65 66.72 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 119.222 0.919 . . . . 0.0 113.104 -176.185 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.437 ' CE2' HG22 ' A' ' 55' ' ' ILE . 1.2 t80 -71.58 -58.96 3.02 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.228 1.011 . . . . 0.0 110.834 173.075 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 86.8 mt -63.84 -33.06 59.61 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.451 0 C-N-CA 126.794 2.038 . . . . 0.0 111.598 -179.861 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -71.04 -24.75 62.41 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.076 0.951 . . . . 0.0 112.704 176.234 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -90.78 -38.81 12.76 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.199 0.999 . . . . 0.0 112.517 175.767 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.3 m -110.24 -3.41 10.54 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.111 0 N-CA-C 114.167 1.173 . . . . 0.0 114.167 -173.577 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 85.21 23.11 49.75 Favored Glycine 0 N--CA 1.473 1.112 0 C-N-CA 125.219 1.39 . . . . 0.0 115.457 159.326 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 56.87 6.9 0.35 Allowed 'General case' 0 CA--C 1.554 1.128 0 C-N-CA 127.577 2.351 . . . . 0.0 115.181 -170.335 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 29.2 mt-30 -104.71 -17.69 14.55 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 125.545 1.538 . . . . 0.0 112.977 -173.005 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 44.5 m-80 -123.98 4.17 8.68 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.396 1.078 . . . . 0.0 113.634 -173.543 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.437 HG22 ' CE2' ' A' ' 46' ' ' TYR . 23.1 pt -75.28 155.26 6.22 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 C-N-CA 122.976 0.51 . . . . 0.0 111.291 173.377 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -137.62 142.85 41.23 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 124.487 1.115 . . . . 0.0 110.257 179.106 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -60.7 -27.45 67.89 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.741 0.816 . . . . 0.0 112.227 -179.867 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -65.93 -49.76 74.64 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.484 0 C-N-CA 125.606 1.562 . . . . 0.0 110.125 175.044 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 61.9 m -77.79 -43.41 30.73 Favored 'General case' 0 C--O 1.222 -0.387 0 C-N-CA 123.612 0.765 . . . . 0.0 109.962 -175.642 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 19.8 tp -61.39 -35.11 76.6 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 125.481 1.513 . . . . 0.0 112.171 174.322 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.459 ' HA ' HG13 ' A' ' 66' ' ' ILE . 30.3 t -54.96 -31.65 60.82 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 124.719 1.208 . . . . 0.0 112.513 168.501 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -100.57 -26.9 13.67 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 125.033 1.333 . . . . 0.0 114.162 -174.892 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 64.6 mmtt -61.44 -37.7 84.51 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 125.018 1.327 . . . . 0.0 111.773 174.974 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.2 mp -116.95 6.73 13.06 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 114.146 1.165 . . . . 0.0 114.146 -174.373 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 20.4 m-80 56.56 57.46 4.82 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 126.485 1.914 . . . . 0.0 113.23 -179.046 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.459 HG13 ' HA ' ' A' ' 61' ' ' SER . 1.6 pt -124.76 -170.93 0.67 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.693 0 C-N-CA 126.584 1.954 . . . . 0.0 110.917 -172.753 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.5 p -89.76 159.98 16.77 Favored 'General case' 0 N--CA 1.476 0.862 0 O-C-N 121.311 -0.868 . . . . 0.0 110.921 170.258 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 88.8 t -62.14 -30.18 48.2 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.893 0 C-N-CA 123.187 0.595 . . . . 0.0 111.307 172.641 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -79.73 -36.7 36.99 Favored 'General case' 0 N--CA 1.469 0.492 0 O-C-N 121.001 -1.062 . . . . 0.0 110.514 -179.055 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 4.6 tmtm? -68.08 -44.45 76.26 Favored 'General case' 0 C--O 1.222 -0.362 0 C-N-CA 124.421 1.088 . . . . 0.0 110.715 177.242 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -59.33 -46.87 87.42 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 125.046 1.338 . . . . 0.0 112.752 170.107 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 18.9 ttmm -67.67 -26.69 66.32 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 124.417 1.087 . . . . 0.0 111.523 -176.79 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -51.26 -42.14 60.86 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-N 118.171 0.441 . . . . 0.0 111.216 174.2 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 24.2 m-85 -70.39 -39.71 74.37 Favored 'General case' 0 C--O 1.225 -0.211 0 C-N-CA 124.479 1.111 . . . . 0.0 111.588 -177.474 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 52.6 mt -67.15 -24.79 32.58 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 C-N-CA 125.608 1.563 . . . . 0.0 111.185 179.292 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.428 ' HA ' ' HE2' ' A' ' 76' ' ' LYS . 10.6 mmpt? -95.23 -25.44 16.37 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 125.322 1.449 . . . . 0.0 113.177 178.46 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 42.6 m-20 -80.89 -41.93 22.28 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 125.305 1.442 . . . . 0.0 110.679 174.242 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 50.6 m -123.17 123.32 40.54 Favored 'General case' 0 N--CA 1.465 0.281 0 C-N-CA 123.818 0.847 . . . . 0.0 112.347 174.491 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 6.8 t-20 -148.15 -66.35 0.24 Allowed 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 113.377 0.88 . . . . 0.0 113.377 -171.142 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 23.6 mmt85 -96.49 -13.37 23.11 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 125.366 1.466 . . . . 0.0 113.779 -179.588 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 50.4 tp -87.94 -51.63 5.72 Favored 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 125.156 1.383 . . . . 0.0 113.186 -173.225 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 71.24 -62.2 1.05 Allowed Glycine 0 CA--C 1.539 1.576 0 N-CA-C 115.162 0.825 . . . . 0.0 115.162 -171.599 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 23.5 mmt85 -136.57 154.73 50.61 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 126.141 1.776 . . . . 0.0 112.6 -175.101 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 6.7 t -71.47 -14.5 62.15 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 125.608 1.563 . . . . 0.0 115.037 -174.744 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 71.5 m-80 -100.14 127.01 46.47 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.247 1.019 . . . . 0.0 111.979 -177.726 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 45.5 t30 -151.28 -70.51 0.17 Allowed 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.603 1.161 . . . . 0.0 111.611 169.465 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 12.0 tp -150.77 36.79 0.63 Allowed 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 125.883 1.673 . . . . 0.0 111.672 -177.606 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 39.9 ttpt -84.87 -27.56 26.61 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 125.937 1.695 . . . . 0.0 111.519 -179.065 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 8.9 t -157.41 127.44 6.25 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 126.465 1.906 . . . . 0.0 109.621 175.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -142.92 3.64 0.37 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.791 0 C-N-CA 125.645 1.578 . . . . 0.0 113.832 -178.672 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 65.74 12.69 57.45 Favored Glycine 0 CA--C 1.541 1.659 0 O-C-N 120.65 -1.281 . . . . 0.0 114.154 -168.355 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . 0.293 3.0 mp 50.66 33.3 0.2 Allowed 'Isoleucine or valine' 0 CA--C 1.552 1.034 0 C-N-CA 127.559 2.344 . . . . 0.0 112.11 179.245 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 8.0 tp 51.35 26.86 3.29 Favored 'General case' 0 CA--C 1.553 1.077 0 C-N-CA 126.638 1.975 . . . . 0.0 114.761 -179.034 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 6.3 pt20 -121.18 32.2 6.04 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 125.439 1.496 . . . . 0.0 113.397 -172.802 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 17.3 mm-40 -70.65 -21.97 62.55 Favored 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 114.083 1.142 . . . . 0.0 114.083 -175.192 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -143.41 79.9 1.65 Allowed 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 124.579 1.152 . . . . 0.0 111.2 178.614 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 11.6 p -151.1 154.77 7.95 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.715 0 C-N-CA 125.71 1.604 . . . . 0.0 110.578 177.099 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 25.5 m 63.76 -39.42 0.2 Allowed 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 128.301 2.64 . . . . 0.0 116.909 -179.333 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 49.8 m -86.01 -19.56 30.16 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.738 1.215 . . . . 0.0 114.122 -177.547 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 13.5 ttt -144.57 28.99 1.28 Allowed 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.986 1.315 . . . . 0.0 112.458 -177.731 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -83.54 59.68 5.25 Favored 'General case' 0 CA--C 1.55 0.943 0 C-N-CA 124.881 1.273 . . . . 0.0 111.624 -174.75 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -152.02 165.1 35.71 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 125.841 1.656 . . . . 0.0 112.442 -177.628 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 36.4 mtmm -128.56 151.73 49.11 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 125.848 1.659 . . . . 0.0 111.539 171.569 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 61.0 m -136.22 145.92 46.2 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 125.748 1.619 . . . . 0.0 111.003 178.228 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 64.5 mtm -139.56 165.5 27.08 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 125.589 1.556 . . . . 0.0 112.084 -174.955 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 12.2 t -137.09 162.72 32.59 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 125.386 1.474 . . . . 0.0 112.03 175.631 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 44.4 t-105 . . . . . 0 C--O 1.254 1.325 0 C-N-CA 126.126 1.771 . . . . 0.0 112.791 -168.509 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.606 0 N-CA-C 112.197 -0.361 . . . . 0.0 112.197 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 27.9 m -125.83 27.16 6.46 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 125.102 1.361 . . . . 0.0 113.53 -171.165 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 25.3 t60 -111.24 126.25 54.68 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 125.238 1.415 . . . . 0.0 111.699 -176.689 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 26.6 ttt -155.21 137.28 14.65 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 125.09 1.356 . . . . 0.0 111.336 -176.953 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -151.44 159.55 44.16 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 113.822 1.045 . . . . 0.0 113.822 175.937 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 86.8 p -153.43 154.79 35.1 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 125.769 1.628 . . . . 0.0 112.028 -178.3 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 60.6 mtt -143.74 63.41 1.35 Allowed 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 125.253 1.421 . . . . 0.0 111.231 -175.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -130.09 110.03 16.78 Favored Pre-proline 0 CA--C 1.55 0.949 0 C-N-CA 124.75 1.22 . . . . 0.0 111.79 -173.726 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 69.3 Cg_endo -85.28 -8.52 8.69 Favored 'Trans proline' 0 C--N 1.352 0.741 0 C-N-CA 123.51 2.807 . . . . 0.0 115.179 -176.609 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 96.6 mt -111.92 48.65 0.95 Allowed 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 126.261 1.825 . . . . 0.0 111.183 -177.757 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -118.29 1.52 11.86 Favored 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 114.26 1.208 . . . . 0.0 114.26 -179.836 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -119.12 -55.84 2.13 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 124.673 1.189 . . . . 0.0 112.879 -168.402 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.1 pp -128.98 14.32 2.72 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 C-N-CA 126.414 1.886 . . . . 0.0 112.762 -173.741 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 7.7 tt -46.54 105.31 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.1 0 C-N-CA 125.346 1.458 . . . . 0.0 112.4 179.79 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -154.71 -3.29 0.16 Allowed 'General case' 0 N--CA 1.478 0.929 0 N-CA-C 114.519 1.303 . . . . 0.0 114.519 -177.406 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -84.62 12.12 7.65 Favored 'General case' 0 CA--C 1.546 0.796 0 N-CA-C 115.157 1.54 . . . . 0.0 115.157 -162.383 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 7.1 tp -147.01 29.29 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 C-N-CA 125.73 1.612 . . . . 0.0 113.32 -173.707 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 2.3 tppp? -121.09 -46.78 2.3 Favored 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 114.824 1.416 . . . . 0.0 114.824 -179.085 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 95.2 mttt 44.58 45.34 7.83 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 126.267 1.827 . . . . 0.0 114.247 -173.473 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -106.0 132.69 51.79 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.707 1.203 . . . . 0.0 111.882 179.578 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -154.64 172.03 18.53 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 125.643 1.577 . . . . 0.0 111.967 177.083 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 62.8 t30 -144.04 158.18 43.87 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 125.569 1.547 . . . . 0.0 111.035 174.02 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 56.6 t0 -145.24 106.92 4.25 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.768 1.227 . . . . 0.0 110.975 178.224 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 74.2 m -133.18 103.53 6.05 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 125.399 1.48 . . . . 0.0 110.757 -179.167 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 147.51 -20.43 1.5 Allowed Glycine 0 N--CA 1.475 1.261 0 C-N-CA 124.635 1.112 . . . . 0.0 115.309 171.253 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 7.1 p -139.71 124.08 19.56 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 C-N-CA 125.171 1.388 . . . . 0.0 110.633 174.728 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -157.21 157.85 35.11 Favored 'General case' 0 N--CA 1.478 0.972 0 N-CA-C 113.955 1.094 . . . . 0.0 113.955 178.479 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.429 HD23 ' H ' ' A' ' 22' ' ' LEU . 1.0 OUTLIER -83.02 32.49 0.44 Allowed 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 126.618 1.967 . . . . 0.0 114.78 -179.207 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -119.79 91.53 45.26 Favored Pre-proline 0 CA--C 1.546 0.816 0 C-N-CA 124.49 1.116 . . . . 0.0 112.541 -166.833 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo -77.18 -35.08 1.85 Allowed 'Trans proline' 0 CA--C 1.541 0.832 0 C-N-CA 122.298 1.999 . . . . 0.0 113.784 -178.168 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 1.8 tt -153.83 68.98 0.78 Allowed 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 124.587 1.155 . . . . 0.0 111.117 -175.558 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 1.8 t 53.65 39.44 30.17 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 125.287 1.435 . . . . 0.0 114.662 177.448 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 7.4 p -154.93 142.89 14.24 Favored Pre-proline 0 N--CA 1.475 0.782 0 C-N-CA 125.796 1.639 . . . . 0.0 109.839 -175.088 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -77.37 66.11 7.92 Favored 'Trans proline' 0 CA--C 1.547 1.149 0 C-N-CA 123.607 2.871 . . . . 0.0 111.568 176.931 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 41.5 tptt 60.1 123.1 0.02 OUTLIER Pre-proline 0 N--CA 1.478 0.973 0 C-N-CA 130.061 3.344 . . . . 0.0 114.892 -172.151 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 93.1 Cg_endo -76.27 147.24 29.14 Favored 'Trans proline' 0 CA--C 1.54 0.792 0 C-N-CA 122.791 2.327 . . . . 0.0 111.826 177.059 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 9.7 mtpm? -74.0 139.55 44.86 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.562 1.145 . . . . 0.0 111.313 177.834 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 5.0 tp -143.51 129.4 19.46 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 126.171 1.788 . . . . 0.0 109.549 -176.595 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -141.41 61.22 1.48 Allowed 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.533 1.133 . . . . 0.0 110.66 -174.138 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -124.07 80.47 1.82 Allowed 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.957 1.303 . . . . 0.0 113.059 -170.924 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 49.7 mt -126.55 157.0 39.93 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 127.1 2.16 . . . . 0.0 111.045 175.736 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 70.7 m -72.98 164.8 26.14 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 122.891 0.476 . . . . 0.0 110.255 169.794 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -55.21 -44.2 75.18 Favored 'General case' 0 N--CA 1.478 0.932 0 O-C-N 120.76 -1.213 . . . . 0.0 112.797 -176.261 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 12.8 tt0 -69.7 -42.92 73.41 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 123.552 0.741 . . . . 0.0 111.19 176.187 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 83.9 mt-30 -63.71 -39.0 93.2 Favored 'General case' 0 CA--C 1.536 0.42 0 O-C-N 121.659 -0.65 . . . . 0.0 112.12 179.183 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -61.21 -40.11 92.77 Favored 'General case' 0 N--CA 1.468 0.475 0 O-C-N 121.06 -1.025 . . . . 0.0 110.903 173.719 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 51.6 mt -69.62 -39.51 78.36 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 CA-C-O 117.789 -1.101 . . . . 0.0 111.704 175.817 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 47.3 mt -64.03 -43.28 97.53 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.947 0 CA-C-N 121.01 1.732 . . . . 0.0 110.285 176.814 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -59.5 -47.49 85.3 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.056 0.943 . . . . 0.0 110.885 176.795 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -69.44 -49.17 57.51 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 124.335 1.054 . . . . 0.0 112.86 -179.714 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -64.29 -23.14 67.19 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-N 118.91 0.777 . . . . 0.0 112.96 -176.646 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.445 ' CE2' HG22 ' A' ' 55' ' ' ILE . 1.4 t80 -69.4 -59.55 2.92 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 124.206 1.002 . . . . 0.0 110.72 174.309 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 50.5 mt -60.74 -34.28 58.37 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.436 0 C-N-CA 125.309 1.444 . . . . 0.0 111.492 176.95 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -67.07 -21.04 65.91 Favored 'General case' 0 CA--C 1.546 0.807 0 O-C-N 121.269 -0.895 . . . . 0.0 113.271 176.379 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -98.03 -31.27 12.23 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 124.748 1.219 . . . . 0.0 113.309 178.308 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 5.9 m -122.36 -19.21 4.36 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 N-CA-C 114.139 1.163 . . . . 0.0 114.139 -173.857 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 83.43 147.1 7.21 Favored Glycine 0 CA--C 1.532 1.096 0 C-N-CA 124.964 1.269 . . . . 0.0 112.864 -172.128 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 12.3 tp -61.63 -13.25 20.66 Favored 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 125.244 1.418 . . . . 0.0 113.81 -175.05 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 7.6 pt20 -87.8 -16.26 34.62 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 127.143 2.177 . . . . 0.0 114.134 179.437 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 76.1 m-80 -111.15 -11.66 14.22 Favored 'General case' 0 N--CA 1.476 0.858 0 N-CA-C 114.513 1.301 . . . . 0.0 114.513 -178.138 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.445 HG22 ' CE2' ' A' ' 46' ' ' TYR . 43.8 pt -67.92 156.87 6.64 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.614 0 C-N-CA 123.83 0.852 . . . . 0.0 111.722 168.856 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.2 p -131.21 142.24 50.15 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 125.704 1.602 . . . . 0.0 109.645 174.215 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -63.17 -25.81 68.52 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 123.769 0.828 . . . . 0.0 112.27 177.573 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.9 mp -63.29 -49.61 82.31 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 C-N-CA 125.124 1.37 . . . . 0.0 109.601 173.055 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 97.2 m -75.26 -41.7 56.77 Favored 'General case' 0 C--O 1.224 -0.289 0 C-N-CA 123.929 0.892 . . . . 0.0 110.749 -177.846 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.9 tt -67.03 -32.63 73.97 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 124.627 1.171 . . . . 0.0 111.954 177.825 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.453 ' HA ' HG13 ' A' ' 66' ' ' ILE . 44.5 t -53.98 -33.33 56.73 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 124.791 1.236 . . . . 0.0 113.034 165.455 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -97.87 -22.79 16.16 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 125.071 1.348 . . . . 0.0 113.667 -175.166 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 7.9 mmtm -69.04 -37.95 78.86 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 124.792 1.237 . . . . 0.0 111.386 175.924 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.4 mp -107.52 -0.98 21.76 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 125.14 1.376 . . . . 0.0 114.057 -175.577 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 16.7 m-80 57.89 48.13 14.03 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 126.133 1.773 . . . . 0.0 112.603 -175.041 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.453 HG13 ' HA ' ' A' ' 61' ' ' SER . 15.3 pt -111.98 -159.19 0.14 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.632 0 C-N-CA 125.964 1.706 . . . . 0.0 110.992 -177.078 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 44.6 p -100.79 161.04 13.87 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 124.649 1.179 . . . . 0.0 111.323 168.084 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 59.6 t -61.59 -24.31 33.47 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 O-C-N 121.58 -0.7 . . . . 0.0 111.059 169.34 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -78.18 -37.02 46.73 Favored 'General case' 0 C--O 1.232 0.166 0 O-C-N 120.901 -1.124 . . . . 0.0 110.246 -178.15 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 33.5 mttm -64.71 -52.86 54.91 Favored 'General case' 0 C--N 1.347 0.498 0 CA-C-N 118.888 0.767 . . . . 0.0 110.568 167.395 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -58.99 -37.55 77.11 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.012 0.925 . . . . 0.0 112.773 -172.13 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 23.7 ttmm -77.57 -31.02 52.88 Favored 'General case' 0 CA--C 1.522 -0.123 0 C-N-CA 125.444 1.498 . . . . 0.0 111.889 177.777 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -57.09 -42.38 80.6 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 119.037 0.835 . . . . 0.0 111.531 179.596 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 39.3 m-85 -61.93 -51.5 67.88 Favored 'General case' 0 C--O 1.222 -0.389 0 C-N-CA 124.451 1.101 . . . . 0.0 109.641 178.481 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 71.3 mt -62.27 -25.07 36.69 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.875 0 C-N-CA 124.475 1.11 . . . . 0.0 111.517 -179.363 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 13.1 tppt? -87.48 -27.29 22.75 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 126.498 1.919 . . . . 0.0 113.28 -179.385 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 31.6 p30 -103.66 -33.87 8.81 Favored 'General case' 0 CA--C 1.546 0.825 0 CA-C-N 119.897 1.226 . . . . 0.0 113.401 177.88 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 11.8 p -83.67 -6.47 59.45 Favored 'General case' 0 N--CA 1.478 0.931 0 N-CA-C 115.545 1.683 . . . . 0.0 115.545 -171.086 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 24.8 p30 -67.3 9.13 0.24 Allowed 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 117.086 2.254 . . . . 0.0 117.086 -168.805 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 19.8 mmt85 -104.38 -3.5 24.03 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 125.958 1.703 . . . . 0.0 113.803 172.737 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -94.24 -47.36 6.66 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 124.858 1.263 . . . . 0.0 112.081 -177.816 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -88.55 159.47 29.51 Favored Glycine 0 CA--C 1.536 1.352 0 C-N-CA 124.346 0.974 . . . . 0.0 112.933 171.293 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER 64.85 33.4 10.11 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 126.061 1.744 . . . . 0.0 115.283 179.687 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 1.9 t -165.73 69.13 0.13 Allowed 'General case' 0 N--CA 1.478 0.965 0 CA-C-O 123.058 1.409 . . . . 0.0 109.906 179.48 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 66.1 m-80 -138.86 141.2 38.64 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 125.352 1.461 . . . . 0.0 110.451 176.605 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 22.6 t-20 -128.71 -16.03 4.31 Favored 'General case' 0 CA--C 1.547 0.844 0 N-CA-C 114.435 1.272 . . . . 0.0 114.435 -171.631 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 6.6 tp -137.9 30.44 2.52 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 124.07 0.948 . . . . 0.0 112.394 -163.824 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 60.6 tttp -83.91 -24.86 30.59 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 126.262 1.825 . . . . 0.0 111.63 -179.983 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 9.9 t -156.55 127.9 7.04 Favored 'General case' 0 C--O 1.234 0.245 0 C-N-CA 125.939 1.695 . . . . 0.0 109.732 173.976 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -142.68 2.03 0.39 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.788 0 C-N-CA 125.46 1.504 . . . . 0.0 114.014 -178.829 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 69.67 11.22 65.29 Favored Glycine 0 CA--C 1.539 1.563 0 O-C-N 120.797 -1.19 . . . . 0.0 114.627 -170.202 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . 0.267 4.2 mp 51.88 41.8 0.35 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.979 0 C-N-CA 126.814 2.046 . . . . 0.0 111.614 174.668 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 9.0 tp 52.91 24.56 3.42 Favored 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 126.632 1.973 . . . . 0.0 114.864 -179.406 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 34.4 mt-30 -133.99 55.83 1.88 Allowed 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.939 1.695 . . . . 0.0 111.479 -173.253 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -93.01 108.43 20.0 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.336 1.054 . . . . 0.0 110.302 172.835 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -133.62 65.22 1.59 Allowed 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 125.096 1.358 . . . . 0.0 111.307 -173.933 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 94.6 t -132.28 143.68 39.24 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.687 0 C-N-CA 125.061 1.344 . . . . 0.0 111.227 -179.569 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 82.8 p -147.4 -53.64 0.21 Allowed 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 173.138 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 22.6 t -149.99 113.32 4.93 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 124.634 1.173 . . . . 0.0 111.322 177.33 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 54.2 mtt 55.0 24.39 5.91 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 126.041 1.737 . . . . 0.0 115.145 -178.089 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 -82.62 67.48 8.69 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 125.33 1.452 . . . . 0.0 111.329 179.291 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -140.12 159.58 41.87 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 125.391 1.476 . . . . 0.0 112.6 -178.217 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -133.34 150.65 51.84 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 125.92 1.688 . . . . 0.0 111.993 177.901 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 51.1 m -83.6 164.42 19.75 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 125.014 1.326 . . . . 0.0 112.211 172.54 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 7.3 ttp -137.55 -175.79 4.19 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 125.421 1.489 . . . . 0.0 111.202 176.186 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 23.0 m -113.34 146.24 39.76 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 125.317 1.447 . . . . 0.0 110.872 179.71 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 27.6 m-90 . . . . . 0 C--O 1.252 1.203 0 C-N-CA 126.11 1.764 . . . . 0.0 112.372 -179.729 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.472 0 N-CA-C 111.451 -0.659 . . . . 0.0 111.451 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 49.0 m -98.47 153.02 18.91 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.937 1.295 . . . . 0.0 112.499 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 11.3 m-70 60.09 157.85 0.03 OUTLIER 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 127.028 2.131 . . . . 0.0 114.937 -168.983 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 9.9 tpt -88.0 60.17 5.7 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 124.895 1.278 . . . . 0.0 112.189 -173.552 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -146.19 157.81 43.84 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.838 1.255 . . . . 0.0 113.239 -177.721 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 20.1 t -153.3 160.5 42.73 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 126.082 1.753 . . . . 0.0 110.939 175.551 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -136.24 59.52 1.7 Allowed 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 124.882 1.273 . . . . 0.0 111.802 179.94 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 59.6 m-20 47.15 70.71 1.92 Allowed Pre-proline 0 CA--C 1.551 1.007 0 C-N-CA 127.006 2.122 . . . . 0.0 114.59 171.828 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 88.8 Cg_endo -69.35 0.39 5.4 Favored 'Trans proline' 0 CA--C 1.542 0.893 0 C-N-CA 124.21 3.274 . . . . 0.0 115.455 -173.634 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -134.93 33.14 3.17 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 126.408 1.883 . . . . 0.0 113.626 -178.65 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -99.58 -2.08 36.59 Favored 'General case' 0 N--CA 1.477 0.898 0 N-CA-C 114.407 1.262 . . . . 0.0 114.407 172.855 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -131.5 -60.78 0.93 Allowed 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 124.782 1.233 . . . . 0.0 113.458 -160.361 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.8 pp -106.45 9.66 9.35 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 C-N-CA 125.609 1.564 . . . . 0.0 112.937 -178.55 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 19.2 tt -46.11 129.06 2.45 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 124.632 1.173 . . . . 0.0 112.854 175.967 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -151.48 49.67 0.82 Allowed 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 125.683 1.593 . . . . 0.0 109.935 -179.646 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -115.71 15.56 16.46 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 124.347 1.059 . . . . 0.0 112.84 -170.378 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 15.9 tt -159.23 40.25 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 C-N-CA 126.692 1.997 . . . . 0.0 112.272 -175.815 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -139.92 -42.59 0.43 Allowed 'General case' 0 N--CA 1.476 0.85 0 N-CA-C 115.914 1.82 . . . . 0.0 115.914 -170.574 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 48.5 tttm -133.7 37.96 3.26 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 125.588 1.555 . . . . 0.0 112.624 -166.106 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -129.23 156.76 43.45 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 125.329 1.452 . . . . 0.0 112.95 -172.93 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -94.62 174.86 6.91 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 125.359 1.464 . . . . 0.0 113.405 179.081 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 28.4 m120 -129.26 67.52 1.43 Allowed 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.912 1.685 . . . . 0.0 111.511 -172.496 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 36.0 m-20 -85.24 39.95 0.8 Allowed 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 125.251 1.421 . . . . 0.0 113.554 -177.805 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 38.0 m -80.45 71.37 7.28 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.662 1.185 . . . . 0.0 112.816 -172.325 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 90.05 91.97 1.23 Allowed Glycine 0 CA--C 1.531 1.04 0 C-N-CA 125.693 1.615 . . . . 0.0 112.494 -178.255 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 12.8 p -146.95 137.05 17.21 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 C-N-CA 125.522 1.529 . . . . 0.0 111.073 178.358 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 10.9 m 63.11 164.01 0.11 Allowed 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 126.631 1.972 . . . . 0.0 114.568 -179.83 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -124.61 32.5 5.45 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 126.325 1.85 . . . . 0.0 114.235 -176.876 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -90.89 134.94 29.41 Favored Pre-proline 0 CA--C 1.549 0.934 0 C-N-CA 125.062 1.345 . . . . 0.0 112.339 -177.873 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -76.75 -27.73 7.03 Favored 'Trans proline' 0 CA--C 1.542 0.893 0 C-N-CA 122.953 2.435 . . . . 0.0 112.631 173.756 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 65.2 tp -149.04 -59.19 0.22 Allowed 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 125.268 1.427 . . . . 0.0 111.75 173.881 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 87.1 p -152.79 149.43 28.32 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 126.992 2.117 . . . . 0.0 110.466 178.942 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 62.6 t 59.88 144.74 0.06 OUTLIER Pre-proline 0 N--CA 1.484 1.246 0 C-N-CA 126.803 2.041 . . . . 0.0 112.155 -160.923 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 69.2 Cg_endo -68.24 75.64 0.71 Allowed 'Trans proline' 0 CA--C 1.545 1.06 0 C-N-CA 123.524 2.816 . . . . 0.0 111.907 175.234 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 57.44 90.64 0.09 OUTLIER Pre-proline 0 N--CA 1.475 0.783 0 C-N-CA 128.942 2.897 . . . . 0.0 112.555 -175.961 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo -79.11 137.76 13.85 Favored 'Trans proline' 0 CA--C 1.541 0.853 0 C-N-CA 122.644 2.229 . . . . 0.0 111.273 169.086 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 49.1 mtmt -69.71 117.41 11.28 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 123.79 0.836 . . . . 0.0 111.307 175.598 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.5 pp -148.47 149.31 31.45 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 125.537 1.535 . . . . 0.0 112.37 179.156 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 58.2 mt-10 -146.67 77.6 1.47 Allowed 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 125.725 1.61 . . . . 0.0 110.289 174.178 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -118.42 111.04 18.17 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.917 1.287 . . . . 0.0 111.988 -174.795 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 62.8 mt -141.71 161.79 37.07 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 127.364 2.266 . . . . 0.0 112.015 -178.878 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 66.0 m -71.33 164.3 26.01 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 123.295 0.638 . . . . 0.0 110.491 170.889 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -56.6 -44.72 81.4 Favored 'General case' 0 N--CA 1.477 0.901 0 O-C-N 120.633 -1.292 . . . . 0.0 112.974 -174.669 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 10.7 tt0 -68.82 -43.1 76.24 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 123.763 0.825 . . . . 0.0 110.989 175.752 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 85.0 mt-30 -61.13 -42.44 98.54 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 122.914 0.486 . . . . 0.0 111.968 178.349 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 40.1 ttmt -59.94 -39.07 84.26 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 124.073 0.949 . . . . 0.0 111.232 176.139 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 45.2 mt -68.26 -41.83 84.1 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 CA-C-O 118.121 -0.942 . . . . 0.0 111.386 174.386 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 48.3 mt -64.3 -44.66 97.32 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.982 0 CA-C-N 120.777 1.626 . . . . 0.0 110.48 178.555 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -56.02 -49.41 73.75 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 124.799 1.24 . . . . 0.0 110.195 176.54 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -65.52 -52.34 53.37 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.177 0.991 . . . . 0.0 113.024 178.185 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 19.6 mm-40 -62.24 -26.95 68.66 Favored 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 112.925 0.713 . . . . 0.0 112.925 -179.137 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -70.38 -55.28 9.48 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 123.576 0.751 . . . . 0.0 111.126 175.875 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 44.6 mt -60.57 -35.11 61.24 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.553 0 C-N-CA 124.958 1.303 . . . . 0.0 111.48 175.571 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -68.51 -21.46 64.58 Favored 'General case' 0 CA--C 1.545 0.765 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 176.761 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -95.92 -30.2 13.76 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.666 1.187 . . . . 0.0 113.029 178.963 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 6.0 m -122.27 -25.21 2.3 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.003 0 CA-C-N 119.651 1.114 . . . . 0.0 113.946 -173.966 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 94.07 142.38 12.19 Favored Glycine 0 CA--C 1.533 1.21 0 C-N-CA 125.303 1.43 . . . . 0.0 113.213 -172.694 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 55.0 tp -60.03 -16.85 34.43 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 127.046 2.139 . . . . 0.0 115.503 -171.879 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 7.9 pm0 -99.05 -10.15 22.97 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 127.732 2.413 . . . . 0.0 113.825 179.74 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 80.9 m-20 -107.18 -14.29 14.94 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.86 1.264 . . . . 0.0 114.111 178.907 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 26.5 pt -63.27 157.14 4.39 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 C-N-CA 123.267 0.627 . . . . 0.0 111.276 164.679 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -130.09 145.93 51.72 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.523 1.129 . . . . 0.0 110.035 175.28 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -61.73 -26.82 68.29 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 123.773 0.829 . . . . 0.0 112.271 177.288 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.9 mp -69.99 -40.08 78.18 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.454 0 C-N-CA 125.993 1.717 . . . . 0.0 110.519 175.857 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 90.8 m -80.78 -41.31 23.63 Favored 'General case' 0 C--O 1.223 -0.292 0 O-C-N 121.64 -0.663 . . . . 0.0 109.522 179.209 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 17.0 tp -64.77 -35.65 81.78 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 125.014 1.326 . . . . 0.0 111.946 177.026 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.441 ' HA ' HG13 ' A' ' 66' ' ' ILE . 60.2 p -60.38 -24.62 65.26 Favored 'General case' 0 N--CA 1.476 0.841 0 CA-C-N 118.893 0.77 . . . . 0.0 113.006 170.449 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -100.94 -31.03 11.32 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 125.3 1.44 . . . . 0.0 114.107 -177.119 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 54.9 mmtt -63.76 -34.51 78.06 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 125.331 1.452 . . . . 0.0 111.582 177.875 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.4 mp -117.67 4.23 12.33 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 124.987 1.315 . . . . 0.0 114.415 -175.165 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 21.6 m-80 57.58 60.96 2.62 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 126.276 1.831 . . . . 0.0 113.375 -178.591 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.441 HG13 ' HA ' ' A' ' 61' ' ' SER . 1.1 pt -133.48 174.8 12.64 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.843 0 C-N-CA 126.771 2.028 . . . . 0.0 111.946 -171.536 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.3 p -76.72 157.9 31.36 Favored 'General case' 0 N--CA 1.478 0.945 0 O-C-N 121.096 -1.003 . . . . 0.0 111.352 173.082 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 89.5 t -62.92 -28.47 45.09 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 CA-C-O 118.838 -0.601 . . . . 0.0 111.421 173.637 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 65.3 mm-40 -81.75 -36.62 28.34 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 120.307 1.412 . . . . 0.0 110.825 -178.872 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 5.2 tmtm? -62.6 -44.67 95.73 Favored 'General case' 0 N--CA 1.464 0.268 0 C-N-CA 125.456 1.503 . . . . 0.0 110.348 175.249 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -66.25 -48.74 69.51 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.989 1.716 . . . . 0.0 112.757 173.927 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -71.12 -27.95 63.95 Favored 'General case' 0 CA--C 1.515 -0.376 0 O-C-N 120.976 -1.077 . . . . 0.0 111.673 -173.388 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -60.59 -36.6 78.93 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 119.929 -0.708 . . . . 0.0 111.306 178.029 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 23.9 m-85 -61.28 -41.22 96.6 Favored 'General case' 0 N--CA 1.463 0.2 0 O-C-N 121.312 -0.867 . . . . 0.0 111.742 174.063 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 61.1 mt -70.44 -29.12 37.51 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.643 0 C-N-CA 124.683 1.193 . . . . 0.0 110.903 179.598 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 7.3 tptm -76.49 -35.16 58.54 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 125.169 1.388 . . . . 0.0 111.862 174.707 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 96.0 m-20 -85.14 -53.43 5.27 Favored 'General case' 0 N--CA 1.462 0.153 0 C-N-CA 126.405 1.882 . . . . 0.0 110.338 -172.775 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 61.2 m -99.43 107.67 19.95 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 124.96 1.304 . . . . 0.0 111.317 172.177 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 5.0 t-20 -144.34 119.97 10.45 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.133 0.973 . . . . 0.0 111.015 -171.001 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 7.1 mpt_? 55.72 -23.33 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.706 0 C-N-CA 128.327 2.651 . . . . 0.0 117.259 -169.052 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 6.9 tt -86.99 -39.97 15.19 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 126.545 1.938 . . . . 0.0 112.765 -172.32 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 70.07 -133.29 24.35 Favored Glycine 0 CA--C 1.531 1.085 0 C-N-CA 123.362 0.506 . . . . 0.0 112.46 -175.501 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.08 -56.63 4.1 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.826 0.85 . . . . 0.0 109.133 174.663 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 1.7 t -169.0 124.7 0.9 Allowed 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 126.005 1.722 . . . . 0.0 109.664 172.417 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 52.1 m-80 -138.79 151.77 47.34 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 124.935 1.294 . . . . 0.0 111.935 178.928 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 53.5 t30 -147.18 174.11 11.9 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 126.233 1.813 . . . . 0.0 110.486 -177.653 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 8.6 tp 60.02 28.59 18.15 Favored 'General case' 0 CA--C 1.551 0.986 0 C-N-CA 125.329 1.451 . . . . 0.0 113.85 179.29 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 20.0 ptmt -129.21 2.52 5.18 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 126.027 1.731 . . . . 0.0 114.68 -176.939 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 12.6 t -156.76 131.15 8.63 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 125.41 1.484 . . . . 0.0 109.966 -179.629 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -136.69 6.17 0.85 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.812 0 C-N-CA 126.358 1.863 . . . . 0.0 112.906 179.15 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 66.52 7.25 39.34 Favored Glycine 0 CA--C 1.539 1.581 0 O-C-N 120.792 -1.192 . . . . 0.0 114.709 -170.689 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 13.7 mm 52.19 36.6 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.008 0 C-N-CA 126.894 2.078 . . . . 0.0 111.623 178.062 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 54.66 25.36 6.33 Favored 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 127.004 2.121 . . . . 0.0 114.601 179.914 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 37.2 mt-30 -133.67 23.31 3.98 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 125.988 1.715 . . . . 0.0 112.626 -172.463 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -138.6 142.83 39.15 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 125.459 1.504 . . . . 0.0 111.403 -178.636 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 54.18 65.82 1.4 Allowed 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 126.094 1.758 . . . . 0.0 113.594 -179.225 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 21.0 t -130.17 72.49 0.43 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 C-N-CA 125.166 1.387 . . . . 0.0 110.428 179.272 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 45.4 t -163.82 -68.32 0.04 OUTLIER 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.766 0.826 . . . . 0.0 113.013 172.638 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 17.1 t -74.05 -31.92 63.09 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 123.611 0.765 . . . . 0.0 112.786 -175.403 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 97.2 mtp -127.29 137.25 52.8 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 125.949 1.7 . . . . 0.0 109.556 169.524 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 17.7 tt0 -153.85 41.66 0.52 Allowed 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 124.616 1.166 . . . . 0.0 111.046 -177.317 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 52.41 -141.87 0.8 Allowed 'General case' 0 CA--C 1.552 1.045 0 C-N-CA 125.233 1.413 . . . . 0.0 112.253 -165.694 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 66.9 mttm -123.37 154.42 38.99 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 125.777 1.631 . . . . 0.0 111.512 177.294 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 49.1 m -121.77 156.73 32.54 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 125.566 1.546 . . . . 0.0 112.407 -176.486 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 1.8 pmm? -142.29 161.39 38.15 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 125.583 1.553 . . . . 0.0 112.317 177.117 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 3.6 m -142.89 144.27 32.39 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 124.867 1.267 . . . . 0.0 110.371 172.453 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 8.1 t-105 . . . . . 0 C--O 1.253 1.276 0 C-N-CA 125.23 1.412 . . . . 0.0 112.716 -174.216 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.574 0 N-CA-C 111.893 -0.483 . . . . 0.0 111.893 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 19.6 m -66.93 -35.4 79.9 Favored 'General case' 0 N--CA 1.477 0.923 0 N-CA-C 114.639 1.348 . . . . 0.0 114.639 -169.245 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 28.3 t60 -151.96 105.7 3.12 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 124.745 1.218 . . . . 0.0 110.571 178.666 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 35.1 ttp -148.18 40.74 0.96 Allowed 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 124.16 0.984 . . . . 0.0 113.0 -177.769 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -154.75 148.35 25.31 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 113.066 0.765 . . . . 0.0 113.066 -178.593 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 30.4 t -156.46 130.69 8.64 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 125.401 1.48 . . . . 0.0 110.641 175.242 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 16.9 ttt -151.21 19.83 0.76 Allowed 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 124.636 1.174 . . . . 0.0 112.716 -177.046 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 11.6 t0 -138.97 121.68 10.56 Favored Pre-proline 0 CA--C 1.55 0.981 0 O-C-N 120.626 -1.296 . . . . 0.0 112.344 -170.053 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_endo -83.83 -2.32 10.26 Favored 'Trans proline' 0 C--N 1.352 0.726 0 C-N-CA 123.768 2.979 . . . . 0.0 114.971 179.054 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 75.7 mt -107.54 41.59 1.48 Allowed 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.867 1.667 . . . . 0.0 112.173 -176.82 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -106.91 0.83 24.13 Favored 'General case' 0 N--CA 1.476 0.873 0 N-CA-C 114.779 1.4 . . . . 0.0 114.779 178.345 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -120.05 -56.87 1.98 Allowed 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 124.396 1.079 . . . . 0.0 113.328 -167.975 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.0 pp -129.1 14.7 2.67 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.925 0 C-N-CA 126.176 1.791 . . . . 0.0 112.988 -171.888 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 14.1 tt -41.08 130.4 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.917 0 C-N-CA 125.496 1.518 . . . . 0.0 112.851 177.824 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 35.3 t30 -141.71 0.63 1.45 Allowed 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 115.332 1.604 . . . . 0.0 115.332 -176.881 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -85.1 11.25 10.08 Favored 'General case' 0 CA--C 1.546 0.805 0 N-CA-C 114.601 1.334 . . . . 0.0 114.601 -173.777 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 13.5 tt -147.97 27.17 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.913 0 C-N-CA 125.533 1.533 . . . . 0.0 113.694 -170.989 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 58.5 mtmt -122.98 -40.62 2.4 Favored 'General case' 0 N--CA 1.477 0.909 0 N-CA-C 115.311 1.597 . . . . 0.0 115.311 179.392 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 22.0 ttmm -146.75 144.74 29.61 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 125.126 1.37 . . . . 0.0 112.358 -177.755 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -109.75 60.47 0.6 Allowed 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 125.823 1.649 . . . . 0.0 110.869 179.224 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -127.43 7.29 6.38 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 125.06 1.344 . . . . 0.0 114.281 -175.393 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.5 t-20 -97.67 116.1 29.23 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 124.543 1.137 . . . . 0.0 111.645 -177.327 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 20.2 m-20 -144.69 134.61 23.81 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 125.918 1.687 . . . . 0.0 110.483 176.645 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 21.4 t -152.47 101.33 2.65 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 124.145 0.978 . . . . 0.0 111.081 173.652 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 69.37 35.09 75.5 Favored Glycine 0 N--CA 1.473 1.108 0 C-N-CA 124.543 1.068 . . . . 0.0 115.742 171.395 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 92.9 t -88.86 142.73 12.47 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.385 0 C-N-CA 125.101 1.361 . . . . 0.0 110.985 -177.863 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 2.8 t -130.38 -177.24 4.24 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 125.649 1.58 . . . . 0.0 111.809 174.503 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -74.95 25.01 0.09 Allowed 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 116.895 2.183 . . . . 0.0 116.895 -173.885 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -90.37 131.09 39.43 Favored Pre-proline 0 CA--C 1.55 0.953 0 C-N-CA 126.126 1.77 . . . . 0.0 112.512 -172.163 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -79.27 -38.69 0.39 Allowed 'Trans proline' 0 CA--C 1.541 0.84 0 C-N-CA 122.629 2.219 . . . . 0.0 112.885 178.055 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 24.7 tp -156.35 92.34 1.32 Allowed 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 125.441 1.496 . . . . 0.0 110.141 173.245 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 24.3 p 54.69 28.54 10.22 Favored 'General case' 0 N--CA 1.475 0.81 0 N-CA-C 116.949 2.203 . . . . 0.0 116.949 166.839 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 5.8 p -152.06 146.12 18.27 Favored Pre-proline 0 N--CA 1.476 0.845 0 C-N-CA 125.964 1.706 . . . . 0.0 110.623 -170.686 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_endo -75.59 60.71 5.94 Favored 'Trans proline' 0 CA--C 1.548 1.21 0 C-N-CA 123.933 3.089 . . . . 0.0 112.275 175.836 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 60.66 124.91 0.02 OUTLIER Pre-proline 0 N--CA 1.479 0.997 0 C-N-CA 129.052 2.941 . . . . 0.0 114.372 -172.873 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -84.03 165.92 13.07 Favored 'Trans proline' 0 CA--C 1.541 0.864 0 C-N-CA 123.381 2.721 . . . . 0.0 112.586 175.445 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 21.8 ptmt -99.83 126.99 46.02 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 126.038 1.735 . . . . 0.0 109.56 166.387 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 8.1 mp -118.38 150.29 39.78 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 124.832 1.253 . . . . 0.0 112.564 178.821 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -147.27 45.77 1.14 Allowed 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.632 1.573 . . . . 0.0 111.479 173.339 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -138.56 102.62 4.65 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 125.638 1.575 . . . . 0.0 112.224 -171.553 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.9 mt -129.39 154.87 46.5 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 128.548 2.739 . . . . 0.0 109.227 167.796 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 23.3 t -71.95 163.46 27.81 Favored 'General case' 0 N--CA 1.48 1.052 0 O-C-N 121.878 -0.514 . . . . 0.0 110.26 170.253 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -56.26 -45.48 80.05 Favored 'General case' 0 N--CA 1.477 0.924 0 O-C-N 120.257 -1.527 . . . . 0.0 112.863 -174.175 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 9.4 tt0 -71.18 -43.15 68.03 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 123.526 0.73 . . . . 0.0 111.553 175.675 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 89.3 mt-30 -61.29 -38.28 86.21 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 123.302 0.641 . . . . 0.0 111.885 178.587 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 41.2 ttmt -62.91 -44.23 96.65 Favored 'General case' 0 N--CA 1.464 0.249 0 C-N-CA 124.86 1.264 . . . . 0.0 110.731 175.732 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 49.8 mt -65.65 -43.97 93.7 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 CA-C-O 118.45 -0.786 . . . . 0.0 110.924 177.117 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 52.6 mt -63.97 -46.44 94.01 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 CA-C-N 120.078 1.308 . . . . 0.0 110.299 179.296 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -59.04 -48.9 79.91 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 125.14 1.376 . . . . 0.0 110.931 178.263 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -63.82 -53.04 56.98 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 124.954 1.301 . . . . 0.0 112.185 177.096 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 17.0 mm-40 -60.13 -30.45 69.3 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 119.088 0.858 . . . . 0.0 112.5 179.476 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.404 ' CD2' ' HE2' ' A' ' 63' ' ' LYS . 1.4 t80 -66.2 -58.83 4.53 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 118.988 0.813 . . . . 0.0 110.705 175.592 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 70.6 mt -62.72 -35.02 68.72 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.329 0 C-N-CA 126.573 1.949 . . . . 0.0 111.622 179.884 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -74.65 -29.42 61.25 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.05 0.94 . . . . 0.0 112.415 178.98 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -82.69 -40.0 21.23 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.778 0.831 . . . . 0.0 112.183 174.621 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.8 m -104.15 -12.55 9.15 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.086 0 N-CA-C 114.386 1.254 . . . . 0.0 114.386 -173.612 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 91.59 27.85 16.16 Favored Glycine 0 CA--C 1.534 1.253 0 C-N-CA 125.108 1.337 . . . . 0.0 115.805 164.589 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 56.13 9.08 0.45 Allowed 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 127.427 2.291 . . . . 0.0 115.027 -173.9 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 2.5 pt20 -117.92 -7.96 10.84 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 125.798 1.639 . . . . 0.0 113.435 -167.087 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 67.3 m-80 -123.28 -1.4 8.68 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 125.094 1.358 . . . . 0.0 113.305 178.339 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 21.7 pt -72.16 150.39 8.7 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 CA-C-O 121.016 0.436 . . . . 0.0 111.417 177.734 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -138.04 143.61 40.62 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 124.448 1.099 . . . . 0.0 109.398 177.687 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -61.39 -26.62 67.97 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 118.787 0.722 . . . . 0.0 112.468 -179.418 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -66.96 -42.99 89.48 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 C-N-CA 125.654 1.582 . . . . 0.0 110.548 174.601 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 81.6 m -79.77 -46.46 16.94 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 123.681 0.793 . . . . 0.0 109.192 -177.466 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 17.3 tp -62.59 -34.69 77.5 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.561 1.544 . . . . 0.0 112.511 177.563 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.455 ' HA ' HG13 ' A' ' 66' ' ' ILE . 60.2 p -61.95 -25.2 67.46 Favored 'General case' 0 N--CA 1.475 0.81 0 N-CA-C 113.222 0.823 . . . . 0.0 113.222 171.667 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -101.55 -24.67 14.1 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 125.434 1.493 . . . . 0.0 114.115 -178.112 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.404 ' HE2' ' CD2' ' A' ' 46' ' ' TYR . 21.0 mmmt -65.74 -34.87 79.19 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.9 1.28 . . . . 0.0 111.497 172.82 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 49.6 mt -115.91 -1.1 12.64 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 125.931 1.692 . . . . 0.0 113.52 -169.319 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 26.7 m-80 57.0 61.63 2.52 Favored 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 126.683 1.993 . . . . 0.0 113.542 -177.342 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.455 HG13 ' HA ' ' A' ' 61' ' ' SER . 0.6 OUTLIER -136.17 178.18 5.4 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 C-N-CA 127.118 2.167 . . . . 0.0 111.548 -171.838 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -78.25 159.13 28.67 Favored 'General case' 0 N--CA 1.478 0.975 0 O-C-N 121.047 -1.033 . . . . 0.0 111.392 172.266 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 98.6 t -63.49 -31.44 52.91 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.955 0 O-C-N 121.605 -0.685 . . . . 0.0 111.187 172.808 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -78.4 -35.95 46.44 Favored 'General case' 0 N--CA 1.471 0.584 0 O-C-N 120.895 -1.128 . . . . 0.0 110.065 -177.353 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 5.4 tmtm? -65.24 -49.96 67.65 Favored 'General case' 0 C--O 1.223 -0.292 0 C-N-CA 125.316 1.447 . . . . 0.0 110.379 174.255 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -58.53 -42.9 88.81 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 125.036 1.334 . . . . 0.0 112.605 174.23 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 34.5 ttmt -71.73 -28.13 63.46 Favored 'General case' 0 CA--C 1.519 -0.219 0 CA-C-O 118.076 -0.964 . . . . 0.0 111.577 -176.586 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -50.58 -44.6 56.89 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 118.973 0.806 . . . . 0.0 111.145 175.849 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 40.3 m-85 -65.54 -38.1 88.63 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.815 0.846 . . . . 0.0 110.782 -177.191 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 35.5 mt -69.39 -27.63 35.13 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.674 0 C-N-CA 124.916 1.286 . . . . 0.0 110.724 176.967 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 45.1 mttt -79.11 -31.88 44.35 Favored 'General case' 0 N--CA 1.47 0.563 0 O-C-N 120.393 -1.442 . . . . 0.0 114.553 176.51 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 24.7 p30 -105.09 -45.58 4.49 Favored 'General case' 0 N--CA 1.471 0.625 0 CA-C-N 119.844 1.202 . . . . 0.0 112.351 -176.155 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 2.5 t -73.01 -16.1 61.51 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 115.326 1.602 . . . . 0.0 115.326 -176.326 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 8.6 p30 -62.94 -18.25 62.92 Favored 'General case' 0 N--CA 1.478 0.931 0 O-C-N 120.121 -1.612 . . . . 0.0 114.957 -176.15 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 1.6 mpt_? -66.59 -13.48 61.12 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 125.231 1.412 . . . . 0.0 113.508 174.746 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 8.0 tp -70.86 -31.85 68.67 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 124.796 1.239 . . . . 0.0 113.306 178.5 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -85.08 -163.72 37.52 Favored Glycine 0 CA--C 1.541 1.695 0 C-N-CA 124.189 0.899 . . . . 0.0 114.55 -179.367 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 74.6 mtp85 -118.32 -101.68 0.43 Allowed 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 125.644 1.578 . . . . 0.0 111.605 177.966 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 5.7 t -155.57 120.2 4.71 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 125.592 1.557 . . . . 0.0 110.438 -179.124 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 64.9 m-80 -143.25 18.79 1.91 Allowed 'General case' 0 CA--C 1.553 1.059 0 C-N-CA 124.508 1.123 . . . . 0.0 113.654 -174.207 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 53.7 t30 -108.29 16.33 23.27 Favored 'General case' 0 CA--C 1.552 1.039 0 C-N-CA 125.166 1.386 . . . . 0.0 113.78 -169.886 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 9.7 mt -145.24 163.17 35.25 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 126.455 1.902 . . . . 0.0 111.194 -173.262 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 54.2 pttt -121.94 10.89 10.24 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 126.587 1.955 . . . . 0.0 113.362 -176.838 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 13.7 t -146.3 124.83 12.42 Favored 'General case' 0 C--O 1.233 0.219 0 C-N-CA 125.407 1.483 . . . . 0.0 109.603 174.378 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -139.37 10.46 0.62 Allowed 'Isoleucine or valine' 0 CA--C 1.548 0.867 0 C-N-CA 125.9 1.68 . . . . 0.0 113.032 -175.584 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 77.72 -12.5 15.88 Favored Glycine 0 N--CA 1.477 1.381 0 O-C-N 120.784 -1.198 . . . . 0.0 114.497 -166.326 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 4.9 mp 54.53 93.58 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.549 0 C-N-CA 127.059 2.144 . . . . 0.0 109.788 -163.696 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 74.1 mt -60.98 94.58 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.957 1.303 . . . . 0.0 112.148 -175.402 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 84.9 mt-30 -111.73 -69.11 0.89 Allowed 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 125.196 1.398 . . . . 0.0 112.22 -179.581 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 2.7 pp20? -153.68 162.43 41.26 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 125.124 1.37 . . . . 0.0 112.234 178.268 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -147.12 57.12 1.14 Allowed 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 124.155 0.982 . . . . 0.0 111.939 175.617 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 26.5 t -134.87 133.54 53.85 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.94 0 C-N-CA 124.126 0.97 . . . . 0.0 112.14 -179.361 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 9.2 t -114.38 78.37 1.15 Allowed 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 125.015 1.326 . . . . 0.0 111.294 177.025 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 6.1 t 47.37 74.52 0.16 Allowed 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 126.848 2.059 . . . . 0.0 114.364 175.821 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 91.4 mtp 54.21 61.74 2.9 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 125.743 1.617 . . . . 0.0 113.485 -176.032 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -79.05 47.31 0.76 Allowed 'General case' 0 CA--C 1.553 1.07 0 C-N-CA 125.126 1.371 . . . . 0.0 112.037 174.808 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -147.74 155.73 42.01 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 126.165 1.786 . . . . 0.0 112.02 -176.213 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 36.6 mtmm -107.78 96.03 6.1 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 125.397 1.479 . . . . 0.0 111.002 -176.976 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 48.8 m -137.59 60.24 1.64 Allowed 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 125.313 1.445 . . . . 0.0 111.449 -174.456 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 28.5 ptm -139.51 158.63 43.8 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 124.901 1.281 . . . . 0.0 113.178 -178.418 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 3.3 m -144.77 145.26 31.58 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 125.302 1.441 . . . . 0.0 110.352 172.214 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 15.6 t-105 . . . . . 0 C--O 1.254 1.3 0 C-N-CA 124.936 1.294 . . . . 0.0 112.825 -176.563 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.482 0 N-CA-C 111.242 -0.743 . . . . 0.0 111.242 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 33.6 t -153.04 -52.63 0.11 Allowed 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 124.275 1.03 . . . . 0.0 112.205 176.106 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 35.2 t-80 -147.74 159.34 43.91 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 125.339 1.456 . . . . 0.0 111.498 176.435 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 25.0 ttp -102.3 15.06 30.27 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 115.106 1.521 . . . . 0.0 115.106 -169.04 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -150.51 155.93 40.45 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 114.85 1.426 . . . . 0.0 114.85 -176.62 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 58.3 m -141.43 118.97 11.59 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 127.06 2.144 . . . . 0.0 108.8 -178.368 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 83.6 mtp -139.62 51.25 1.75 Allowed 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.735 1.214 . . . . 0.0 111.175 -167.338 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -119.99 148.25 46.31 Favored Pre-proline 0 CA--C 1.545 0.758 0 C-N-CA 125.552 1.541 . . . . 0.0 112.194 -170.852 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -69.24 -19.08 39.08 Favored 'Trans proline' 0 C--N 1.35 0.632 0 C-N-CA 123.284 2.656 . . . . 0.0 114.745 -175.04 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.44 HD23 ' H ' ' A' ' 4' ' ' LEU . 1.2 pt? -95.11 12.41 28.77 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 126.271 1.828 . . . . 0.0 114.343 -179.585 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -71.05 -8.04 50.62 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 115.189 1.551 . . . . 0.0 115.189 -176.809 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -116.72 -63.31 1.46 Allowed 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 124.796 1.238 . . . . 0.0 113.243 -163.631 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.3 pp -103.15 -18.09 6.79 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.85 0 C-N-CA 124.72 1.208 . . . . 0.0 113.053 -175.875 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . 0.287 11.3 tt 35.99 48.81 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.167 0 C-N-CA 127.301 2.24 . . . . 0.0 116.332 170.903 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -126.33 88.9 2.92 Favored 'General case' 0 CA--C 1.542 0.658 0 O-C-N 120.844 -1.16 . . . . 0.0 111.911 -177.136 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -138.17 79.98 1.77 Allowed 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.84 1.256 . . . . 0.0 110.813 -178.707 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . 0.358 9.5 tt 50.31 26.23 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.205 0 C-N-CA 127.708 2.403 . . . . 0.0 115.124 179.458 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 3.8 ttpt -124.72 -21.69 4.74 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 124.949 1.299 . . . . 0.0 114.462 -178.316 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 80.8 tttt -128.69 68.93 1.38 Allowed 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 125.525 1.53 . . . . 0.0 111.727 -176.26 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 4.1 tm-20 -146.87 130.34 16.77 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 125.137 1.375 . . . . 0.0 109.886 -178.063 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -151.32 153.61 35.14 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.546 1.138 . . . . 0.0 112.96 -179.126 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 30.1 t30 -94.61 154.41 17.38 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.305 1.442 . . . . 0.0 112.576 179.859 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 31.5 m-20 -80.0 54.74 1.96 Allowed 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 125.472 1.509 . . . . 0.0 112.511 175.817 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 49.0 m -79.0 98.95 6.65 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.619 1.168 . . . . 0.0 111.803 -177.13 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 75.53 98.31 0.13 Allowed Glycine 0 CA--C 1.535 1.305 0 C-N-CA 125.319 1.438 . . . . 0.0 113.111 -179.376 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 58.2 t -132.68 131.14 59.73 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.961 0 C-N-CA 125.085 1.354 . . . . 0.0 110.482 -177.551 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.402 HG22 ' H ' ' A' ' 22' ' ' LEU . 0.2 OUTLIER 52.79 -154.8 0.2 Allowed 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 125.737 1.615 . . . . 0.0 112.694 -178.39 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.402 ' H ' HG22 ' A' ' 21' ' ' THR . 44.9 mt -112.17 24.47 12.56 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 126.411 1.885 . . . . 0.0 112.35 -175.818 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -153.49 98.56 2.68 Favored Pre-proline 0 CA--C 1.55 0.965 0 C-N-CA 125.523 1.529 . . . . 0.0 111.098 -166.068 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 90.3 Cg_endo -78.34 -15.94 13.92 Favored 'Trans proline' 0 CA--C 1.543 0.934 0 C-N-CA 123.228 2.619 . . . . 0.0 113.124 178.722 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.424 ' HG ' ' H ' ' A' ' 26' ' ' SER . 6.7 tp -144.51 -157.94 0.84 Allowed 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 127.107 2.163 . . . . 0.0 109.083 178.541 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.424 ' H ' ' HG ' ' A' ' 25' ' ' LEU . 57.3 p -75.12 35.61 0.11 Allowed 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 126.74 2.016 . . . . 0.0 114.594 178.707 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 7.9 p -156.7 142.59 12.86 Favored Pre-proline 0 CA--C 1.543 0.702 0 C-N-CA 126.561 1.944 . . . . 0.0 110.257 -172.518 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 90.5 Cg_endo -77.06 69.53 7.01 Favored 'Trans proline' 0 CA--C 1.547 1.174 0 C-N-CA 123.655 2.903 . . . . 0.0 111.978 179.156 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 53.4 tptt 61.1 109.13 0.03 OUTLIER Pre-proline 0 N--CA 1.481 1.125 0 C-N-CA 129.346 3.058 . . . . 0.0 113.597 -176.12 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -76.86 156.3 34.78 Favored 'Trans proline' 0 C--N 1.352 0.741 0 C-N-CA 122.788 2.326 . . . . 0.0 111.873 -178.847 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 20.0 pttp -64.52 150.82 45.97 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.929 0.892 . . . . 0.0 112.984 -179.946 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 42.8 tp -143.57 130.33 20.34 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 124.813 1.245 . . . . 0.0 110.88 175.695 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 5.2 mp0 -122.1 69.04 0.94 Allowed 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.233 1.413 . . . . 0.0 110.736 176.116 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -127.29 84.6 2.27 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.133 1.373 . . . . 0.0 111.707 -173.204 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.4 mt -136.3 151.74 49.95 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 127.263 2.225 . . . . 0.0 109.898 178.089 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 67.1 m -74.3 165.09 25.77 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 123.199 0.6 . . . . 0.0 110.829 171.925 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -55.06 -43.99 74.35 Favored 'General case' 0 N--CA 1.48 1.037 0 O-C-N 120.665 -1.272 . . . . 0.0 113.54 -172.983 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 8.5 pt20 -77.82 -35.21 51.5 Favored 'General case' 0 N--CA 1.472 0.625 0 O-C-N 121.56 -0.713 . . . . 0.0 112.547 174.802 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 84.6 mt-30 -65.17 -38.47 90.63 Favored 'General case' 0 N--CA 1.466 0.369 0 O-C-N 121.616 -0.678 . . . . 0.0 111.397 178.961 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 23.4 ttmm -58.99 -42.34 89.78 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 124.555 1.142 . . . . 0.0 110.879 175.173 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 41.0 mt -71.01 -42.3 76.86 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.557 0 CA-C-O 118.265 -0.874 . . . . 0.0 110.977 178.818 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 43.3 mt -63.13 -44.34 99.38 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 CA-C-N 120.412 1.46 . . . . 0.0 110.215 177.246 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -59.0 -49.11 79.15 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 125.12 1.368 . . . . 0.0 110.897 178.069 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -63.25 -52.83 60.51 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 124.858 1.263 . . . . 0.0 112.435 176.374 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -58.52 -31.48 67.94 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-N 119.28 0.945 . . . . 0.0 112.771 179.205 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.432 ' CE2' HG22 ' A' ' 55' ' ' ILE . 1.2 t80 -66.83 -58.44 5.04 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 118.794 0.725 . . . . 0.0 110.593 177.296 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 72.3 mt -65.82 -33.48 63.89 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.442 0 C-N-CA 126.323 1.849 . . . . 0.0 111.615 -178.638 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -72.41 -26.83 62.01 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 123.693 0.797 . . . . 0.0 112.294 177.733 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -86.21 -40.88 15.14 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.039 0.935 . . . . 0.0 112.096 174.939 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.2 m -108.4 -5.57 10.7 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.241 0 N-CA-C 114.552 1.315 . . . . 0.0 114.552 -171.918 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 86.72 26.94 30.76 Favored Glycine 0 CA--C 1.532 1.1 0 C-N-CA 124.711 1.148 . . . . 0.0 115.519 160.543 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 55.99 10.11 0.55 Allowed 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 127.479 2.312 . . . . 0.0 115.322 -173.991 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 5.1 pt20 -123.18 -3.7 8.49 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 124.946 1.298 . . . . 0.0 113.694 -168.948 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 58.8 m-80 -122.43 0.88 9.52 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 124.995 1.318 . . . . 0.0 113.191 174.638 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.432 HG22 ' CE2' ' A' ' 46' ' ' TYR . 18.0 pt -76.97 154.25 5.59 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 C-N-CA 123.039 0.535 . . . . 0.0 111.593 175.963 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -139.82 143.65 36.93 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 124.805 1.242 . . . . 0.0 109.634 179.623 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -60.65 -27.09 67.54 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 118.871 0.76 . . . . 0.0 112.379 179.698 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -67.14 -48.45 78.71 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.463 0 C-N-CA 125.644 1.577 . . . . 0.0 110.194 175.574 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 76.9 m -78.33 -43.65 27.25 Favored 'General case' 0 C--O 1.224 -0.257 0 C-N-CA 123.477 0.711 . . . . 0.0 109.97 -176.659 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 18.6 tp -60.17 -34.58 73.78 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 125.375 1.47 . . . . 0.0 112.082 173.713 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.55 ' HA ' HG13 ' A' ' 66' ' ' ILE . 35.1 t -52.92 -36.14 59.24 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 124.363 1.065 . . . . 0.0 112.571 168.527 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -100.66 -22.82 14.8 Favored 'General case' 0 CA--C 1.533 0.299 0 N-CA-C 114.405 1.261 . . . . 0.0 114.405 -173.088 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 66.6 mmtt -63.99 -34.64 78.46 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 124.721 1.208 . . . . 0.0 111.947 174.953 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.5 mp -117.72 2.67 12.29 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 124.866 1.266 . . . . 0.0 114.076 -174.781 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 12.9 m-80 56.57 46.4 20.52 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 125.613 1.565 . . . . 0.0 112.763 -172.917 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.55 HG13 ' HA ' ' A' ' 61' ' ' SER . 9.9 pt -105.15 -171.99 0.36 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.619 0 C-N-CA 125.913 1.685 . . . . 0.0 111.11 -179.953 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -89.33 158.16 17.91 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 123.523 0.729 . . . . 0.0 110.41 170.081 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 49.7 t -59.1 -31.23 45.41 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.119 0 O-C-N 121.595 -0.69 . . . . 0.0 111.422 170.059 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -80.41 -35.95 34.44 Favored 'General case' 0 CA--C 1.53 0.211 0 O-C-N 121.139 -0.976 . . . . 0.0 110.184 -177.111 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 26.0 tttt -65.97 -44.71 84.14 Favored 'General case' 0 C--N 1.344 0.341 0 C-N-CA 123.393 0.677 . . . . 0.0 110.731 174.06 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -58.51 -49.56 76.95 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.673 1.589 . . . . 0.0 112.35 173.923 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 35.0 ttmt -68.88 -30.0 68.41 Favored 'General case' 0 N--CA 1.463 0.18 0 O-C-N 121.11 -0.994 . . . . 0.0 111.195 -177.152 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -56.15 -37.28 69.29 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 122.97 0.508 . . . . 0.0 112.362 175.311 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 48.6 m-85 -68.55 -45.13 72.96 Favored 'General case' 0 N--CA 1.463 0.218 0 C-N-CA 125.482 1.513 . . . . 0.0 110.609 176.092 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 79.7 mt -64.33 -31.53 53.88 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 C-N-CA 124.961 1.304 . . . . 0.0 111.35 -179.535 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 47.9 mtmt -81.81 -33.65 30.66 Favored 'General case' 0 N--CA 1.469 0.521 0 N-CA-C 113.875 1.065 . . . . 0.0 113.875 -178.188 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 5.7 p30 -86.92 -41.49 13.92 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 119.417 1.008 . . . . 0.0 111.31 173.944 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 8.5 t -105.57 104.85 14.66 Favored 'General case' 0 N--CA 1.456 -0.163 0 O-C-N 123.496 0.498 . . . . 0.0 110.882 -176.963 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -152.98 129.47 10.68 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 123.666 0.786 . . . . 0.0 111.014 -172.204 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 2.0 mpt_? 54.92 1.28 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.58 0 C-N-CA 126.463 1.905 . . . . 0.0 116.026 -169.62 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 29.3 tp -122.98 -44.04 2.2 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 124.832 1.253 . . . . 0.0 113.864 -164.057 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -77.07 95.47 1.16 Allowed Glycine 0 CA--C 1.533 1.175 0 CA-C-N 118.327 0.512 . . . . 0.0 113.171 -177.01 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 40.5 ttm-85 -94.91 -79.46 0.43 Allowed 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 123.985 0.914 . . . . 0.0 113.236 -176.013 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 15.3 t -160.67 26.86 0.15 Allowed 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 124.667 1.187 . . . . 0.0 112.285 -169.752 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 69.2 m-80 -130.77 126.88 37.51 Favored 'General case' 0 N--CA 1.472 0.641 0 O-C-N 120.487 -1.383 . . . . 0.0 111.477 -175.198 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 2.5 t30 -157.34 140.82 15.66 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 125.378 1.471 . . . . 0.0 111.112 175.879 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 4.8 mp -128.39 167.98 16.23 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 127.702 2.401 . . . . 0.0 110.198 178.715 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 4.9 ptpp? -118.36 8.27 12.15 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 126.28 1.832 . . . . 0.0 113.469 -177.556 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 15.3 t -148.55 132.37 17.02 Favored 'General case' 0 C--O 1.233 0.216 0 C-N-CA 125.504 1.522 . . . . 0.0 109.668 171.517 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -144.71 11.82 0.26 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.808 0 C-N-CA 126.608 1.963 . . . . 0.0 112.822 -173.57 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 65.79 11.59 54.55 Favored Glycine 0 CA--C 1.536 1.387 0 O-C-N 120.75 -1.219 . . . . 0.0 114.532 -172.31 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . 0.3 3.1 mp 52.89 33.27 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 C-N-CA 126.768 2.027 . . . . 0.0 111.889 -178.809 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 8.9 mp 51.37 27.7 3.86 Favored 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 127.484 2.313 . . . . 0.0 114.312 175.459 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 6.9 pt20 -129.11 10.4 5.84 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 125.152 1.381 . . . . 0.0 114.289 -172.416 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -74.22 155.59 38.15 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.148 0.979 . . . . 0.0 112.331 174.273 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 57.91 49.98 11.07 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 125.498 1.519 . . . . 0.0 114.41 179.671 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 45.3 t -130.27 137.52 56.14 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.743 0 C-N-CA 125.383 1.473 . . . . 0.0 110.546 176.066 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 13.7 t -136.81 -44.13 0.58 Allowed 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 123.829 0.851 . . . . 0.0 113.131 174.71 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 21.1 t -147.42 103.36 3.55 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.048 0.939 . . . . 0.0 111.826 175.101 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 24.8 mmt 52.13 31.92 9.73 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 126.04 1.736 . . . . 0.0 114.8 178.99 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 11.7 mt-10 -83.4 48.68 1.44 Allowed 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 125.657 1.583 . . . . 0.0 113.221 -176.227 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -119.23 155.44 31.71 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 126.642 1.977 . . . . 0.0 111.787 177.35 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 8.8 mptt -124.49 119.19 28.41 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 125.091 1.357 . . . . 0.0 110.667 -178.963 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 45.3 t -158.74 -65.94 0.08 Allowed 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 124.367 1.067 . . . . 0.0 111.814 175.432 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 25.2 mtm -150.12 164.67 35.0 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 126.42 1.888 . . . . 0.0 111.661 -174.644 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 9.9 t -114.3 166.77 11.32 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 125.63 1.572 . . . . 0.0 111.809 171.763 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 6.7 t-105 . . . . . 0 C--O 1.254 1.294 0 C-N-CA 125.566 1.546 . . . . 0.0 113.177 -168.495 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.567 0 N-CA-C 112.284 -0.326 . . . . 0.0 112.284 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 22.8 t -72.84 -41.52 64.74 Favored 'General case' 0 N--CA 1.476 0.835 0 N-CA-C 113.092 0.775 . . . . 0.0 113.092 -176.324 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 43.5 t-80 -153.17 156.75 39.17 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 125.396 1.478 . . . . 0.0 111.414 177.685 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 22.1 ttt -146.43 134.25 21.24 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 124.603 1.161 . . . . 0.0 111.336 177.441 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -150.23 174.1 13.2 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 124.892 1.277 . . . . 0.0 112.801 -178.512 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 9.3 t -132.02 160.25 36.43 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 125.822 1.649 . . . . 0.0 111.918 176.234 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 77.6 mtm -134.52 65.14 1.58 Allowed 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 125.523 1.529 . . . . 0.0 112.184 -168.58 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -128.84 75.04 80.49 Favored Pre-proline 0 CA--C 1.551 0.986 0 C-N-CA 124.981 1.312 . . . . 0.0 112.049 176.79 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 80.3 Cg_endo -78.9 -3.83 13.51 Favored 'Trans proline' 0 C--N 1.352 0.735 0 C-N-CA 123.973 3.115 . . . . 0.0 114.909 -179.834 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 94.1 mt -108.76 41.34 1.61 Allowed 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 126.279 1.832 . . . . 0.0 112.167 -177.261 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -107.14 -5.04 18.24 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 114.472 1.286 . . . . 0.0 114.472 178.035 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.21 -58.29 2.15 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 124.296 1.038 . . . . 0.0 113.027 -162.508 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.1 pp -129.04 15.11 2.69 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 C-N-CA 126.615 1.966 . . . . 0.0 112.713 -174.981 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 10.2 tt -41.55 124.35 0.49 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.995 0 C-N-CA 125.413 1.485 . . . . 0.0 112.488 177.121 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -147.11 29.87 0.96 Allowed 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 124.027 0.931 . . . . 0.0 112.996 -175.113 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -106.19 11.57 31.1 Favored 'General case' 0 N--CA 1.476 0.841 0 O-C-N 120.899 -1.126 . . . . 0.0 113.553 -179.321 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 15.5 tt -150.13 36.78 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.477 0.876 0 C-N-CA 126.509 1.924 . . . . 0.0 111.799 -175.343 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 2.9 tppt? -136.89 -37.55 0.66 Allowed 'General case' 0 N--CA 1.478 0.935 0 N-CA-C 115.309 1.596 . . . . 0.0 115.309 -176.175 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -151.02 151.12 31.58 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 126.556 1.942 . . . . 0.0 110.783 -179.923 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -138.01 143.13 40.44 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 124.969 1.308 . . . . 0.0 110.954 173.567 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -145.55 171.8 14.15 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 125.572 1.549 . . . . 0.0 111.678 179.825 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.8 t-20 -135.47 151.34 50.29 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 125.546 1.539 . . . . 0.0 111.668 -178.566 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 19.2 m-20 -122.14 136.71 54.95 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 125.507 1.523 . . . . 0.0 112.265 -178.938 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 21.4 t -82.75 101.41 10.88 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-O 121.72 0.771 . . . . 0.0 110.294 174.558 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 97.36 114.37 3.21 Favored Glycine 0 CA--C 1.531 1.049 0 C-N-CA 125.769 1.652 . . . . 0.0 112.649 -177.607 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 61.0 t -122.3 132.48 70.98 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 C-N-CA 126.413 1.885 . . . . 0.0 109.914 173.957 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 54.97 -161.9 0.15 Allowed 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 125.923 1.689 . . . . 0.0 113.299 -175.378 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 45.4 mt -130.02 32.21 4.56 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 126.113 1.765 . . . . 0.0 112.02 -164.227 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -126.78 81.03 69.79 Favored Pre-proline 0 CA--C 1.55 0.956 0 C-N-CA 124.129 0.972 . . . . 0.0 113.547 -156.691 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_endo -76.15 -27.65 8.04 Favored 'Trans proline' 0 CA--C 1.543 0.947 0 C-N-CA 123.728 2.952 . . . . 0.0 114.168 -178.047 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 1.1 tt -150.95 52.62 0.86 Allowed 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 124.049 0.94 . . . . 0.0 112.266 -173.786 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.2 t 56.66 37.78 29.06 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 124.817 1.247 . . . . 0.0 114.018 -179.009 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 10.0 p -157.7 144.46 13.18 Favored Pre-proline 0 N--CA 1.473 0.722 0 C-N-CA 126.466 1.906 . . . . 0.0 109.141 -171.908 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_endo -78.26 60.27 7.38 Favored 'Trans proline' 0 CA--C 1.548 1.193 0 C-N-CA 123.63 2.886 . . . . 0.0 112.667 -178.675 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 59.85 115.11 0.02 OUTLIER Pre-proline 0 N--CA 1.481 1.121 0 C-N-CA 128.532 2.733 . . . . 0.0 112.927 -172.314 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -95.06 137.51 0.82 Allowed 'Trans proline' 0 CA--C 1.538 0.711 0 C-N-CA 122.814 2.343 . . . . 0.0 111.282 178.644 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 35.6 mmtt -72.52 112.38 8.52 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 124.76 1.224 . . . . 0.0 111.253 175.686 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.5 pt? -141.36 161.3 38.22 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 125.661 1.585 . . . . 0.0 113.251 168.879 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -148.8 44.27 1.0 Allowed 'General case' 0 N--CA 1.474 0.758 0 CA-C-O 123.266 1.508 . . . . 0.0 112.759 179.152 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -95.66 98.69 10.67 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 125.186 1.395 . . . . 0.0 112.007 -171.183 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 6.9 mt -124.5 150.44 45.79 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 126.424 1.89 . . . . 0.0 110.796 -179.576 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 63.4 m -75.88 165.09 25.51 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 123.302 0.641 . . . . 0.0 110.528 171.628 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -55.15 -44.46 75.15 Favored 'General case' 0 N--CA 1.48 1.042 0 O-C-N 120.72 -1.237 . . . . 0.0 113.472 -173.526 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 8.9 pt20 -75.35 -36.64 60.95 Favored 'General case' 0 N--CA 1.469 0.51 0 O-C-N 121.601 -0.687 . . . . 0.0 112.486 175.306 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 76.4 mt-30 -65.75 -36.92 84.94 Favored 'General case' 0 N--CA 1.466 0.341 0 O-C-N 121.508 -0.745 . . . . 0.0 111.595 178.9 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 40.3 ttmt -61.59 -42.17 98.49 Favored 'General case' 0 N--CA 1.465 0.307 0 C-N-CA 124.405 1.082 . . . . 0.0 111.008 174.99 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 46.2 mt -69.03 -43.14 82.15 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 CA-C-O 118.449 -0.786 . . . . 0.0 111.045 176.732 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 44.0 mt -63.01 -44.25 99.54 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 CA-C-N 120.167 1.349 . . . . 0.0 110.343 178.73 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -59.53 -49.07 79.22 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.9 1.28 . . . . 0.0 110.794 176.586 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -67.42 -51.46 51.44 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 124.364 1.065 . . . . 0.0 112.799 -179.369 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 18.9 mm-40 -61.9 -24.12 66.75 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 118.968 0.804 . . . . 0.0 113.162 -178.385 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.502 ' CE2' HG22 ' A' ' 55' ' ' ILE . 1.4 t80 -70.29 -60.17 2.44 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 123.891 0.876 . . . . 0.0 110.841 174.031 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 64.7 mt -59.72 -35.15 58.24 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 C-N-CA 127.003 2.121 . . . . 0.0 111.762 177.846 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -70.86 -22.57 62.28 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 123.969 0.908 . . . . 0.0 113.116 178.143 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -94.9 -32.19 13.33 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.472 1.109 . . . . 0.0 112.731 178.013 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 4.5 m -118.57 -20.61 5.05 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.916 0 CA-C-N 119.552 1.069 . . . . 0.0 113.731 -173.461 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 83.2 141.98 4.54 Favored Glycine 0 CA--C 1.531 1.061 0 C-N-CA 124.787 1.184 . . . . 0.0 112.33 -171.312 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -66.83 -9.96 42.92 Favored 'General case' 0 N--CA 1.479 0.994 0 CA-C-O 122.721 1.248 . . . . 0.0 113.93 -171.485 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 5.6 pt20 -84.96 -11.74 54.85 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 126.268 1.827 . . . . 0.0 113.854 174.753 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 73.4 m-80 -114.35 -9.4 12.79 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 114.585 1.328 . . . . 0.0 114.585 -177.877 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.502 HG22 ' CE2' ' A' ' 46' ' ' TYR . 21.8 pt -71.43 159.98 5.46 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 C-N-CA 123.574 0.749 . . . . 0.0 111.608 168.684 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.1 p -129.22 144.37 51.19 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 125.149 1.379 . . . . 0.0 110.014 173.805 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -63.9 -26.14 68.46 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.933 0.893 . . . . 0.0 112.169 175.875 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -63.49 -49.26 83.37 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.459 0 C-N-CA 125.291 1.436 . . . . 0.0 109.48 173.099 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 99.2 m -75.14 -43.02 54.89 Favored 'General case' 0 C--O 1.223 -0.309 0 C-N-CA 123.538 0.735 . . . . 0.0 110.156 -178.248 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 17.3 tp -62.22 -35.13 77.95 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.469 1.108 . . . . 0.0 112.093 176.23 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.47 ' HA ' HG13 ' A' ' 66' ' ' ILE . 47.2 t -53.79 -32.5 52.79 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.367 1.067 . . . . 0.0 113.015 168.349 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -100.74 -23.55 14.59 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 125.621 1.568 . . . . 0.0 114.008 -174.137 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 67.1 mmtt -66.05 -37.58 86.19 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 124.858 1.263 . . . . 0.0 111.343 173.977 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.3 mp -114.21 1.38 14.51 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 125.092 1.357 . . . . 0.0 114.256 -172.819 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 12.7 m-80 57.21 46.36 18.89 Favored 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 125.712 1.605 . . . . 0.0 112.868 -175.155 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.47 HG13 ' HA ' ' A' ' 61' ' ' SER . 7.0 pt -106.39 -166.42 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 C-N-CA 125.974 1.709 . . . . 0.0 111.537 -178.992 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -94.5 159.41 15.11 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 123.9 0.88 . . . . 0.0 110.491 167.644 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 93.8 t -60.39 -30.1 45.66 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 O-C-N 121.563 -0.711 . . . . 0.0 111.241 172.22 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -82.68 -32.52 28.06 Favored 'General case' 0 N--CA 1.465 0.287 0 O-C-N 121.049 -1.032 . . . . 0.0 110.567 -178.194 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 15.2 tttt -70.19 -41.59 73.52 Favored 'General case' 0 C--N 1.343 0.326 0 C-N-CA 123.313 0.645 . . . . 0.0 110.855 174.502 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -60.78 -47.33 86.8 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 125.56 1.544 . . . . 0.0 112.355 171.531 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 36.7 ttmt -72.78 -28.04 62.36 Favored 'General case' 0 CA--C 1.517 -0.296 0 CA-C-O 118.004 -0.998 . . . . 0.0 111.298 -173.519 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -49.72 -47.24 50.69 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 118.833 0.742 . . . . 0.0 110.408 174.272 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 18.9 m-85 -63.56 -43.19 97.75 Favored 'General case' 0 C--O 1.223 -0.326 0 C-N-CA 123.491 0.716 . . . . 0.0 110.43 -175.593 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 48.4 mt -67.92 -28.39 41.15 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.675 0 C-N-CA 125.435 1.494 . . . . 0.0 111.637 -178.773 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 28.4 mmmt -80.46 -23.41 40.23 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 125.423 1.489 . . . . 0.0 112.369 174.941 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 90.2 m-20 -100.29 -62.85 1.19 Allowed 'General case' 0 C--O 1.234 0.244 0 C-N-CA 126.326 1.85 . . . . 0.0 111.609 -173.502 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 69.7 m -98.59 102.66 14.46 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 126.318 1.847 . . . . 0.0 110.862 177.027 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 7.9 p30 -139.13 -74.5 0.38 Allowed 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 123.608 0.763 . . . . 0.0 112.839 -177.476 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 1.2 mpp_? -65.24 -26.64 68.2 Favored 'General case' 0 N--CA 1.484 1.257 0 CA-C-N 119.482 1.037 . . . . 0.0 112.646 177.919 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -92.92 0.4 57.4 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 126.466 1.906 . . . . 0.0 113.492 176.84 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -72.77 -17.29 78.17 Favored Glycine 0 CA--C 1.538 1.492 0 O-C-N 120.89 -1.131 . . . . 0.0 115.415 -174.103 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 13.8 ttt85 -144.84 165.83 26.99 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 126.724 2.009 . . . . 0.0 109.381 170.309 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 8.9 t -49.87 107.88 0.18 Allowed 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 125.73 1.612 . . . . 0.0 113.545 178.739 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 54.7 m-80 -150.6 137.65 19.28 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 126.116 1.767 . . . . 0.0 110.301 179.615 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -153.15 88.86 1.33 Allowed 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 124.785 1.234 . . . . 0.0 109.74 170.821 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -143.57 30.47 1.36 Allowed 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 124.168 0.987 . . . . 0.0 112.027 -175.804 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 85.2 tttt -94.19 -24.2 17.6 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 125.768 1.627 . . . . 0.0 111.933 174.339 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 9.5 t -158.92 127.32 5.22 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 126.439 1.896 . . . . 0.0 109.282 179.415 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -143.25 2.26 0.35 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.786 0 C-N-CA 125.505 1.522 . . . . 0.0 113.975 -177.789 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 70.65 10.22 66.8 Favored Glycine 0 CA--C 1.541 1.669 0 O-C-N 120.728 -1.232 . . . . 0.0 114.682 -169.963 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . 0.257 4.0 mp 53.28 39.22 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.106 0 C-N-CA 126.485 1.914 . . . . 0.0 111.824 174.121 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 14.4 tp 50.93 25.03 2.02 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 127.148 2.179 . . . . 0.0 114.426 -177.758 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 33.6 mt-30 -114.2 86.5 2.43 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 126.008 1.723 . . . . 0.0 110.22 -174.655 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -133.43 147.6 51.73 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 126.791 2.036 . . . . 0.0 110.018 179.024 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -133.6 122.41 23.48 Favored 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 124.694 1.197 . . . . 0.0 110.721 -176.336 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 60.6 t -134.21 108.7 11.52 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.469 0 C-N-CA 125.375 1.47 . . . . 0.0 109.712 178.749 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 32.2 t -162.99 -79.32 0.04 OUTLIER 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 123.757 0.823 . . . . 0.0 112.126 169.014 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 42.9 m -95.3 -27.54 15.43 Favored 'General case' 0 N--CA 1.478 0.948 0 N-CA-C 114.079 1.14 . . . . 0.0 114.079 -172.588 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 65.6 mtt -137.57 110.41 7.65 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 125.419 1.488 . . . . 0.0 109.658 -179.69 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -144.52 85.98 1.8 Allowed 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 124.768 1.227 . . . . 0.0 109.145 -179.693 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -153.29 161.71 42.08 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 124.884 1.273 . . . . 0.0 112.566 -178.437 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 52.3 mmtt -116.95 -65.34 1.2 Allowed 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 125.75 1.62 . . . . 0.0 111.88 174.24 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 56.9 m -144.12 145.32 32.06 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.801 1.64 . . . . 0.0 110.954 -179.176 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 31.9 ttm -154.45 154.01 32.48 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 124.573 1.149 . . . . 0.0 111.805 179.778 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 10.6 m -100.94 142.97 31.66 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 124.811 1.244 . . . . 0.0 110.94 173.807 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 48.6 p90 . . . . . 0 C--O 1.253 1.259 0 C-N-CA 126.522 1.929 . . . . 0.0 113.655 -178.186 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.625 0 N-CA-C 111.671 -0.572 . . . . 0.0 111.671 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 21.3 t -148.29 145.99 28.4 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.824 1.249 . . . . 0.0 111.626 177.884 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 69.1 m80 -141.76 151.06 42.55 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 125.822 1.649 . . . . 0.0 111.597 -178.808 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 27.9 ttt -147.6 139.0 23.76 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 125.29 1.436 . . . . 0.0 111.235 -179.815 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -85.35 152.06 23.55 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 124.05 0.94 . . . . 0.0 112.366 176.228 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 26.9 t -141.69 94.71 2.71 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.932 1.293 . . . . 0.0 109.778 177.782 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 33.9 ttm -149.75 26.28 0.83 Allowed 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 124.834 1.253 . . . . 0.0 112.518 -173.352 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 15.6 m-20 -126.96 156.23 74.47 Favored Pre-proline 0 CA--C 1.548 0.872 0 C-N-CA 125.691 1.597 . . . . 0.0 111.945 -177.001 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 91.7 Cg_endo -74.29 -0.25 9.4 Favored 'Trans proline' 0 CA--C 1.538 0.688 0 C-N-CA 123.468 2.778 . . . . 0.0 114.601 179.969 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 95.0 mt -117.28 36.69 4.14 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 125.878 1.671 . . . . 0.0 112.998 -175.296 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 27.9 m-20 -103.84 2.62 32.92 Favored 'General case' 0 N--CA 1.477 0.898 0 N-CA-C 114.301 1.223 . . . . 0.0 114.301 173.36 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -119.92 -57.17 1.97 Allowed 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 124.398 1.079 . . . . 0.0 113.525 -164.502 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.1 pp -131.36 16.39 1.87 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.94 0 C-N-CA 126.144 1.778 . . . . 0.0 112.869 -172.534 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 15.5 tt -42.03 -39.08 0.76 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.284 0 C-N-CA 126.156 1.782 . . . . 0.0 115.772 -177.164 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 15.9 m120 -121.54 108.38 13.54 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 125.514 1.526 . . . . 0.0 110.497 177.594 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 29.2 t0 -165.38 62.91 0.12 Allowed 'General case' 0 CA--C 1.533 0.29 0 CA-C-O 122.352 1.072 . . . . 0.0 110.655 -168.582 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 29.5 mt 50.08 59.36 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.742 0 C-N-CA 125.931 1.693 . . . . 0.0 110.626 -169.097 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -147.75 -51.38 0.19 Allowed 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 114.62 -1.173 . . . . 0.0 112.064 -179.814 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 61.0 mttp 54.81 177.79 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.558 0 C-N-CA 125.932 1.693 . . . . 0.0 114.495 -174.889 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -142.57 71.3 1.34 Allowed 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 124.986 1.314 . . . . 0.0 110.816 178.393 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -139.19 161.9 36.28 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 125.578 1.551 . . . . 0.0 112.048 177.36 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 29.1 t-20 -154.34 -54.28 0.1 Allowed 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 123.936 0.895 . . . . 0.0 113.092 -174.351 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 51.68 38.97 24.19 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 126.0 1.72 . . . . 0.0 115.402 176.364 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 27.1 t -69.2 109.86 4.29 Favored 'General case' 0 CA--C 1.539 0.532 0 O-C-N 121.439 -0.788 . . . . 0.0 111.377 175.567 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 75.52 105.86 0.11 Allowed Glycine 0 CA--C 1.537 1.442 0 C-N-CA 125.936 1.732 . . . . 0.0 113.947 -177.355 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 14.8 p -141.03 140.33 32.67 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.858 0 C-N-CA 125.421 1.489 . . . . 0.0 111.432 172.47 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 27.6 m 63.92 156.65 0.07 Allowed 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 127.017 2.127 . . . . 0.0 115.329 179.947 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -133.43 31.83 3.71 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 126.217 1.807 . . . . 0.0 114.575 -174.311 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -83.3 151.3 62.47 Favored Pre-proline 0 CA--C 1.549 0.917 0 C-N-CA 125.453 1.501 . . . . 0.0 112.84 -179.199 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 65.3 Cg_endo -72.73 -44.84 0.59 Allowed 'Trans proline' 0 CA--C 1.541 0.846 0 C-N-CA 122.679 2.253 . . . . 0.0 112.605 178.01 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 41.7 tp -159.04 81.32 0.78 Allowed 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 125.61 1.564 . . . . 0.0 109.53 174.063 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 60.47 175.86 0.1 Allowed 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.992 1.317 . . . . 0.0 114.16 -172.863 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 40.8 t 63.31 151.33 0.11 Allowed Pre-proline 0 N--CA 1.486 1.352 0 C-N-CA 127.04 2.136 . . . . 0.0 112.882 -172.945 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -69.59 66.14 1.68 Allowed 'Trans proline' 0 CA--C 1.548 1.224 0 C-N-CA 123.43 2.754 . . . . 0.0 112.094 169.392 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 55.95 102.79 0.03 OUTLIER Pre-proline 0 N--CA 1.478 0.965 0 C-N-CA 128.845 2.858 . . . . 0.0 113.084 -174.058 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 82.3 Cg_endo -69.11 163.09 39.09 Favored 'Trans proline' 0 CA--C 1.539 0.753 0 C-N-CA 122.309 2.006 . . . . 0.0 112.369 175.438 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 96.6 mttt -117.65 111.07 18.67 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 126.245 1.818 . . . . 0.0 110.136 178.979 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -149.29 156.04 41.47 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.264 1.426 . . . . 0.0 113.269 -176.528 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -151.1 46.71 0.84 Allowed 'General case' 0 N--CA 1.474 0.77 0 CA-C-O 123.088 1.423 . . . . 0.0 112.844 -177.791 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -106.36 83.04 1.82 Allowed 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 125.188 1.395 . . . . 0.0 112.357 -172.568 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 5.2 mt -104.65 156.06 18.31 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 126.744 2.018 . . . . 0.0 111.104 175.19 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 18.3 t -73.57 165.89 24.25 Favored 'General case' 0 N--CA 1.479 0.99 0 O-C-N 121.965 -0.459 . . . . 0.0 110.396 167.54 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -59.57 -43.18 93.68 Favored 'General case' 0 CA--C 1.542 0.656 0 O-C-N 120.461 -1.399 . . . . 0.0 112.824 -173.724 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 10.2 tt0 -73.47 -41.88 62.6 Favored 'General case' 0 N--CA 1.469 0.524 0 O-C-N 121.299 -0.875 . . . . 0.0 111.43 175.743 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 30.4 mm-40 -57.06 -43.42 82.02 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 123.894 0.877 . . . . 0.0 111.032 176.637 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 40.8 ttmt -60.14 -42.31 94.57 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 124.981 1.313 . . . . 0.0 111.651 176.733 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 47.1 mt -68.88 -40.87 81.73 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 CA-C-O 118.413 -0.803 . . . . 0.0 111.053 177.535 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 43.6 mt -63.91 -44.22 97.95 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.933 0 CA-C-N 120.307 1.412 . . . . 0.0 110.385 177.705 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -59.22 -50.07 75.44 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.681 1.193 . . . . 0.0 110.396 176.105 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -65.68 -50.68 64.04 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.346 1.058 . . . . 0.0 112.93 -179.576 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.8 mm-40 -60.89 -24.38 65.92 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 118.997 0.817 . . . . 0.0 113.13 -179.145 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.435 ' CE2' HG22 ' A' ' 55' ' ' ILE . 1.7 t80 -73.23 -58.17 3.5 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 123.714 0.806 . . . . 0.0 111.31 175.865 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 15.3 mt -59.91 -33.79 53.91 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.583 0 C-N-CA 125.903 1.681 . . . . 0.0 111.629 175.815 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -69.78 -22.4 63.34 Favored 'General case' 0 CA--C 1.545 0.771 0 O-C-N 121.267 -0.895 . . . . 0.0 113.293 175.372 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -93.76 -32.96 13.78 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 124.526 1.13 . . . . 0.0 112.732 178.539 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 10.5 m -120.15 -19.68 5.04 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.911 0 N-CA-C 114.005 1.113 . . . . 0.0 114.005 -174.094 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 83.58 142.56 5.02 Favored Glycine 0 CA--C 1.531 1.052 0 C-N-CA 124.802 1.192 . . . . 0.0 112.145 -171.486 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 2.2 tt -65.48 -11.19 40.94 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 114.928 1.455 . . . . 0.0 114.928 -170.219 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 38.8 mt-30 -80.18 -20.69 44.19 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.672 1.589 . . . . 0.0 112.921 174.813 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 69.5 m-80 -109.63 -7.07 15.16 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 114.4 1.259 . . . . 0.0 114.4 -171.793 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.435 HG22 ' CE2' ' A' ' 46' ' ' TYR . 16.5 pt -71.85 160.67 5.15 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 C-N-CA 123.676 0.791 . . . . 0.0 111.492 166.689 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.1 p -130.81 144.77 51.69 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 125.357 1.463 . . . . 0.0 109.991 173.923 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -62.98 -27.83 69.68 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 123.935 0.894 . . . . 0.0 112.239 176.679 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -62.83 -52.04 64.44 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.313 0 C-N-CA 125.41 1.484 . . . . 0.0 109.144 174.043 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 58.6 m -73.83 -42.89 60.22 Favored 'General case' 0 C--O 1.223 -0.303 0 C-N-CA 123.357 0.663 . . . . 0.0 110.442 -177.968 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 18.4 tp -59.79 -35.31 74.41 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.413 1.085 . . . . 0.0 111.996 174.819 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.489 ' HA ' HG13 ' A' ' 66' ' ' ILE . 47.7 t -55.39 -34.37 64.3 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 124.132 0.973 . . . . 0.0 113.124 170.156 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.1 -22.41 16.24 Favored 'General case' 0 CA--C 1.534 0.362 0 N-CA-C 114.533 1.308 . . . . 0.0 114.533 -177.448 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 68.0 mmtt -64.1 -38.44 91.06 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 119.508 1.049 . . . . 0.0 111.154 173.744 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.2 mp -112.34 -0.2 15.48 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 125.315 1.446 . . . . 0.0 114.363 -173.162 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 48.8 m-80 54.39 47.84 21.99 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 125.459 1.504 . . . . 0.0 112.84 -172.569 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.489 HG13 ' HA ' ' A' ' 61' ' ' SER . 8.2 pt -104.35 -162.63 0.14 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.766 0 C-N-CA 126.456 1.902 . . . . 0.0 110.849 178.72 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -100.2 159.22 15.28 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 124.364 1.066 . . . . 0.0 110.4 167.701 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 67.7 t -60.96 -29.18 45.06 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.958 0 O-C-N 121.634 -0.666 . . . . 0.0 111.26 172.425 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 85.6 mt-10 -80.16 -34.11 37.88 Favored 'General case' 0 N--CA 1.466 0.357 0 O-C-N 120.953 -1.092 . . . . 0.0 110.092 -178.766 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 13.5 tttp -69.7 -44.38 70.52 Favored 'General case' 0 C--N 1.345 0.378 0 C-N-CA 124.287 1.035 . . . . 0.0 110.344 175.984 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -59.85 -46.75 88.3 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 125.843 1.657 . . . . 0.0 112.688 173.293 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 38.8 ttmt -75.28 -25.12 57.71 Favored 'General case' 0 CA--C 1.518 -0.28 0 C-N-CA 124.099 0.96 . . . . 0.0 111.799 -172.42 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -52.79 -50.11 64.24 Favored 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 118.138 0.426 . . . . 0.0 110.47 171.597 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 19.0 m-85 -62.15 -39.16 91.67 Favored 'General case' 0 C--N 1.34 0.183 0 C-N-CA 124.113 0.965 . . . . 0.0 111.319 -175.847 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 73.8 mt -68.04 -37.78 78.79 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.409 0 C-N-CA 123.956 0.902 . . . . 0.0 110.122 179.4 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 15.8 ttmt -73.0 -40.42 65.24 Favored 'General case' 0 C--N 1.344 0.333 0 C-N-CA 124.338 1.055 . . . . 0.0 112.533 -176.618 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 23.9 p30 -90.97 -44.32 9.41 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 123.324 0.65 . . . . 0.0 111.696 -178.035 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 1.3 t -88.28 45.14 1.25 Allowed 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 115.013 1.486 . . . . 0.0 115.013 -175.772 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -88.29 -37.58 15.88 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 115.454 1.65 . . . . 0.0 115.454 -163.527 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -108.2 -5.91 16.65 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 124.755 1.222 . . . . 0.0 113.657 175.44 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 9.4 tt -74.37 -37.67 63.39 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 124.282 1.033 . . . . 0.0 111.278 170.95 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -79.77 43.02 2.54 Favored Glycine 0 CA--C 1.537 1.42 0 C-N-CA 124.186 0.898 . . . . 0.0 114.994 179.433 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 16.7 mmt85 -127.77 -178.52 4.53 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 126.295 1.838 . . . . 0.0 112.606 -173.586 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 6.4 t -124.98 5.73 7.97 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 126.865 2.066 . . . . 0.0 113.904 -174.93 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 75.4 m-20 -85.36 54.94 3.29 Favored 'General case' 0 CA--C 1.547 0.852 0 O-C-N 120.568 -1.332 . . . . 0.0 112.988 -168.175 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 1.7 p-10 -134.71 19.1 3.55 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 126.025 1.73 . . . . 0.0 113.519 -172.845 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -144.81 45.85 1.36 Allowed 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.635 1.174 . . . . 0.0 110.984 -167.791 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 64.9 tttm -101.81 -25.31 13.86 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 125.801 1.64 . . . . 0.0 112.44 178.845 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 8.9 t -158.07 120.22 3.69 Favored 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 125.897 1.679 . . . . 0.0 109.547 -179.737 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -146.26 3.16 0.18 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.809 0 N-CA-C 114.117 1.154 . . . . 0.0 114.117 -175.543 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 69.79 7.79 59.44 Favored Glycine 0 CA--C 1.54 1.619 0 O-C-N 120.572 -1.33 . . . . 0.0 114.568 -169.288 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . 0.258 21.5 mm 56.98 24.06 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.112 0 C-N-CA 127.272 2.229 . . . . 0.0 113.021 174.756 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 11.3 tp 53.44 22.07 2.71 Favored 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 126.41 1.884 . . . . 0.0 114.306 -171.128 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 16.5 mm100 -98.2 -32.71 11.44 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 125.61 1.564 . . . . 0.0 112.505 -179.959 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -139.08 145.4 39.47 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 125.329 1.452 . . . . 0.0 111.384 177.825 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -145.47 111.04 5.39 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.792 1.237 . . . . 0.0 110.512 176.223 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 57.8 t -141.26 133.65 29.5 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 C-N-CA 125.333 1.453 . . . . 0.0 109.651 178.936 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 42.7 t -162.94 -71.43 0.05 OUTLIER 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 123.701 0.8 . . . . 0.0 112.498 175.322 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 60.8 p -85.85 -20.57 28.92 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 124.881 1.272 . . . . 0.0 113.956 -176.179 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 97.0 mtp -124.02 113.79 18.89 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 126.076 1.75 . . . . 0.0 109.199 176.035 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -142.62 74.21 1.44 Allowed 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.084 1.354 . . . . 0.0 109.757 -177.461 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -147.39 147.88 30.74 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 124.779 1.232 . . . . 0.0 112.144 -179.076 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 30.1 mtpp -138.32 142.72 39.73 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 125.946 1.698 . . . . 0.0 110.751 177.47 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 52.2 m -139.77 67.95 1.37 Allowed 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 124.794 1.238 . . . . 0.0 111.619 -171.806 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 10.3 mmt -133.37 167.58 20.15 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.217 1.407 . . . . 0.0 113.432 -179.174 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 11.6 t -140.02 160.61 39.55 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 126.71 2.004 . . . . 0.0 111.419 -178.475 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 41.2 t-105 . . . . . 0 C--O 1.253 1.249 0 C-N-CA 125.976 1.71 . . . . 0.0 112.845 -170.911 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.523 0 N-CA-C 111.993 -0.443 . . . . 0.0 111.993 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 52.7 m -107.33 115.73 30.69 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 124.727 1.211 . . . . 0.0 111.585 -176.23 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 96.2 m-70 -139.16 -57.17 0.6 Allowed 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.503 1.121 . . . . 0.0 113.021 179.969 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 11.9 tpt -148.11 57.25 1.08 Allowed 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 124.347 1.059 . . . . 0.0 111.937 -174.759 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -151.0 148.37 28.29 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 124.367 1.067 . . . . 0.0 112.713 179.945 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 30.2 t -156.48 124.16 5.49 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 125.038 1.335 . . . . 0.0 110.934 175.525 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 11.2 mmt -140.29 7.01 2.16 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 125.193 1.397 . . . . 0.0 114.203 -178.819 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 46.5 t0 -148.4 108.76 3.62 Favored Pre-proline 0 CA--C 1.549 0.939 0 O-C-N 121.065 -1.022 . . . . 0.0 112.312 -178.183 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 65.2 Cg_endo -83.8 -2.09 10.21 Favored 'Trans proline' 0 C--N 1.351 0.682 0 C-N-CA 123.828 3.019 . . . . 0.0 114.712 178.333 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 96.8 mt -120.8 39.35 3.8 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 126.212 1.805 . . . . 0.0 111.78 -175.576 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -106.13 -3.58 21.31 Favored 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 114.253 1.205 . . . . 0.0 114.253 176.533 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.09 -57.06 2.31 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 124.233 1.013 . . . . 0.0 113.112 -161.017 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.9 pp -129.05 12.22 2.67 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.794 0 C-N-CA 126.389 1.876 . . . . 0.0 112.863 -175.118 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 8.4 tt -42.34 105.73 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.082 0 C-N-CA 126.0 1.72 . . . . 0.0 113.46 -176.459 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 4.3 t30 -150.52 10.94 0.67 Allowed 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 114.878 1.436 . . . . 0.0 114.878 179.87 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -81.6 5.25 18.7 Favored 'General case' 0 CA--C 1.545 0.771 0 N-CA-C 115.147 1.536 . . . . 0.0 115.147 -168.53 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 13.5 tt -148.33 27.57 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 C-N-CA 125.616 1.566 . . . . 0.0 113.975 -172.717 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 52.7 mtmt -120.04 -51.04 2.24 Favored 'General case' 0 N--CA 1.477 0.883 0 N-CA-C 113.981 1.104 . . . . 0.0 113.981 176.555 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 14.2 ptpt -168.19 136.98 2.37 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 125.259 1.424 . . . . 0.0 112.802 -174.031 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 11.7 tt0 -156.82 16.63 0.3 Allowed 'General case' 0 CA--C 1.554 1.118 0 N-CA-C 113.957 1.095 . . . . 0.0 113.957 176.378 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -140.07 158.62 43.76 Favored 'General case' 0 CA--C 1.543 0.701 0 O-C-N 120.584 -1.323 . . . . 0.0 113.675 -169.54 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 9.4 t-20 -85.56 -36.74 20.25 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 124.369 1.067 . . . . 0.0 113.407 -174.428 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 -147.11 123.51 10.99 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 125.872 1.669 . . . . 0.0 110.793 172.914 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 67.5 m -144.86 43.56 1.35 Allowed 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 125.221 1.409 . . . . 0.0 112.771 -177.431 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -156.9 57.71 0.37 Allowed Glycine 0 N--CA 1.47 0.904 0 O-C-N 121.348 -0.845 . . . . 0.0 114.395 -176.998 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 11.0 p -142.08 16.81 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 C-N-CA 125.361 1.465 . . . . 0.0 112.87 -171.592 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -138.51 149.39 45.33 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 125.107 1.363 . . . . 0.0 111.833 -169.781 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 2.3 mp -105.11 31.25 4.98 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 125.498 1.519 . . . . 0.0 113.264 -169.8 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -150.84 87.32 4.75 Favored Pre-proline 0 CA--C 1.549 0.912 0 C-N-CA 124.341 1.056 . . . . 0.0 111.234 -157.098 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -77.18 -29.65 4.87 Favored 'Trans proline' 0 CA--C 1.54 0.795 0 C-N-CA 123.122 2.548 . . . . 0.0 114.1 -169.137 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 1.9 tt -147.75 61.04 1.14 Allowed 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 125.005 1.322 . . . . 0.0 109.374 178.149 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 51.2 m 60.56 168.76 0.09 Allowed 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 125.502 1.521 . . . . 0.0 113.778 -165.203 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 70.5 t 63.41 148.53 0.1 OUTLIER Pre-proline 0 N--CA 1.483 1.186 0 C-N-CA 127.224 2.21 . . . . 0.0 113.873 -178.173 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 64.6 Cg_endo -65.98 79.38 0.29 Allowed 'Trans proline' 0 CA--C 1.544 0.997 0 C-N-CA 122.939 2.426 . . . . 0.0 110.923 165.146 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 53.8 tptt 43.44 86.99 0.12 Allowed Pre-proline 0 N--CA 1.48 1.073 0 C-N-CA 129.735 3.214 . . . . 0.0 114.568 176.44 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -67.24 155.88 68.66 Favored 'Trans proline' 0 CA--C 1.541 0.84 0 C-N-CA 123.178 2.585 . . . . 0.0 113.343 -177.641 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 59.7 pttt -60.39 151.84 26.96 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 125.111 1.365 . . . . 0.0 113.698 -176.089 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 29.6 tp -141.95 149.69 40.44 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 126.143 1.777 . . . . 0.0 110.258 179.29 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -145.13 50.07 1.25 Allowed 'General case' 0 N--CA 1.475 0.822 0 CA-C-O 122.949 1.357 . . . . 0.0 112.804 -179.233 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 25.5 mt-10 -111.68 89.16 2.98 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 125.287 1.435 . . . . 0.0 112.446 -175.757 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.1 mt -132.66 152.98 51.54 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 127.661 2.384 . . . . 0.0 109.26 170.065 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 70.0 m -71.48 164.64 25.43 Favored 'General case' 0 N--CA 1.481 1.077 0 O-C-N 121.788 -0.57 . . . . 0.0 110.5 169.559 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -55.89 -43.76 77.55 Favored 'General case' 0 N--CA 1.481 1.078 0 O-C-N 120.492 -1.38 . . . . 0.0 113.181 -174.949 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 11.6 tt0 -72.24 -41.42 66.82 Favored 'General case' 0 CA--C 1.536 0.442 0 O-C-N 121.549 -0.719 . . . . 0.0 111.537 175.47 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 86.8 mt-30 -62.4 -39.29 92.75 Favored 'General case' 0 N--CA 1.466 0.374 0 O-C-N 121.657 -0.652 . . . . 0.0 111.79 178.465 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 40.0 ttmt -60.81 -41.32 95.45 Favored 'General case' 0 N--CA 1.465 0.281 0 C-N-CA 123.987 0.915 . . . . 0.0 110.625 175.764 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 46.7 mt -67.86 -43.46 86.03 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 CA-C-O 118.332 -0.842 . . . . 0.0 111.266 176.673 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 45.5 mt -64.74 -44.78 96.48 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.956 0 CA-C-N 120.518 1.508 . . . . 0.0 110.481 179.314 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -58.63 -48.77 79.88 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.434 1.494 . . . . 0.0 110.87 176.154 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -64.0 -51.7 63.0 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 124.042 0.937 . . . . 0.0 112.333 176.939 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 13.9 mm-40 -59.75 -23.0 62.86 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 119.318 0.963 . . . . 0.0 113.394 -179.745 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.443 ' CE2' HG22 ' A' ' 55' ' ' ILE . 1.4 t80 -71.47 -64.15 0.98 Allowed 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 119.001 0.819 . . . . 0.0 110.824 172.905 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 27.4 mt -58.84 -34.61 52.81 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 C-N-CA 126.534 1.934 . . . . 0.0 112.019 178.862 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -71.71 -23.45 61.64 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.265 1.026 . . . . 0.0 112.996 177.721 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -91.44 -36.28 13.87 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 124.327 1.051 . . . . 0.0 112.624 176.109 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 19.4 m -112.66 -23.56 4.32 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.269 0 N-CA-C 115.326 1.602 . . . . 0.0 115.326 -174.385 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 83.86 139.16 3.89 Favored Glycine 0 CA--C 1.533 1.183 0 C-N-CA 124.916 1.246 . . . . 0.0 112.288 -167.845 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.2 tt -65.64 -7.94 17.78 Favored 'General case' 0 CA--C 1.551 0.992 0 N-CA-C 114.16 1.17 . . . . 0.0 114.16 -173.4 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 37.7 mt-30 -74.26 -19.3 60.55 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 126.411 1.884 . . . . 0.0 113.566 -178.548 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 13.5 p30 -130.7 2.34 4.47 Favored 'General case' 0 N--CA 1.476 0.868 0 N-CA-C 115.741 1.756 . . . . 0.0 115.741 -176.166 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.443 HG22 ' CE2' ' A' ' 46' ' ' TYR . 31.2 pt -63.01 156.98 4.33 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.655 0 CA-C-N 118.797 0.726 . . . . 0.0 111.707 164.826 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -130.63 144.79 51.67 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 125.139 1.376 . . . . 0.0 110.631 176.063 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -62.97 -26.39 68.81 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 124.005 0.922 . . . . 0.0 112.256 175.923 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -66.35 -41.07 88.27 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.502 0 C-N-CA 125.415 1.486 . . . . 0.0 110.562 174.222 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 98.7 m -80.84 -43.65 19.64 Favored 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 123.23 0.612 . . . . 0.0 109.738 -179.289 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.4 tt -66.06 -33.45 75.82 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 124.648 1.179 . . . . 0.0 112.333 178.158 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.444 ' HA ' HG13 ' A' ' 66' ' ' ILE . 60.4 p -60.91 -26.28 67.34 Favored 'General case' 0 N--CA 1.475 0.795 0 CA-C-N 119.232 0.924 . . . . 0.0 112.978 169.878 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -96.32 -31.27 12.97 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 125.026 1.33 . . . . 0.0 113.39 -178.497 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 8.3 mmtm -61.06 -36.53 79.85 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 125.255 1.422 . . . . 0.0 111.75 175.7 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.1 mt -118.22 9.31 12.53 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 125.678 1.591 . . . . 0.0 113.654 -171.1 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . 0.291 7.4 p30 47.31 60.32 3.53 Favored 'General case' 0 CA--C 1.551 0.996 0 C-N-CA 126.771 2.029 . . . . 0.0 114.132 -176.821 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.444 HG13 ' HA ' ' A' ' 61' ' ' SER . 0.6 OUTLIER -130.64 178.5 5.34 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 127.788 2.435 . . . . 0.0 111.359 -173.438 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.1 p -79.56 158.88 27.05 Favored 'General case' 0 N--CA 1.477 0.91 0 O-C-N 121.011 -1.056 . . . . 0.0 111.598 173.337 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 86.3 t -63.7 -29.94 48.59 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.029 0 O-C-N 121.628 -0.67 . . . . 0.0 111.36 172.468 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -76.68 -38.4 54.54 Favored 'General case' 0 N--CA 1.468 0.468 0 O-C-N 120.985 -1.072 . . . . 0.0 109.951 -178.344 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 5.6 tmtm? -65.06 -47.92 75.61 Favored 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 125.56 1.544 . . . . 0.0 110.771 176.359 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -60.62 -43.03 97.94 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 125.95 1.7 . . . . 0.0 113.479 174.062 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 34.8 ttmt -72.31 -27.09 62.22 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 124.633 1.173 . . . . 0.0 111.657 -179.352 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -56.91 -43.11 81.07 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-O 119.02 -0.515 . . . . 0.0 111.245 177.419 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 65.2 m-85 -60.9 -42.74 98.64 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 124.922 1.289 . . . . 0.0 111.571 175.243 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 62.5 mt -69.23 -21.05 24.85 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.765 0 C-N-CA 124.457 1.103 . . . . 0.0 111.168 -179.855 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 30.3 mmtm -92.96 -23.46 18.71 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 125.656 1.582 . . . . 0.0 113.394 178.547 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 10.3 p30 -104.05 -35.31 8.13 Favored 'General case' 0 N--CA 1.468 0.466 0 N-CA-C 113.822 1.045 . . . . 0.0 113.822 177.986 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 5.2 t -86.82 -12.18 48.74 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 114.218 1.192 . . . . 0.0 114.218 -170.974 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 20.1 p30 -64.38 -10.81 27.1 Favored 'General case' 0 CA--C 1.547 0.833 0 N-CA-C 116.366 1.988 . . . . 0.0 116.366 -170.294 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -85.58 -9.71 56.93 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.874 1.27 . . . . 0.0 113.599 179.078 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.6 tt -84.31 -46.14 12.09 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.561 1.144 . . . . 0.0 112.171 -175.489 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 71.24 -96.27 0.62 Allowed Glycine 0 CA--C 1.533 1.187 0 C-N-CA 123.701 0.667 . . . . 0.0 112.524 177.498 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -101.36 -70.82 0.73 Allowed 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 125.114 1.366 . . . . 0.0 110.706 173.813 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 2.7 t -162.57 110.14 1.3 Allowed 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 126.089 1.755 . . . . 0.0 109.302 -179.867 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 65.7 m-80 -147.03 137.95 23.82 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.992 1.317 . . . . 0.0 110.765 -174.746 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 12.3 m120 -146.93 158.01 43.8 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.284 1.434 . . . . 0.0 112.305 178.581 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 11.2 mp -88.93 -64.49 1.14 Allowed 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 113.342 0.867 . . . . 0.0 113.342 -174.506 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 14.2 pttm -144.86 26.44 1.38 Allowed 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 126.822 2.049 . . . . 0.0 113.797 -174.988 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 13.6 t -148.04 116.47 6.59 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 124.977 1.311 . . . . 0.0 110.199 -172.819 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -138.48 8.06 0.68 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.789 0 C-N-CA 124.996 1.319 . . . . 0.0 113.048 -179.572 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 74.82 -9.66 10.76 Favored Glycine 0 CA--C 1.542 1.742 0 C-N-CA 124.894 1.235 . . . . 0.0 115.311 -173.606 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . 0.273 35.2 mm 63.01 45.19 0.2 Allowed 'Isoleucine or valine' 0 CA--C 1.551 1.012 0 C-N-CA 125.715 1.606 . . . . 0.0 111.611 -176.689 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER 45.71 51.64 10.07 Favored 'General case' 0 CA--C 1.552 1.033 0 C-N-CA 127.07 2.148 . . . . 0.0 114.232 168.722 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 11.7 mt-30 -134.01 15.48 3.88 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 125.693 1.597 . . . . 0.0 112.964 -171.58 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 11.0 mp0 -99.51 43.24 1.07 Allowed 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 126.808 2.043 . . . . 0.0 112.427 -170.276 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 24.5 tt0 -126.21 45.33 2.67 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 125.162 1.385 . . . . 0.0 112.325 -174.969 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 15.2 t -140.64 68.17 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 C-N-CA 124.978 1.311 . . . . 0.0 110.691 -179.911 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 36.0 t -161.49 -72.02 0.06 Allowed 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.375 0.67 . . . . 0.0 112.636 169.946 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 46.2 m -90.19 -22.67 21.57 Favored 'General case' 0 N--CA 1.478 0.972 0 N-CA-C 113.815 1.043 . . . . 0.0 113.815 -173.391 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 7.4 tpt -144.41 136.1 25.84 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 125.668 1.587 . . . . 0.0 109.358 174.823 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 13.6 tt0 -148.52 29.18 0.86 Allowed 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 124.191 0.996 . . . . 0.0 112.009 -172.904 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -123.59 151.18 43.23 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 125.326 1.45 . . . . 0.0 112.83 -171.678 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 52.2 mtmt -93.37 137.05 33.05 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 125.474 1.509 . . . . 0.0 111.149 177.635 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 23.4 t -149.38 124.21 9.9 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 124.912 1.285 . . . . 0.0 110.575 175.632 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 60.5 mtm -146.29 164.78 31.27 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 126.319 1.848 . . . . 0.0 111.284 -174.085 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 9.9 t -121.87 163.58 18.98 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 125.235 1.414 . . . . 0.0 112.107 173.958 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 39.5 t-105 . . . . . 0 C--O 1.252 1.216 0 C-N-CA 126.15 1.78 . . . . 0.0 112.902 -170.964 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.596 0 N-CA-C 111.79 -0.524 . . . . 0.0 111.79 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 23.5 m -117.1 4.94 12.73 Favored 'General case' 0 N--CA 1.481 1.115 0 N-CA-C 114.517 1.303 . . . . 0.0 114.517 -171.997 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 9.0 t60 -73.7 131.54 41.73 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.035 0.934 . . . . 0.0 111.419 -179.211 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -151.61 149.95 29.73 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.446 1.098 . . . . 0.0 111.813 -176.076 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -82.87 153.91 24.9 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 124.22 1.008 . . . . 0.0 113.508 -179.291 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 46.9 m -144.53 142.94 30.57 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 126.319 1.847 . . . . 0.0 110.912 -176.258 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 79.7 mtp -135.29 14.31 3.51 Favored 'General case' 0 N--CA 1.48 1.026 0 N-CA-C 114.083 1.142 . . . . 0.0 114.083 -174.207 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 10.9 t0 -88.2 123.69 68.06 Favored Pre-proline 0 CA--C 1.553 1.082 0 C-N-CA 124.422 1.089 . . . . 0.0 112.027 -175.49 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_endo -87.68 0.2 7.2 Favored 'Trans proline' 0 C--N 1.353 0.779 0 C-N-CA 123.607 2.871 . . . . 0.0 115.224 -178.136 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 74.8 mt -109.85 28.78 8.24 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 124.874 1.27 . . . . 0.0 113.94 -171.376 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -99.15 -5.52 29.94 Favored 'General case' 0 N--CA 1.478 0.93 0 N-CA-C 115.661 1.726 . . . . 0.0 115.661 176.889 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -130.47 -30.58 1.89 Allowed 'General case' 0 N--CA 1.481 1.109 0 N-CA-C 117.17 2.285 . . . . 0.0 117.17 -169.066 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.5 pp -135.4 17.82 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.334 0 C-N-CA 125.337 1.455 . . . . 0.0 113.601 -177.531 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 13.1 tt -51.22 135.16 11.87 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 C-N-CA 125.289 1.435 . . . . 0.0 112.876 -176.826 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -156.24 124.74 5.84 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.876 1.27 . . . . 0.0 110.097 -175.762 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 18.9 p-10 -163.23 62.82 0.18 Allowed 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 122.654 1.216 . . . . 0.0 110.793 -178.101 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 52.5 mt 53.31 59.01 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.75 0 C-N-CA 126.125 1.77 . . . . 0.0 110.378 -173.797 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 4.3 tmmm? -154.12 -42.19 0.09 Allowed 'General case' 0 N--CA 1.475 0.823 0 CA-C-N 114.807 -1.088 . . . . 0.0 113.67 -177.447 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.2 mmmt -107.97 68.19 0.7 Allowed 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 125.54 1.536 . . . . 0.0 112.44 -176.114 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -141.12 11.63 2.18 Favored 'General case' 0 N--CA 1.481 1.081 0 N-CA-C 115.735 1.754 . . . . 0.0 115.735 -174.031 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -79.6 -41.17 27.67 Favored 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 114.101 1.148 . . . . 0.0 114.101 -172.938 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 26.2 m120 -147.18 90.84 1.92 Allowed 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 125.356 1.462 . . . . 0.0 110.255 -176.429 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 12.0 m-20 -136.81 97.13 3.46 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 124.852 1.261 . . . . 0.0 110.534 -175.022 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 25.0 t -146.61 116.76 7.36 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 125.165 1.386 . . . . 0.0 110.105 175.693 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 127.02 -17.4 6.3 Favored Glycine 0 CA--C 1.535 1.294 0 C-N-CA 125.76 1.647 . . . . 0.0 114.739 177.199 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 2.6 p -117.7 100.3 9.87 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.581 0 C-N-CA 126.126 1.771 . . . . 0.0 109.444 175.192 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -154.61 169.55 23.59 Favored 'General case' 0 N--CA 1.474 0.768 0 CA-C-O 121.977 0.894 . . . . 0.0 113.132 -177.209 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 14.1 mt -86.1 18.15 3.22 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 126.59 1.956 . . . . 0.0 113.886 -167.908 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -156.78 140.69 11.57 Favored Pre-proline 0 CA--C 1.55 0.97 0 C-N-CA 127.337 2.255 . . . . 0.0 110.801 -164.133 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 69.3 Cg_endo -85.26 -24.53 1.99 Allowed 'Trans proline' 0 CA--C 1.542 0.901 0 C-N-CA 122.963 2.442 . . . . 0.0 114.0 -175.34 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.462 ' HG ' ' H ' ' A' ' 26' ' ' SER . 6.7 tp -153.94 -159.25 0.95 Allowed 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 126.521 1.928 . . . . 0.0 109.382 -175.608 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.462 ' H ' ' HG ' ' A' ' 25' ' ' LEU . 46.6 p -74.65 41.55 0.15 Allowed 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 127.341 2.256 . . . . 0.0 114.003 177.114 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 8.5 p -151.44 142.18 15.06 Favored Pre-proline 0 CA--C 1.541 0.627 0 C-N-CA 126.269 1.828 . . . . 0.0 110.547 -170.753 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -77.86 60.96 7.46 Favored 'Trans proline' 0 CA--C 1.547 1.162 0 C-N-CA 123.909 3.073 . . . . 0.0 111.774 176.511 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 21.8 tptp 62.15 125.85 0.02 OUTLIER Pre-proline 0 N--CA 1.481 1.104 0 C-N-CA 129.466 3.106 . . . . 0.0 114.3 -169.584 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_endo -74.77 152.36 41.9 Favored 'Trans proline' 0 CA--C 1.539 0.764 0 C-N-CA 122.728 2.285 . . . . 0.0 111.386 173.533 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 56.0 mtmt -80.61 143.2 33.33 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 123.97 0.908 . . . . 0.0 111.861 -179.598 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.1 tp -151.29 132.98 14.89 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 127.094 2.158 . . . . 0.0 108.374 -177.399 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 22.3 mm-40 -146.05 77.49 1.49 Allowed 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 125.766 1.626 . . . . 0.0 109.276 -176.11 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -133.35 75.49 1.62 Allowed 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 124.469 1.108 . . . . 0.0 111.902 -173.881 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.3 mt -109.29 152.73 24.86 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 126.51 1.924 . . . . 0.0 110.609 174.067 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 21.4 t -73.15 166.76 22.51 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 123.053 0.541 . . . . 0.0 110.509 166.95 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -57.52 -44.54 85.13 Favored 'General case' 0 N--CA 1.475 0.794 0 O-C-N 120.705 -1.247 . . . . 0.0 112.744 -175.131 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -74.58 -36.16 63.02 Favored 'General case' 0 N--CA 1.47 0.554 0 O-C-N 121.509 -0.744 . . . . 0.0 112.317 176.045 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 30.0 mm-40 -63.19 -41.47 99.19 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 123.669 0.788 . . . . 0.0 110.438 177.896 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 21.4 ttmm -60.02 -42.59 94.67 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 124.3 1.04 . . . . 0.0 111.159 176.18 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 46.5 mt -69.28 -42.6 81.44 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 CA-C-O 118.341 -0.838 . . . . 0.0 111.115 178.466 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 31.6 mt -63.67 -42.85 97.43 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 CA-C-N 120.586 1.539 . . . . 0.0 110.518 178.218 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -58.47 -47.69 83.23 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.629 1.172 . . . . 0.0 110.621 174.795 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -67.53 -50.42 58.82 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.569 1.147 . . . . 0.0 113.12 -179.597 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -60.46 -26.16 66.56 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-N 118.991 0.814 . . . . 0.0 113.188 -179.625 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 2.1 t80 -74.24 -54.37 7.86 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 123.606 0.762 . . . . 0.0 111.447 177.249 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 45.8 mt -58.81 -35.01 53.86 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 C-N-CA 125.053 1.341 . . . . 0.0 111.23 173.168 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -68.0 -21.07 65.06 Favored 'General case' 0 CA--C 1.547 0.835 0 N-CA-C 113.37 0.878 . . . . 0.0 113.37 175.655 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -95.34 -30.39 13.96 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.833 1.253 . . . . 0.0 113.165 178.406 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 7.7 m -124.54 -22.46 2.48 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 CA-C-N 119.695 1.134 . . . . 0.0 114.049 -173.659 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 89.12 143.96 10.14 Favored Glycine 0 CA--C 1.534 1.256 0 C-N-CA 125.56 1.552 . . . . 0.0 113.246 -172.96 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 58.2 tp -60.08 -17.96 43.49 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 125.707 1.603 . . . . 0.0 115.243 -172.218 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 1.2 pm0 -88.55 -13.4 40.21 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.13 1.372 . . . . 0.0 114.5 176.495 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 77.7 m-20 -110.83 -11.68 14.35 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 114.45 1.278 . . . . 0.0 114.45 -175.084 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 32.2 pt -64.38 156.46 5.46 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 C-N-CA 123.379 0.672 . . . . 0.0 111.205 166.101 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -126.81 144.05 51.08 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 124.752 1.221 . . . . 0.0 110.591 173.886 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -60.62 -26.73 67.23 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.723 0.809 . . . . 0.0 112.099 174.0 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 27.9 mm -63.9 -53.58 42.43 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.396 0 C-N-CA 124.831 1.252 . . . . 0.0 110.6 174.005 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 79.5 m -72.16 -41.52 67.0 Favored 'General case' 0 C--O 1.223 -0.338 0 C-N-CA 123.735 0.814 . . . . 0.0 109.895 -178.331 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 21.0 tp -62.86 -36.88 84.71 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.938 1.295 . . . . 0.0 111.868 177.052 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.498 ' HA ' HG13 ' A' ' 66' ' ' ILE . 43.5 t -54.04 -32.67 55.19 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 124.47 1.108 . . . . 0.0 113.143 168.724 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -100.44 -23.3 14.77 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 114.57 1.322 . . . . 0.0 114.57 -175.153 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 68.5 mmtt -65.76 -38.08 88.09 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 125.093 1.357 . . . . 0.0 111.262 172.861 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.4 mp -111.17 -0.61 16.46 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 125.342 1.457 . . . . 0.0 114.431 -173.535 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 42.7 m-80 55.21 49.51 17.12 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 125.535 1.534 . . . . 0.0 112.78 -173.513 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.498 HG13 ' HA ' ' A' ' 61' ' ' SER . 6.2 pt -109.14 -163.4 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 C-N-CA 126.467 1.907 . . . . 0.0 111.022 -179.33 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.2 p -99.16 161.45 13.62 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.33 1.052 . . . . 0.0 110.538 168.435 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 92.3 t -61.05 -29.11 45.05 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 O-C-N 121.601 -0.687 . . . . 0.0 111.196 173.339 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -82.27 -34.31 28.77 Favored 'General case' 0 N--CA 1.472 0.65 0 O-C-N 120.615 -1.303 . . . . 0.0 110.868 179.489 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 4.1 tttp -80.36 -3.83 51.15 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 126.341 1.856 . . . . 0.0 113.379 178.644 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -102.88 -46.35 4.71 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 129.248 3.019 . . . . 0.0 112.84 167.69 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 36.9 ttmt -69.92 -28.77 65.86 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 124.843 1.257 . . . . 0.0 111.14 -175.307 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 42.5 p-10 -45.7 -55.05 6.92 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 123.239 0.616 . . . . 0.0 111.07 171.646 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 25.0 m-85 -55.14 -42.1 72.6 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 126.021 1.728 . . . . 0.0 112.47 -179.844 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 50.5 mt -70.25 -26.53 29.52 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.728 0 C-N-CA 125.745 1.618 . . . . 0.0 111.467 -178.866 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 30.8 mmmt -87.17 -36.31 18.1 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 125.994 1.718 . . . . 0.0 112.27 175.641 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 73.6 m-20 -76.55 -43.3 39.64 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 125.858 1.663 . . . . 0.0 108.692 -175.381 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 68.9 m -124.77 125.52 44.17 Favored 'General case' 0 C--N 1.342 0.251 0 C-N-CA 124.642 1.177 . . . . 0.0 112.678 175.363 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 7.5 t-20 -151.13 -49.16 0.12 Allowed 'General case' 0 CA--C 1.54 0.558 0 N-CA-C 114.108 1.151 . . . . 0.0 114.108 -171.457 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 53.5 mmm-85 -99.87 8.82 43.85 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 125.624 1.569 . . . . 0.0 113.957 -178.503 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 58.7 tp -123.86 -41.35 2.24 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.678 1.591 . . . . 0.0 114.126 -170.424 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -85.52 66.94 3.69 Favored Glycine 0 CA--C 1.535 1.305 0 N-CA-C 115.169 0.828 . . . . 0.0 115.169 -166.232 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 58.4 mtt85 -112.2 -79.01 0.58 Allowed 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 125.031 1.333 . . . . 0.0 112.207 178.436 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 3.3 t -158.58 123.41 4.22 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 123.685 0.794 . . . . 0.0 111.339 177.303 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 58.5 m-80 -142.25 9.54 1.87 Allowed 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 125.391 1.476 . . . . 0.0 112.768 -177.614 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -135.01 18.77 3.45 Favored 'General case' 0 CA--C 1.554 1.102 0 C-N-CA 125.367 1.467 . . . . 0.0 112.633 -167.027 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 6.2 mp -124.78 160.83 27.78 Favored 'General case' 0 CA--C 1.541 0.596 0 C-N-CA 126.141 1.776 . . . . 0.0 110.254 -176.684 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 53.1 pttt -122.02 8.52 9.86 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 126.274 1.83 . . . . 0.0 113.486 -173.717 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 13.4 t -145.7 121.86 10.81 Favored 'General case' 0 N--CA 1.463 0.202 0 C-N-CA 124.974 1.31 . . . . 0.0 109.831 170.195 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -140.27 4.74 0.55 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.814 0 C-N-CA 125.774 1.629 . . . . 0.0 113.183 -177.58 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 67.33 8.8 52.65 Favored Glycine 0 CA--C 1.539 1.561 0 O-C-N 120.751 -1.218 . . . . 0.0 114.633 -170.304 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . 0.265 2.8 mp 49.43 39.18 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 C-N-CA 127.183 2.193 . . . . 0.0 111.805 -179.928 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 9.8 tp 55.01 22.26 4.28 Favored 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 126.764 2.026 . . . . 0.0 114.91 -178.352 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 36.6 mt-30 -137.28 66.23 1.47 Allowed 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.918 1.687 . . . . 0.0 111.264 -167.254 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -98.25 153.36 18.55 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 125.065 1.346 . . . . 0.0 112.451 177.722 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -141.19 39.29 1.76 Allowed 'General case' 0 N--CA 1.479 0.982 0 N-CA-C 114.431 1.271 . . . . 0.0 114.431 -171.488 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 34.4 m -83.34 148.75 4.87 Favored 'Isoleucine or valine' 0 C--O 1.234 0.279 0 C-N-CA 124.71 1.204 . . . . 0.0 112.663 177.662 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 43.4 t -164.96 -73.36 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 124.477 1.111 . . . . 0.0 112.475 168.919 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 18.2 t -74.64 -31.2 61.89 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 123.863 0.865 . . . . 0.0 112.476 -177.98 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 62.5 mtt -128.3 151.4 49.36 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 125.914 1.685 . . . . 0.0 110.742 169.367 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 20.2 tt0 -141.4 19.65 2.22 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 125.393 1.477 . . . . 0.0 111.822 -176.451 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -119.95 105.52 11.14 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 125.257 1.423 . . . . 0.0 112.048 -170.776 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -127.54 8.79 6.48 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 125.802 1.641 . . . . 0.0 113.584 174.581 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 51.2 p -76.25 160.77 29.35 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 125.417 1.487 . . . . 0.0 112.688 175.002 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 3.5 mmt -144.09 162.2 36.85 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 125.398 1.479 . . . . 0.0 112.526 -179.709 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 10.9 t -107.55 166.23 10.82 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 125.529 1.532 . . . . 0.0 111.752 172.522 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 2.9 t-105 . . . . . 0 C--O 1.253 1.284 0 C-N-CA 125.818 1.647 . . . . 0.0 112.772 -171.751 . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.52 0 N-CA-C 111.217 -0.753 . . . . 0.0 111.217 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 6.8 t -145.09 56.45 1.25 Allowed 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 124.853 1.261 . . . . 0.0 111.311 179.97 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 42.2 t-80 -136.09 92.13 2.76 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 125.301 1.441 . . . . 0.0 109.972 -179.239 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 25.5 ptt? -146.12 21.72 1.39 Allowed 'General case' 0 N--CA 1.475 0.822 0 N-CA-C 114.937 1.458 . . . . 0.0 114.937 -170.898 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -153.99 134.29 13.37 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 123.553 0.741 . . . . 0.0 112.758 179.753 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 40.1 m -151.25 103.08 2.98 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 125.981 1.712 . . . . 0.0 110.294 -173.351 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 16.9 ttp -147.77 24.1 1.09 Allowed 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 124.082 0.953 . . . . 0.0 113.112 -179.565 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 -120.42 130.7 24.72 Favored Pre-proline 0 CA--C 1.547 0.833 0 C-N-CA 124.834 1.254 . . . . 0.0 111.848 -171.931 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -80.07 -15.73 11.53 Favored 'Trans proline' 0 C--N 1.352 0.75 0 C-N-CA 123.084 2.522 . . . . 0.0 114.992 -175.454 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 96.9 mt -116.78 42.05 2.57 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 126.165 1.786 . . . . 0.0 111.806 -174.884 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -113.18 1.29 15.2 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 114.307 1.225 . . . . 0.0 114.307 179.241 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -119.22 -56.0 2.11 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 124.767 1.227 . . . . 0.0 113.063 -167.762 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.1 pp -129.72 14.38 2.44 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.875 0 C-N-CA 126.407 1.883 . . . . 0.0 112.892 -173.199 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 9.4 tt -44.73 124.05 0.83 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 C-N-CA 125.12 1.368 . . . . 0.0 112.254 178.074 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -147.1 12.61 1.09 Allowed 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 113.812 1.042 . . . . 0.0 113.812 -176.62 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -88.46 7.86 30.76 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 114.696 1.369 . . . . 0.0 114.696 -171.753 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 14.2 tt -148.71 30.61 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 C-N-CA 125.763 1.625 . . . . 0.0 113.318 -172.034 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 60.0 tttp -131.87 -43.49 0.99 Allowed 'General case' 0 N--CA 1.476 0.837 0 N-CA-C 114.28 1.215 . . . . 0.0 114.28 -179.437 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 52.2 mtmt -129.32 167.83 17.15 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 126.503 1.921 . . . . 0.0 112.436 179.224 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 57.26 35.99 26.8 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 125.76 1.624 . . . . 0.0 113.189 -176.414 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -145.28 -64.17 0.33 Allowed 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 125.202 1.401 . . . . 0.0 112.515 -176.841 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 23.1 t-20 -148.62 126.84 12.15 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.327 1.451 . . . . 0.0 110.294 -177.894 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -143.28 160.46 40.44 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 125.559 1.544 . . . . 0.0 111.314 173.687 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 87.7 p -134.1 3.47 3.42 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 126.016 1.726 . . . . 0.0 114.881 -176.186 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -163.9 105.28 0.25 Allowed Glycine 0 CA--C 1.531 1.056 0 CA-C-N 119.084 0.857 . . . . 0.0 113.414 172.191 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 4.7 t -125.78 40.83 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.072 0 C-N-CA 125.644 1.578 . . . . 0.0 111.011 -174.992 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -149.98 164.45 35.45 Favored 'General case' 0 N--CA 1.478 0.937 0 N-CA-C 114.737 1.384 . . . . 0.0 114.737 -176.768 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -109.79 26.37 10.73 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 126.354 1.862 . . . . 0.0 114.923 -165.684 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -99.54 122.48 51.4 Favored Pre-proline 0 CA--C 1.55 0.95 0 C-N-CA 125.177 1.391 . . . . 0.0 111.45 -172.128 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -78.65 -23.61 8.15 Favored 'Trans proline' 0 CA--C 1.541 0.827 0 C-N-CA 123.061 2.507 . . . . 0.0 113.001 -179.828 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.409 ' HG ' ' H ' ' A' ' 26' ' ' SER . 7.0 tp -148.44 -156.15 0.69 Allowed 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 126.95 2.1 . . . . 0.0 108.989 178.926 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.409 ' H ' ' HG ' ' A' ' 25' ' ' LEU . 56.2 p -75.72 37.42 0.14 Allowed 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 126.608 1.963 . . . . 0.0 114.638 179.687 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 8.8 p -157.07 139.97 10.84 Favored Pre-proline 0 CA--C 1.542 0.668 0 C-N-CA 126.219 1.807 . . . . 0.0 110.934 -169.989 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -77.88 69.09 7.55 Favored 'Trans proline' 0 CA--C 1.545 1.067 0 C-N-CA 124.001 3.134 . . . . 0.0 111.977 179.282 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 28.6 tptt 59.56 105.67 0.03 OUTLIER Pre-proline 0 N--CA 1.481 1.109 0 C-N-CA 128.981 2.912 . . . . 0.0 113.961 -177.046 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 95.6 Cg_endo -75.59 148.92 33.67 Favored 'Trans proline' 0 CA--C 1.54 0.782 0 C-N-CA 122.74 2.293 . . . . 0.0 112.055 -176.592 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 63.6 pttt -63.36 141.67 58.68 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 124.267 1.027 . . . . 0.0 113.073 -177.344 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 29.0 tp -128.01 143.06 51.07 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 125.678 1.591 . . . . 0.0 111.414 -175.129 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 76.8 mm-40 -138.63 64.07 1.5 Allowed 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 125.377 1.471 . . . . 0.0 110.555 -178.127 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 27.6 mt-10 -127.32 68.32 1.29 Allowed 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 125.021 1.329 . . . . 0.0 112.274 -175.683 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.9 mt -123.44 149.92 44.46 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 127.086 2.155 . . . . 0.0 110.044 172.371 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 17.9 m -71.41 167.56 19.33 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 123.749 0.819 . . . . 0.0 110.733 169.293 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -56.25 -45.37 80.06 Favored 'General case' 0 N--CA 1.478 0.94 0 O-C-N 120.591 -1.318 . . . . 0.0 113.357 -174.799 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 10.4 tt0 -74.61 -42.1 59.23 Favored 'General case' 0 N--CA 1.471 0.593 0 O-C-N 121.416 -0.802 . . . . 0.0 111.46 177.004 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 29.2 mm-40 -55.3 -44.94 76.21 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.079 0.952 . . . . 0.0 110.812 176.577 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt -60.55 -42.03 95.76 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 125.058 1.343 . . . . 0.0 111.396 178.457 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 45.4 mt -69.29 -40.59 80.4 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 CA-C-O 118.117 -0.944 . . . . 0.0 111.245 177.912 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 38.2 mt -64.08 -43.05 97.42 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.848 0 CA-C-N 120.256 1.389 . . . . 0.0 110.205 177.301 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -60.24 -47.67 85.01 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.372 1.069 . . . . 0.0 110.931 177.159 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -67.51 -50.29 59.53 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 124.886 1.274 . . . . 0.0 112.328 179.722 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -64.2 -26.06 68.35 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 118.999 0.818 . . . . 0.0 112.783 -176.61 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.462 ' CD1' ' HE2' ' A' ' 63' ' ' LYS . 1.1 t80 -67.61 -58.43 4.69 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 123.913 0.885 . . . . 0.0 110.509 174.421 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.0 mt -62.61 -35.63 71.25 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 C-N-CA 126.539 1.935 . . . . 0.0 111.368 179.512 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -70.96 -26.64 63.25 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 123.881 0.873 . . . . 0.0 112.617 178.25 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -88.11 -38.84 15.05 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.267 1.027 . . . . 0.0 112.541 175.329 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.5 m -108.56 -6.99 10.96 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.147 0 N-CA-C 114.529 1.307 . . . . 0.0 114.529 -172.616 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 87.52 26.46 30.09 Favored Glycine 0 CA--C 1.531 1.056 0 C-N-CA 124.695 1.141 . . . . 0.0 115.476 161.865 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 57.15 10.21 0.8 Allowed 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 127.223 2.209 . . . . 0.0 115.09 -174.957 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 4.7 pt20 -123.27 -3.78 8.44 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 125.141 1.376 . . . . 0.0 113.713 -168.561 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 59.5 m-80 -123.47 0.52 8.85 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.953 1.301 . . . . 0.0 113.196 174.75 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.434 HG22 ' CE2' ' A' ' 46' ' ' TYR . 19.0 pt -74.9 152.33 6.66 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.57 0 CA-C-O 121.099 0.476 . . . . 0.0 111.223 175.125 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -140.04 143.84 36.58 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 124.668 1.187 . . . . 0.0 109.581 179.625 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -60.4 -28.24 68.08 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 123.417 0.687 . . . . 0.0 112.247 179.732 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.8 mp -64.78 -48.81 82.95 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 C-N-CA 125.467 1.507 . . . . 0.0 110.157 175.222 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 78.2 m -80.71 -41.43 23.65 Favored 'General case' 0 C--O 1.223 -0.326 0 C-N-CA 124.103 0.961 . . . . 0.0 110.202 -174.722 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 20.0 tp -62.51 -35.6 79.9 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 125.214 1.406 . . . . 0.0 112.265 173.448 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.458 ' HA ' HG13 ' A' ' 66' ' ' ILE . 29.6 t -54.51 -33.47 59.96 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.706 1.203 . . . . 0.0 112.366 168.781 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -94.89 -31.85 13.5 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.755 1.222 . . . . 0.0 113.68 -176.322 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.462 ' HE2' ' CD1' ' A' ' 46' ' ' TYR . 1.0 OUTLIER -62.02 -32.75 73.27 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 125.42 1.488 . . . . 0.0 112.52 178.413 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.6 mp -118.6 8.34 11.95 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.751 1.221 . . . . 0.0 114.01 -177.97 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 44.9 m-80 53.37 56.22 7.66 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 126.243 1.817 . . . . 0.0 113.304 -178.659 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.458 HG13 ' HA ' ' A' ' 61' ' ' SER . 1.5 pt -122.08 -168.33 0.5 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.701 0 C-N-CA 127.132 2.173 . . . . 0.0 110.536 -173.738 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 2.4 p -93.48 160.2 14.9 Favored 'General case' 0 N--CA 1.476 0.835 0 O-C-N 121.264 -0.898 . . . . 0.0 111.04 170.641 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 86.9 t -61.73 -29.98 47.39 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 C-N-CA 123.086 0.554 . . . . 0.0 111.271 172.527 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -79.25 -37.73 37.23 Favored 'General case' 0 N--CA 1.468 0.429 0 O-C-N 120.854 -1.154 . . . . 0.0 110.283 -178.224 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 5.2 tmtm? -67.66 -45.31 75.65 Favored 'General case' 0 C--N 1.339 0.138 0 C-N-CA 124.56 1.144 . . . . 0.0 110.741 178.275 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -60.3 -45.86 91.9 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.713 1.605 . . . . 0.0 113.278 170.877 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 33.5 ttmt -69.46 -27.12 64.96 Favored 'General case' 0 N--CA 1.466 0.373 0 O-C-N 121.005 -1.059 . . . . 0.0 111.546 -177.251 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -55.67 -43.67 76.55 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-O 119.372 -0.347 . . . . 0.0 111.334 175.806 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 30.7 m-85 -62.16 -44.35 96.8 Favored 'General case' 0 C--O 1.224 -0.263 0 C-N-CA 125.269 1.428 . . . . 0.0 111.515 177.339 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 65.0 mt -64.59 -30.34 49.94 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.586 0 C-N-CA 123.947 0.899 . . . . 0.0 110.571 178.653 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -77.24 -38.01 52.03 Favored 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 125.0 1.32 . . . . 0.0 113.368 -178.704 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 8.3 p30 -92.86 -41.86 9.83 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 119.105 0.866 . . . . 0.0 111.587 178.841 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 4.9 t -86.2 68.05 10.15 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-O 121.926 0.87 . . . . 0.0 111.252 -176.58 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -133.17 -10.92 2.92 Favored 'General case' 0 CA--C 1.543 0.697 0 N-CA-C 114.449 1.277 . . . . 0.0 114.449 -173.38 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 2.5 mpt_? -103.32 -10.03 19.01 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 125.112 1.365 . . . . 0.0 112.747 171.75 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 9.3 tt -74.36 -30.93 62.21 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.167 1.387 . . . . 0.0 112.019 174.906 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -162.87 152.35 22.48 Favored Glycine 0 CA--C 1.529 0.96 0 C-N-CA 124.558 1.075 . . . . 0.0 112.984 174.698 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 13.6 tpp85 -150.06 -70.4 0.19 Allowed 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 113.708 1.003 . . . . 0.0 113.708 -173.295 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 14.4 t -162.73 23.49 0.1 Allowed 'General case' 0 N--CA 1.483 1.178 0 CA-C-O 122.515 1.15 . . . . 0.0 112.682 -166.658 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 72.5 m-80 -100.33 77.13 1.92 Allowed 'General case' 0 CA--C 1.542 0.637 0 O-C-N 120.409 -1.432 . . . . 0.0 111.485 -171.145 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 13.7 m120 -136.94 160.05 40.05 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.209 1.404 . . . . 0.0 113.285 -178.754 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 9.4 mp -114.25 169.4 9.05 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 127.53 2.332 . . . . 0.0 109.799 178.437 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 19.2 pttp -127.74 14.01 6.94 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 126.11 1.764 . . . . 0.0 113.506 -173.146 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 14.7 t -148.77 127.35 12.41 Favored 'General case' 0 C--O 1.233 0.212 0 C-N-CA 125.459 1.503 . . . . 0.0 109.604 175.488 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -137.69 6.68 0.75 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.732 0 C-N-CA 125.858 1.663 . . . . 0.0 113.228 -176.587 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 64.1 12.81 51.16 Favored Glycine 0 CA--C 1.538 1.52 0 O-C-N 120.776 -1.203 . . . . 0.0 114.184 -169.983 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . 0.273 3.7 mp 51.78 40.83 0.34 Allowed 'Isoleucine or valine' 0 CA--C 1.548 0.875 0 C-N-CA 126.804 2.042 . . . . 0.0 111.312 179.731 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 54.59 23.61 4.79 Favored 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 127.109 2.164 . . . . 0.0 114.759 -179.413 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 35.9 mt-30 -135.53 65.64 1.54 Allowed 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.915 1.686 . . . . 0.0 110.829 -169.462 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -126.23 152.82 45.57 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 125.549 1.54 . . . . 0.0 111.858 175.937 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -83.11 88.09 6.9 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 124.226 1.01 . . . . 0.0 110.992 178.264 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 12.2 p -149.06 145.77 17.73 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 C-N-CA 124.909 1.284 . . . . 0.0 111.724 176.08 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 75.0 m -147.38 -54.19 0.22 Allowed 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 124.724 1.21 . . . . 0.0 112.814 -178.295 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 25.9 t -107.51 -46.52 3.82 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 124.521 1.128 . . . . 0.0 112.955 -175.424 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 94.8 mtp -88.86 51.49 2.18 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 125.021 1.328 . . . . 0.0 112.143 -176.162 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 21.7 tt0 -80.41 57.73 2.92 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 125.42 1.488 . . . . 0.0 112.126 -177.114 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -137.36 124.74 21.93 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.439 1.496 . . . . 0.0 111.196 -179.522 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 59.9 mtpt -138.15 -46.14 0.52 Allowed 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 125.448 1.499 . . . . 0.0 112.587 -179.029 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 73.9 p -151.38 159.19 44.38 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 125.917 1.687 . . . . 0.0 111.84 178.304 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 53.2 mtt -142.69 165.03 28.5 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 125.761 1.624 . . . . 0.0 112.14 -179.838 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 13.0 t -129.64 164.98 22.72 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 125.914 1.686 . . . . 0.0 111.465 172.332 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 30.9 t-105 . . . . . 0 C--O 1.253 1.281 0 C-N-CA 125.313 1.445 . . . . 0.0 112.921 -168.204 . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.516 0 N-CA-C 110.774 -0.93 . . . . 0.0 110.774 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 48.7 m -139.6 162.22 35.61 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 125.201 1.401 . . . . 0.0 112.156 -173.875 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 66.1 m80 -128.27 157.06 41.95 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 125.535 1.534 . . . . 0.0 111.891 179.754 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 2.3 mpt? -118.61 148.07 43.07 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 125.146 1.378 . . . . 0.0 111.929 -176.253 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -78.58 152.24 31.95 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.134 0.974 . . . . 0.0 112.668 178.25 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 19.2 t -81.73 137.93 35.29 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 124.271 1.029 . . . . 0.0 111.766 177.68 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 12.1 tmm? -150.26 108.04 3.69 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.679 1.192 . . . . 0.0 109.956 178.285 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 77.4 m-20 39.72 58.66 6.8 Favored Pre-proline 0 CA--C 1.555 1.135 0 C-N-CA 127.346 2.258 . . . . 0.0 115.159 177.994 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 78.7 Cg_endo -70.02 -16.53 36.48 Favored 'Trans proline' 0 C--N 1.352 0.752 0 C-N-CA 123.29 2.66 . . . . 0.0 115.365 -170.801 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.445 HD23 ' H ' ' A' ' 4' ' ' LEU . 2.4 pt? -113.93 13.1 18.25 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 126.148 1.779 . . . . 0.0 115.011 -176.974 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -74.94 -2.03 25.2 Favored 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 115.166 1.543 . . . . 0.0 115.166 -175.768 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -125.65 -61.86 1.23 Allowed 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 125.407 1.483 . . . . 0.0 112.951 -163.392 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.4 pp -104.16 -14.83 8.46 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 C-N-CA 124.681 1.193 . . . . 0.0 113.53 -177.105 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . 0.291 14.2 tt 34.44 48.95 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.27 0 C-N-CA 127.502 2.321 . . . . 0.0 116.234 170.04 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -95.94 37.33 1.23 Allowed 'General case' 0 CA--C 1.547 0.83 0 O-C-N 120.418 -1.426 . . . . 0.0 113.077 -170.902 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 -109.44 10.72 25.29 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 113.851 1.056 . . . . 0.0 113.851 -176.635 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 6.9 tp -150.14 31.34 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.48 1.047 0 C-N-CA 125.013 1.325 . . . . 0.0 113.61 -173.299 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 7.0 tmtm? -137.57 -46.04 0.55 Allowed 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 123.717 0.807 . . . . 0.0 113.045 -176.827 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 52.9 mtpt -132.79 157.47 44.89 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 127.158 2.183 . . . . 0.0 112.795 -177.473 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -101.03 104.14 15.28 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 125.313 1.445 . . . . 0.0 110.201 176.985 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -156.12 173.03 17.42 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.815 1.246 . . . . 0.0 112.333 -170.111 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 26.7 t-20 -139.75 -47.54 0.45 Allowed 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 124.157 0.983 . . . . 0.0 113.506 -179.269 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 15.1 t0 -149.76 133.81 17.11 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 124.768 1.227 . . . . 0.0 110.514 178.636 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 37.8 m -127.34 25.73 6.1 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 125.213 1.405 . . . . 0.0 113.311 179.74 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 82.64 65.61 1.6 Allowed Glycine 0 CA--C 1.53 0.983 0 C-N-CA 124.587 1.089 . . . . 0.0 112.372 178.935 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 7.9 p -131.28 14.54 1.9 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.999 0 C-N-CA 125.943 1.697 . . . . 0.0 113.029 -169.866 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 3.6 m -134.37 149.67 50.85 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 124.614 1.165 . . . . 0.0 112.681 -163.007 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.486 HD23 ' H ' ' A' ' 22' ' ' LEU . 1.8 pt? -97.28 28.21 3.78 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 116.091 1.885 . . . . 0.0 116.091 -170.961 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -148.37 149.29 31.36 Favored Pre-proline 0 CA--C 1.548 0.892 0 C-N-CA 125.251 1.42 . . . . 0.0 111.773 179.88 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -78.62 -51.52 0.07 OUTLIER 'Trans proline' 0 C--N 1.352 0.717 0 C-N-CA 122.669 2.246 . . . . 0.0 112.76 -175.887 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -159.59 -52.8 0.06 Allowed 'General case' 0 N--CA 1.476 0.838 0 CA-C-O 122.06 0.933 . . . . 0.0 112.818 176.366 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 13.2 t -152.06 163.08 40.07 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 127.666 2.386 . . . . 0.0 110.312 177.864 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 40.2 t 62.05 151.23 0.1 Allowed Pre-proline 0 N--CA 1.482 1.132 0 C-N-CA 127.334 2.254 . . . . 0.0 112.728 -169.839 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -65.48 76.93 0.26 Allowed 'Trans proline' 0 CA--C 1.547 1.136 0 C-N-CA 123.456 2.771 . . . . 0.0 111.754 168.022 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 43.1 tptt 53.31 81.09 0.27 Allowed Pre-proline 0 CA--C 1.549 0.911 0 C-N-CA 129.196 2.998 . . . . 0.0 113.906 176.069 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_endo -69.85 136.47 32.84 Favored 'Trans proline' 0 C--N 1.351 0.707 0 C-N-CA 123.192 2.594 . . . . 0.0 113.036 -179.825 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.3 151.64 9.5 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 126.027 1.731 . . . . 0.0 115.209 -169.02 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 18.7 tp -138.86 145.04 39.51 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 126.488 1.915 . . . . 0.0 110.931 -171.852 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -137.69 69.39 1.4 Allowed 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 125.614 1.566 . . . . 0.0 110.167 178.084 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 25.7 mt-10 -134.02 79.0 1.79 Allowed 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 124.577 1.151 . . . . 0.0 112.83 -174.886 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.7 mt -126.18 152.86 45.44 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 126.813 2.045 . . . . 0.0 110.194 169.277 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 18.9 t -75.31 166.77 23.11 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 123.178 0.591 . . . . 0.0 110.503 169.727 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -55.83 -46.04 78.21 Favored 'General case' 0 N--CA 1.476 0.844 0 O-C-N 120.591 -1.318 . . . . 0.0 113.077 -173.017 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 11.8 tt0 -72.29 -42.22 65.77 Favored 'General case' 0 N--CA 1.47 0.566 0 O-C-N 121.53 -0.731 . . . . 0.0 111.268 176.796 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 14.8 mm100 -60.22 -42.25 94.78 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.797 0.839 . . . . 0.0 110.695 179.744 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 41.4 ttmt -60.73 -43.07 98.35 Favored 'General case' 0 N--CA 1.466 0.332 0 C-N-CA 125.194 1.398 . . . . 0.0 111.008 176.538 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 53.2 mt -67.25 -41.59 86.83 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 CA-C-O 118.179 -0.915 . . . . 0.0 111.155 177.185 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 44.1 mt -63.89 -45.38 97.14 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.928 0 CA-C-N 120.593 1.542 . . . . 0.0 110.166 178.097 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -58.18 -49.6 76.46 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.709 1.204 . . . . 0.0 110.87 176.953 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -65.59 -52.18 54.08 Favored 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 125.028 1.331 . . . . 0.0 112.677 179.515 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 -61.43 -29.21 69.8 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-N 119.169 0.895 . . . . 0.0 112.798 -179.294 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.46 ' CE1' HG22 ' A' ' 55' ' ' ILE . 1.4 t80 -66.83 -56.42 10.45 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 118.685 0.675 . . . . 0.0 110.849 175.342 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 81.1 mt -65.03 -32.01 56.44 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 C-N-CA 126.886 2.074 . . . . 0.0 111.763 178.856 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -73.0 -28.06 62.15 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 123.9 0.88 . . . . 0.0 112.436 176.149 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -85.29 -39.92 17.16 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.01 0.924 . . . . 0.0 112.165 176.054 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.1 m -109.94 -3.62 10.56 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.199 0 N-CA-C 114.152 1.167 . . . . 0.0 114.152 -173.761 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 86.43 19.87 55.86 Favored Glycine 0 N--CA 1.474 1.172 0 C-N-CA 125.539 1.542 . . . . 0.0 115.525 160.538 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 57.13 5.53 0.26 Allowed 'General case' 0 CA--C 1.555 1.164 0 C-N-CA 127.057 2.143 . . . . 0.0 114.706 -166.778 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 15.9 mt-30 -98.81 -14.31 19.74 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 125.901 1.681 . . . . 0.0 112.751 -173.481 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 39.2 m-80 -131.22 6.23 4.51 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 113.937 1.088 . . . . 0.0 113.937 -171.962 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.46 HG22 ' CE1' ' A' ' 46' ' ' TYR . 20.1 pt -77.23 154.38 5.49 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 CA-C-N 118.691 0.678 . . . . 0.0 111.81 176.123 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -133.15 144.01 49.61 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 124.374 1.069 . . . . 0.0 110.306 175.959 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -60.58 -29.17 69.01 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.959 0.904 . . . . 0.0 111.756 177.995 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.9 mp -63.43 -57.18 12.97 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.218 0 C-N-CA 124.81 1.244 . . . . 0.0 108.903 173.93 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 52.9 m -68.42 -45.67 71.98 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 123.696 0.799 . . . . 0.0 109.764 -175.138 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 19.0 tp -57.87 -35.77 71.42 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.915 1.286 . . . . 0.0 112.175 174.324 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.447 ' HA ' HG13 ' A' ' 66' ' ' ILE . 19.4 p -63.91 -20.67 66.02 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 113.883 1.068 . . . . 0.0 113.883 172.551 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 13.6 mptt -103.82 -31.4 9.82 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 125.224 1.409 . . . . 0.0 113.351 -178.287 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 7.2 mtpp -65.87 -28.98 69.36 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 120.035 1.289 . . . . 0.0 112.105 176.836 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.9 mp -115.55 4.48 14.2 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.402 1.481 . . . . 0.0 114.381 -178.653 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 31.9 m-80 56.19 59.57 3.63 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 125.998 1.719 . . . . 0.0 113.651 179.611 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.447 HG13 ' HA ' ' A' ' 61' ' ' SER . 0.9 OUTLIER -135.41 176.63 8.11 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 C-N-CA 126.607 1.963 . . . . 0.0 111.492 -169.853 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.4 p -77.09 158.73 30.3 Favored 'General case' 0 N--CA 1.479 0.985 0 O-C-N 120.947 -1.095 . . . . 0.0 111.317 172.006 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 98.8 t -64.33 -28.5 45.03 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.984 0 O-C-N 121.684 -0.635 . . . . 0.0 111.349 173.644 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -77.86 -38.13 46.72 Favored 'General case' 0 N--CA 1.469 0.475 0 O-C-N 121.183 -0.948 . . . . 0.0 110.055 179.449 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 5.5 tmtm? -67.25 -43.24 82.4 Favored 'General case' 0 N--CA 1.462 0.175 0 C-N-CA 125.138 1.375 . . . . 0.0 111.346 177.244 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -60.7 -50.0 75.25 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.861 1.264 . . . . 0.0 112.92 170.277 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 33.8 ttmt -68.44 -24.79 64.77 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 124.615 1.166 . . . . 0.0 111.846 -176.525 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -53.64 -40.05 65.49 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 123.679 0.792 . . . . 0.0 111.444 171.899 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -70.79 -42.41 70.37 Favored 'General case' 0 C--O 1.224 -0.24 0 C-N-CA 124.152 0.981 . . . . 0.0 111.633 176.593 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 42.9 mt -65.45 -30.82 51.36 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 C-N-CA 124.711 1.204 . . . . 0.0 111.414 -179.289 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 12.4 tppt? -89.47 -22.8 22.3 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.808 1.643 . . . . 0.0 113.002 179.924 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 56.6 m-20 -82.9 -47.68 11.54 Favored 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 124.942 1.297 . . . . 0.0 110.409 172.961 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 68.0 m -118.69 112.51 19.88 Favored 'General case' 0 N--CA 1.464 0.229 0 C-N-CA 124.608 1.163 . . . . 0.0 112.034 -177.609 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -146.88 -71.4 0.23 Allowed 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 113.213 0.819 . . . . 0.0 113.213 -176.733 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 3.9 mpt_? -77.43 -16.82 58.6 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 124.637 1.175 . . . . 0.0 112.818 178.901 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -98.03 24.34 7.14 Favored 'General case' 0 CA--C 1.551 0.996 0 C-N-CA 127.129 2.172 . . . . 0.0 112.604 176.373 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -72.09 -106.43 0.06 OUTLIER Glycine 0 CA--C 1.538 1.487 0 O-C-N 120.99 -1.069 . . . . 0.0 113.27 177.52 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 80.5 mtt-85 -132.74 159.99 38.1 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 124.566 1.146 . . . . 0.0 113.201 175.598 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 10.1 t -86.66 36.25 0.7 Allowed 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 127.366 2.267 . . . . 0.0 113.615 -173.162 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 69.2 m-80 -124.07 140.7 52.72 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 125.03 1.332 . . . . 0.0 111.244 -179.275 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 18.6 t-20 -138.11 152.49 48.8 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 125.303 1.441 . . . . 0.0 111.426 -178.416 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 10.7 mp -114.46 162.69 16.36 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 127.151 2.181 . . . . 0.0 110.647 -172.041 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 48.5 pttt -120.56 16.89 12.07 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 126.605 1.962 . . . . 0.0 112.753 -173.729 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 14.6 t -146.17 122.7 11.07 Favored 'General case' 0 C--O 1.233 0.205 0 C-N-CA 125.477 1.511 . . . . 0.0 109.662 174.04 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -138.87 10.28 0.65 Allowed 'Isoleucine or valine' 0 CA--C 1.548 0.893 0 C-N-CA 125.95 1.7 . . . . 0.0 112.95 -177.106 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 77.69 -12.74 14.73 Favored Glycine 0 CA--C 1.536 1.345 0 C-N-CA 124.746 1.165 . . . . 0.0 114.505 -165.561 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 4.5 mp 54.67 97.42 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.53 0 C-N-CA 127.373 2.269 . . . . 0.0 109.825 -163.015 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 32.1 tp -67.41 76.46 0.16 Allowed 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 125.733 1.613 . . . . 0.0 112.919 -172.988 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 83.7 mt-30 -92.34 -47.97 6.91 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 124.522 1.129 . . . . 0.0 112.958 178.944 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -143.62 145.43 32.48 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 125.155 1.382 . . . . 0.0 111.108 -168.755 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -99.99 97.71 8.54 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 124.49 1.116 . . . . 0.0 110.159 175.696 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 25.8 t -129.18 -67.48 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 C-N-CA 124.56 1.144 . . . . 0.0 112.589 -172.311 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 31.2 p 51.43 11.41 0.12 Allowed 'General case' 0 CA--C 1.547 0.851 0 N-CA-C 118.89 2.922 . . . . 0.0 118.89 177.31 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 27.6 t -123.79 -44.27 2.09 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 125.349 1.46 . . . . 0.0 113.318 -178.161 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 3.0 tmm? -137.36 60.05 1.66 Allowed 'General case' 0 N--CA 1.474 0.775 0 CA-C-O 123.388 1.566 . . . . 0.0 110.148 178.552 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 22.1 tt0 -82.5 53.78 2.43 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 126.022 1.729 . . . . 0.0 112.63 -170.716 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -75.5 94.01 3.07 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 124.846 1.258 . . . . 0.0 111.769 -178.741 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 20.0 mmmt -128.24 109.46 11.5 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 126.494 1.918 . . . . 0.0 109.439 -177.746 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 11.2 t -151.81 82.49 1.28 Allowed 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.107 0.963 . . . . 0.0 111.791 -178.321 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 26.6 ptt? -156.56 162.82 39.89 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 125.532 1.533 . . . . 0.0 111.605 172.016 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 4.2 m -141.75 144.33 33.95 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 124.569 1.148 . . . . 0.0 110.535 172.612 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 3.4 t-105 . . . . . 0 C--O 1.252 1.234 0 C-N-CA 125.415 1.486 . . . . 0.0 112.675 -172.908 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.622 0 N-CA-C 111.587 -0.605 . . . . 0.0 111.587 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 1.6 t -137.82 22.77 2.87 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 124.626 1.171 . . . . 0.0 113.461 -176.31 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 69.0 m80 -136.51 150.3 48.6 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 125.557 1.543 . . . . 0.0 112.3 -176.092 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 45.9 ttm -102.06 61.62 0.87 Allowed 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 125.396 1.478 . . . . 0.0 110.99 178.077 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -154.61 169.62 23.43 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.135 1.374 . . . . 0.0 112.17 -178.257 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 29.8 t -122.38 141.02 52.01 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 125.302 1.441 . . . . 0.0 111.447 176.272 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 17.7 ttt -144.44 29.78 1.26 Allowed 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 125.421 1.488 . . . . 0.0 111.617 -178.076 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 -119.65 94.11 48.15 Favored Pre-proline 0 CA--C 1.545 0.778 0 C-N-CA 125.102 1.361 . . . . 0.0 111.481 -172.224 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -78.83 -13.77 14.23 Favored 'Trans proline' 0 C--N 1.351 0.658 0 C-N-CA 122.977 2.451 . . . . 0.0 114.9 -178.949 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 96.8 mt -101.71 46.07 0.95 Allowed 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 126.015 1.726 . . . . 0.0 113.189 -170.709 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -109.79 -2.66 17.19 Favored 'General case' 0 N--CA 1.479 0.975 0 N-CA-C 114.885 1.439 . . . . 0.0 114.885 171.693 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -128.63 -55.76 1.22 Allowed 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 124.303 1.041 . . . . 0.0 113.18 -166.384 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.8 pp -108.4 9.12 9.21 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 C-N-CA 125.593 1.557 . . . . 0.0 112.882 -178.201 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 10.0 tt -54.09 117.62 0.99 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.825 0 C-N-CA 123.781 0.833 . . . . 0.0 111.769 178.301 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -150.35 15.48 0.8 Allowed 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 124.131 0.972 . . . . 0.0 113.621 -178.167 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -85.2 5.2 31.12 Favored 'General case' 0 CA--C 1.545 0.763 0 N-CA-C 114.931 1.456 . . . . 0.0 114.931 -169.183 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 13.6 tt -146.77 24.4 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.805 0 C-N-CA 125.396 1.478 . . . . 0.0 114.262 -170.217 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 35.4 ttpt -118.56 -48.15 2.51 Favored 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 114.546 1.313 . . . . 0.0 114.546 177.98 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 59.2 mttp 51.29 -175.25 0.02 OUTLIER 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 126.379 1.872 . . . . 0.0 113.978 -170.904 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 28.3 mt-10 56.56 34.11 23.83 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 126.14 1.776 . . . . 0.0 114.984 171.968 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -111.02 15.29 21.78 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 125.15 1.38 . . . . 0.0 114.58 -166.416 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 64.6 t-20 -106.1 117.99 35.46 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.971 1.308 . . . . 0.0 110.958 -179.45 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 24.7 m-20 -110.71 14.46 22.28 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 125.634 1.573 . . . . 0.0 114.466 -178.432 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 74.9 m -68.2 115.59 7.84 Favored 'General case' 0 CA--C 1.535 0.387 0 O-C-N 121.215 -0.928 . . . . 0.0 112.088 177.832 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 128.51 -12.79 6.26 Favored Glycine 0 CA--C 1.534 1.235 0 C-N-CA 125.758 1.647 . . . . 0.0 115.422 175.616 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 92.3 t -131.22 127.46 60.51 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.789 0 C-N-CA 125.083 1.353 . . . . 0.0 109.875 178.182 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.441 HG22 ' H ' ' A' ' 22' ' ' LEU . 0.3 OUTLIER 58.49 -163.08 0.21 Allowed 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 125.117 1.367 . . . . 0.0 111.883 -176.968 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.441 ' H ' HG22 ' A' ' 21' ' ' THR . 1.2 pt? -134.91 33.95 3.15 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 125.445 1.498 . . . . 0.0 113.145 -179.406 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -107.61 111.92 62.5 Favored Pre-proline 0 CA--C 1.547 0.849 0 C-N-CA 124.862 1.265 . . . . 0.0 111.954 -173.21 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo -80.27 -31.08 1.8 Allowed 'Trans proline' 0 CA--C 1.54 0.791 0 C-N-CA 122.312 2.008 . . . . 0.0 113.539 -178.805 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 18.8 tp -152.53 61.6 0.81 Allowed 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.666 1.187 . . . . 0.0 111.564 -175.74 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.2 t 56.6 40.42 29.38 Favored 'General case' 0 N--CA 1.479 0.987 0 N-CA-C 114.261 1.208 . . . . 0.0 114.261 178.586 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 10.2 p -154.43 142.71 14.34 Favored Pre-proline 0 N--CA 1.473 0.718 0 C-N-CA 126.046 1.739 . . . . 0.0 109.461 -174.376 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 98.1 Cg_endo -77.76 63.32 8.03 Favored 'Trans proline' 0 CA--C 1.548 1.18 0 C-N-CA 123.588 2.858 . . . . 0.0 112.368 -178.686 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 40.3 tptt 58.87 117.71 0.02 OUTLIER Pre-proline 0 N--CA 1.48 1.052 0 C-N-CA 129.747 3.219 . . . . 0.0 113.743 -168.456 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 82.0 Cg_endo -77.09 146.96 25.99 Favored 'Trans proline' 0 CA--C 1.538 0.696 0 C-N-CA 122.751 2.301 . . . . 0.0 111.421 -178.498 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 9.5 mtpm? -67.15 131.31 45.54 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.434 0.694 . . . . 0.0 111.056 177.964 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.3 tt -147.78 132.94 18.33 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.188 1.395 . . . . 0.0 111.882 -175.561 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -136.17 116.61 13.72 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 126.479 1.912 . . . . 0.0 109.272 173.329 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -148.61 80.16 1.44 Allowed 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 124.224 1.009 . . . . 0.0 110.304 -175.662 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 36.6 mt -135.33 154.06 51.64 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 125.994 1.718 . . . . 0.0 110.885 -173.633 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 71.2 m -71.66 165.15 24.56 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 122.976 0.51 . . . . 0.0 110.412 169.741 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -53.79 -44.9 70.49 Favored 'General case' 0 N--CA 1.478 0.952 0 O-C-N 120.952 -1.092 . . . . 0.0 112.877 -176.19 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 6.9 pt20 -72.41 -36.0 68.53 Favored 'General case' 0 N--CA 1.47 0.539 0 O-C-N 121.733 -0.605 . . . . 0.0 112.211 176.683 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 86.7 mt-30 -67.87 -40.21 83.61 Favored 'General case' 0 CA--C 1.534 0.348 0 O-C-N 121.662 -0.648 . . . . 0.0 111.271 179.373 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 17.6 ttmm -59.65 -40.87 89.16 Favored 'General case' 0 N--CA 1.471 0.595 0 O-C-N 121.469 -0.769 . . . . 0.0 110.687 174.359 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 51.5 mt -69.73 -41.54 79.99 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 CA-C-O 117.865 -1.065 . . . . 0.0 111.638 176.969 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 35.9 mt -64.0 -43.08 97.53 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.943 0 CA-C-N 121.144 1.793 . . . . 0.0 110.04 177.598 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -58.12 -49.62 76.35 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.605 1.162 . . . . 0.0 110.688 177.381 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -62.77 -52.93 61.28 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 124.776 1.23 . . . . 0.0 112.834 175.78 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -59.06 -30.99 68.47 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-N 119.154 0.888 . . . . 0.0 112.729 -179.838 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.416 ' CE1' HG22 ' A' ' 55' ' ' ILE . 1.3 t80 -67.73 -57.31 6.56 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 123.35 0.66 . . . . 0.0 110.644 176.871 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 89.0 mt -64.15 -33.63 63.65 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 C-N-CA 126.212 1.805 . . . . 0.0 111.352 179.686 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -71.42 -27.24 63.16 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.016 0.926 . . . . 0.0 112.544 177.097 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -88.19 -37.61 15.98 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.085 0.954 . . . . 0.0 112.533 176.151 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.5 m -109.9 -4.79 10.9 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.223 0 N-CA-C 114.488 1.292 . . . . 0.0 114.488 -174.087 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 83.13 25.8 47.03 Favored Glycine 0 N--CA 1.471 1.004 0 C-N-CA 125.028 1.299 . . . . 0.0 115.049 162.203 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 57.6 6.65 0.45 Allowed 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 127.511 2.325 . . . . 0.0 115.175 -172.061 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 27.2 mt-30 -102.17 -15.34 16.71 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 125.55 1.54 . . . . 0.0 113.181 -172.637 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 42.4 m-80 -126.49 5.68 6.89 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.167 0.987 . . . . 0.0 113.569 -172.543 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.416 HG22 ' CE1' ' A' ' 46' ' ' TYR . 15.1 pt -79.35 152.45 4.8 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.555 0 O-C-N 121.903 -0.498 . . . . 0.0 111.309 173.978 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -139.52 144.99 38.15 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 124.55 1.14 . . . . 0.0 109.592 178.915 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -61.94 -23.16 66.19 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 119.193 0.906 . . . . 0.0 112.59 -179.255 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 2.0 mp -70.29 -55.01 16.04 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.232 0 C-N-CA 125.336 1.454 . . . . 0.0 109.091 172.662 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 91.2 m -68.92 -43.32 75.41 Favored 'General case' 0 N--CA 1.464 0.274 0 O-C-N 121.535 -0.728 . . . . 0.0 110.385 -176.895 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 13.7 tp -60.8 -34.87 75.17 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 125.665 1.586 . . . . 0.0 112.241 173.43 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.486 ' HA ' HG13 ' A' ' 66' ' ' ILE . 4.4 t -57.11 -28.82 62.99 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 124.092 0.957 . . . . 0.0 112.685 169.806 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 8.7 mptt -105.56 -23.24 12.82 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.853 1.261 . . . . 0.0 113.789 -174.949 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 58.6 mmtt -66.46 -33.69 76.26 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 124.533 1.133 . . . . 0.0 111.458 175.316 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.0 mp -119.07 5.82 11.31 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 124.831 1.252 . . . . 0.0 114.364 -175.85 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 19.1 m-80 57.84 58.12 3.82 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 126.262 1.825 . . . . 0.0 113.221 -178.733 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.486 HG13 ' HA ' ' A' ' 61' ' ' SER . 3.4 pt -134.89 168.26 23.97 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 C-N-CA 126.072 1.749 . . . . 0.0 112.49 -170.082 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 30.5 p -69.57 151.72 45.63 Favored 'General case' 0 N--CA 1.47 0.525 0 O-C-N 121.382 -0.824 . . . . 0.0 111.405 174.918 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 91.7 t -61.09 -27.06 40.92 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.861 0 C-N-CA 123.095 0.558 . . . . 0.0 111.054 171.211 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -75.6 -41.92 53.24 Favored 'General case' 0 C--O 1.235 0.323 0 O-C-N 120.96 -1.088 . . . . 0.0 110.155 -176.839 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.25 -32.01 49.47 Favored 'General case' 0 C--N 1.346 0.416 0 CA-C-N 118.311 0.505 . . . . 0.0 111.627 179.626 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -63.86 -46.75 83.59 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.797 1.239 . . . . 0.0 112.194 171.502 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 39.4 ttmt -67.94 -29.46 68.53 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 124.3 1.04 . . . . 0.0 111.334 -178.861 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -55.35 -38.94 69.44 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 122.806 0.442 . . . . 0.0 112.071 176.393 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 35.2 m-85 -65.52 -45.57 82.98 Favored 'General case' 0 C--O 1.224 -0.264 0 C-N-CA 124.699 1.2 . . . . 0.0 111.398 175.664 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 61.6 mt -65.18 -30.59 50.75 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.592 0 C-N-CA 124.115 0.966 . . . . 0.0 110.79 -178.611 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt -79.2 -36.82 39.6 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 124.713 1.205 . . . . 0.0 113.144 179.018 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 6.3 p30 -90.9 -44.85 9.12 Favored 'General case' 0 C--N 1.345 0.387 0 CA-C-N 120.019 1.282 . . . . 0.0 111.737 179.682 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 38.7 m -97.07 93.04 6.35 Favored 'General case' 0 C--O 1.231 0.115 0 C-N-CA 123.032 0.533 . . . . 0.0 110.787 179.43 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -140.77 -54.8 0.5 Allowed 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 113.481 0.919 . . . . 0.0 113.481 -179.419 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 1.6 mpp_? -76.66 -12.84 60.06 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 124.315 1.046 . . . . 0.0 113.249 176.329 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 26.9 tp -70.31 -36.08 74.07 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.893 1.277 . . . . 0.0 112.641 176.54 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -73.22 139.42 26.86 Favored Glycine 0 CA--C 1.533 1.196 0 N-CA-C 111.577 -0.609 . . . . 0.0 111.577 175.983 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 11.3 mmm-85 -120.22 146.35 46.13 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 124.332 1.053 . . . . 0.0 112.121 -171.625 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 10.8 t -66.79 106.44 1.86 Allowed 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 125.149 1.38 . . . . 0.0 111.345 177.997 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 41.8 m-80 -131.91 111.47 11.59 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 125.436 1.494 . . . . 0.0 109.55 178.977 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 10.3 m120 -144.85 158.95 43.61 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.048 1.339 . . . . 0.0 112.244 -174.785 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 10.7 mp -88.79 163.8 15.53 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 125.53 1.532 . . . . 0.0 110.889 174.647 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 19.3 ptmt -126.13 13.08 7.77 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 126.764 2.026 . . . . 0.0 112.998 -172.014 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 15.2 t -147.3 123.1 10.6 Favored 'General case' 0 C--O 1.233 0.204 0 C-N-CA 125.758 1.623 . . . . 0.0 109.431 173.665 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -133.63 -6.31 1.35 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 C-N-CA 125.757 1.623 . . . . 0.0 111.904 177.419 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 69.23 19.16 73.87 Favored Glycine 0 CA--C 1.533 1.177 0 C-N-CA 124.679 1.133 . . . . 0.0 113.698 -165.571 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -130.55 -27.49 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.302 0 N-CA-C 114.866 1.432 . . . . 0.0 114.866 -173.766 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 17.4 tp -73.49 50.2 0.31 Allowed 'General case' 0 CA--C 1.551 0.985 0 CA-C-N 113.937 -1.483 . . . . 0.0 111.293 166.885 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 18.3 mt-30 -92.25 -9.93 40.34 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 128.091 2.556 . . . . 0.0 114.42 -170.804 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -79.12 108.32 12.53 Favored 'General case' 0 CA--C 1.544 0.726 0 O-C-N 121.101 -0.999 . . . . 0.0 111.225 178.14 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -149.4 71.37 1.11 Allowed 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 124.658 1.183 . . . . 0.0 110.912 -179.784 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 28.0 t -139.7 80.69 0.35 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 124.836 1.254 . . . . 0.0 110.1 177.519 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 47.5 t -163.23 -76.86 0.04 OUTLIER 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 123.935 0.894 . . . . 0.0 112.329 169.375 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 55.5 p -88.74 -29.14 20.04 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 125.028 1.331 . . . . 0.0 113.321 -176.744 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 43.9 mtt -126.61 142.41 51.55 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 126.465 1.906 . . . . 0.0 109.752 167.809 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -157.86 90.78 1.09 Allowed 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.839 1.655 . . . . 0.0 107.823 172.829 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -146.33 157.78 43.82 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 124.3 1.04 . . . . 0.0 113.273 -171.858 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -92.19 71.38 5.36 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 125.907 1.683 . . . . 0.0 111.776 -174.894 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 7.5 t -134.27 166.15 23.47 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 124.773 1.229 . . . . 0.0 112.662 177.348 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 28.1 ttt -133.38 93.57 3.18 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 126.45 1.9 . . . . 0.0 109.885 -179.662 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER 58.44 24.64 12.01 Favored 'General case' 0 N--CA 1.485 1.313 0 N-CA-C 115.149 1.537 . . . . 0.0 115.149 173.515 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 1.3 t-105 . . . . . 0 C--O 1.253 1.263 0 C-N-CA 126.598 1.959 . . . . 0.0 113.106 -179.574 . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.503 0 N-CA-C 111.452 -0.659 . . . . 0.0 111.452 . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 63.1 p -86.15 -13.8 46.02 Favored 'General case' 0 N--CA 1.477 0.9 0 N-CA-C 115.15 1.537 . . . . 0.0 115.15 -174.085 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 48.5 t-80 -72.98 135.41 44.98 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 124.061 0.945 . . . . 0.0 112.82 -176.524 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 59.1 tpp -155.11 137.67 15.1 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 125.67 1.588 . . . . 0.0 110.697 -179.377 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -149.87 127.69 11.77 Favored 'General case' 0 CA--C 1.542 0.64 0 N-CA-C 113.077 0.769 . . . . 0.0 113.077 171.564 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 39.2 m -154.1 71.64 0.86 Allowed 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 126.349 1.86 . . . . 0.0 110.43 -172.415 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.2 ttt -137.66 30.65 2.57 Favored 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 124.429 1.092 . . . . 0.0 113.388 -170.539 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 8.6 t0 -101.85 123.01 45.37 Favored Pre-proline 0 CA--C 1.551 1.012 0 C-N-CA 124.471 1.109 . . . . 0.0 112.156 -176.614 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 69.1 Cg_endo -82.67 -3.42 11.27 Favored 'Trans proline' 0 C--N 1.352 0.725 0 C-N-CA 123.501 2.8 . . . . 0.0 115.147 179.437 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 81.8 mt -108.24 43.58 1.21 Allowed 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.799 1.64 . . . . 0.0 112.314 -175.793 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -104.81 0.5 28.17 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 115.013 1.486 . . . . 0.0 115.013 178.633 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -120.52 -57.72 1.89 Allowed 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 124.408 1.083 . . . . 0.0 113.489 -166.751 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.1 pp -129.71 15.87 2.44 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 C-N-CA 126.249 1.819 . . . . 0.0 112.76 -172.188 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 16.9 tt -38.88 120.66 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 C-N-CA 125.825 1.65 . . . . 0.0 113.369 178.027 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 1.9 m120 -165.01 108.1 0.85 Allowed 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.584 1.154 . . . . 0.0 109.685 179.372 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 23.3 t0 -166.44 81.91 0.26 Allowed 'General case' 0 N--CA 1.466 0.353 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 -178.82 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 46.1 mm 53.0 63.21 0.21 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.831 0 CA-C-O 123.169 1.461 . . . . 0.0 111.096 -170.463 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 1.3 mmmt -150.99 -39.39 0.13 Allowed 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 124.781 1.233 . . . . 0.0 113.968 179.595 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 50.8 tttm 43.04 61.29 2.19 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 126.606 1.962 . . . . 0.0 113.205 -177.762 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -123.04 133.56 54.33 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.699 1.2 . . . . 0.0 111.15 -178.144 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -153.35 169.81 22.2 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 125.032 1.333 . . . . 0.0 111.769 176.805 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 -146.91 147.46 30.81 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.6 1.16 . . . . 0.0 111.478 -179.655 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 33.1 m-20 -100.21 96.99 7.84 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 124.526 1.131 . . . . 0.0 111.052 -179.624 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 23.3 t -119.68 105.45 11.19 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 124.808 1.243 . . . . 0.0 110.982 178.676 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 63.13 37.03 94.25 Favored Glycine 0 N--CA 1.472 1.097 0 C-N-CA 124.889 1.233 . . . . 0.0 115.491 175.604 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 47.0 t -80.05 147.37 6.58 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 C-N-CA 125.006 1.323 . . . . 0.0 111.035 -177.833 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 35.2 m -48.82 149.6 1.74 Allowed 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 125.72 1.608 . . . . 0.0 113.696 168.976 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -142.66 34.07 1.43 Allowed 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.895 1.678 . . . . 0.0 114.171 -171.187 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -113.62 96.33 40.07 Favored Pre-proline 0 CA--C 1.551 0.983 0 C-N-CA 124.822 1.249 . . . . 0.0 111.89 -174.316 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_endo -79.42 -19.74 10.07 Favored 'Trans proline' 0 CA--C 1.542 0.878 0 C-N-CA 123.215 2.61 . . . . 0.0 113.346 178.81 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 6.3 tp -143.09 -158.23 0.85 Allowed 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 127.104 2.162 . . . . 0.0 108.758 -177.961 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 3.2 t -77.0 42.91 0.33 Allowed 'General case' 0 N--CA 1.479 0.992 0 O-C-N 120.761 -1.212 . . . . 0.0 113.205 175.356 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 7.8 p -159.0 141.14 10.05 Favored Pre-proline 0 CA--C 1.543 0.682 0 C-N-CA 126.398 1.879 . . . . 0.0 110.484 -176.097 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_endo -78.09 65.96 8.32 Favored 'Trans proline' 0 CA--C 1.548 1.184 0 C-N-CA 123.958 3.105 . . . . 0.0 111.358 174.061 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 30.3 tptt 64.27 124.58 0.02 OUTLIER Pre-proline 0 CA--C 1.554 1.099 0 C-N-CA 129.447 3.099 . . . . 0.0 114.137 -172.933 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -80.72 116.52 3.2 Favored 'Trans proline' 0 C--N 1.351 0.71 0 C-N-CA 122.558 2.172 . . . . 0.0 112.279 -179.838 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 10.1 mtpm? -55.07 141.87 32.73 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 124.371 1.068 . . . . 0.0 113.349 -172.073 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -143.59 132.57 22.84 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 126.411 1.884 . . . . 0.0 109.976 -174.809 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 33.4 mp0 -131.65 70.16 1.47 Allowed 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 125.312 1.445 . . . . 0.0 111.308 -178.345 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -109.58 73.18 0.83 Allowed 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.61 1.164 . . . . 0.0 113.357 -170.774 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 86.9 mt -138.97 148.23 43.23 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 126.282 1.833 . . . . 0.0 111.294 178.841 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 26.8 m -72.04 169.51 15.84 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 124.32 1.048 . . . . 0.0 110.871 169.889 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -57.33 -43.54 83.44 Favored 'General case' 0 CA--C 1.545 0.773 0 O-C-N 120.427 -1.421 . . . . 0.0 113.324 -173.46 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 12.6 tt0 -74.69 -43.3 55.87 Favored 'General case' 0 N--CA 1.472 0.661 0 O-C-N 121.129 -0.982 . . . . 0.0 111.696 176.856 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 11.7 mm-40 -53.46 -45.32 69.48 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.0 1.32 . . . . 0.0 111.449 174.521 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 41.0 ttmt -60.45 -38.12 83.12 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 125.31 1.444 . . . . 0.0 111.761 176.889 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 49.9 mt -76.16 -35.81 29.17 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 CA-C-O 118.075 -0.964 . . . . 0.0 111.93 178.565 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 48.8 mt -60.51 -40.97 86.01 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.035 0 CA-C-N 120.766 1.621 . . . . 0.0 109.825 172.752 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.454 HD22 HD11 ' A' ' 60' ' ' LEU . 0.4 OUTLIER -59.45 -52.4 65.75 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.177 0.991 . . . . 0.0 110.649 175.0 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -65.36 -49.27 70.0 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 124.419 1.088 . . . . 0.0 113.42 -177.662 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 18.8 mm-40 -62.46 -25.05 67.78 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 123.941 0.896 . . . . 0.0 113.065 -179.297 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -71.87 -54.82 8.88 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 123.367 0.667 . . . . 0.0 110.999 175.883 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 52.7 mt -59.35 -36.17 62.4 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 C-N-CA 125.134 1.374 . . . . 0.0 111.262 174.202 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -67.84 -20.86 65.2 Favored 'General case' 0 CA--C 1.546 0.791 0 N-CA-C 113.266 0.839 . . . . 0.0 113.266 176.771 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -96.41 -29.72 13.78 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.882 1.273 . . . . 0.0 113.228 178.358 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 5.3 m -123.19 -22.79 2.77 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.993 0 CA-C-N 119.791 1.178 . . . . 0.0 114.068 -173.815 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 89.92 143.51 10.43 Favored Glycine 0 CA--C 1.534 1.251 0 C-N-CA 125.531 1.539 . . . . 0.0 113.082 -172.017 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 30.6 tp -59.89 -17.19 35.12 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 126.116 1.766 . . . . 0.0 114.932 -173.377 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 37.6 mt-30 -89.55 -18.99 25.55 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 126.474 1.91 . . . . 0.0 112.923 179.753 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 57.9 m-80 -108.67 -9.11 15.3 Favored 'General case' 0 N--CA 1.472 0.648 0 N-CA-C 114.35 1.241 . . . . 0.0 114.35 -173.748 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 30.5 pt -65.62 159.49 4.14 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.471 0 C-N-CA 123.787 0.835 . . . . 0.0 111.134 162.396 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -132.43 143.14 49.6 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 125.494 1.518 . . . . 0.0 109.904 175.612 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -59.44 -26.65 65.38 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 123.826 0.851 . . . . 0.0 112.219 174.679 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 27.7 mm -66.07 -44.33 92.01 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.495 0 C-N-CA 125.286 1.434 . . . . 0.0 111.686 175.36 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 56.2 m -83.4 -38.85 21.4 Favored 'General case' 0 C--O 1.222 -0.364 0 C-N-CA 123.175 0.59 . . . . 0.0 109.461 -178.515 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.454 HD11 HD22 ' A' ' 43' ' ' LEU . 14.3 tp -62.64 -37.82 87.84 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 125.0 1.32 . . . . 0.0 111.538 175.651 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.462 ' HA ' HG13 ' A' ' 66' ' ' ILE . 53.1 p -61.26 -25.76 67.3 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 113.2 0.815 . . . . 0.0 113.2 171.747 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -99.38 -28.29 13.35 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 125.092 1.357 . . . . 0.0 114.234 -177.196 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 51.9 mmtt -64.65 -36.47 84.36 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 125.806 1.642 . . . . 0.0 111.506 175.701 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.0 mp -115.31 3.64 14.26 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 125.408 1.483 . . . . 0.0 114.054 -174.0 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 42.3 m-80 56.13 61.13 2.87 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 126.347 1.859 . . . . 0.0 113.291 -179.171 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.462 HG13 ' HA ' ' A' ' 61' ' ' SER . 0.9 OUTLIER -134.82 178.11 5.9 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.715 0 C-N-CA 127.64 2.376 . . . . 0.0 111.226 -171.979 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.3 p -80.54 159.97 25.33 Favored 'General case' 0 N--CA 1.48 1.044 0 O-C-N 120.82 -1.175 . . . . 0.0 111.656 173.175 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 84.3 t -62.3 -29.13 45.98 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 C-N-CA 123.384 0.674 . . . . 0.0 111.303 172.943 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -81.28 -36.87 29.32 Favored 'General case' 0 N--CA 1.468 0.458 0 O-C-N 120.917 -1.114 . . . . 0.0 110.433 -179.436 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 9.7 tmtt? -64.08 -45.26 89.51 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 125.129 1.372 . . . . 0.0 110.702 175.922 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -60.0 -49.69 76.67 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 125.877 1.671 . . . . 0.0 113.008 170.335 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 34.7 ttmt -71.44 -23.14 61.79 Favored 'General case' 0 N--CA 1.466 0.332 0 O-C-N 121.003 -1.061 . . . . 0.0 111.876 -174.353 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -52.9 -40.34 63.44 Favored 'General case' 0 CA--C 1.546 0.796 0 CA-C-N 118.211 0.459 . . . . 0.0 111.324 172.039 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 27.8 m-85 -68.78 -40.72 79.52 Favored 'General case' 0 C--O 1.224 -0.238 0 C-N-CA 123.781 0.832 . . . . 0.0 111.486 179.5 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 61.2 mt -69.71 -26.85 31.53 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.676 0 C-N-CA 125.471 1.509 . . . . 0.0 111.121 179.666 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 71.2 mmtt -82.03 -32.0 30.69 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 125.016 1.326 . . . . 0.0 112.78 172.843 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 38.6 m-20 -82.11 -45.79 14.72 Favored 'General case' 0 C--O 1.232 0.161 0 C-N-CA 124.42 1.088 . . . . 0.0 111.082 -177.522 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 7.9 t -118.25 125.71 50.67 Favored 'General case' 0 N--CA 1.464 0.234 0 N-CA-C 113.225 0.824 . . . . 0.0 113.225 169.656 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 7.5 t-20 -148.87 -44.42 0.15 Allowed 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 114.046 1.128 . . . . 0.0 114.046 -170.264 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 1.3 mpp_? -115.14 18.72 16.11 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 126.005 1.722 . . . . 0.0 112.696 174.547 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 7.2 tt -127.71 -55.12 1.32 Allowed 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 124.8 1.24 . . . . 0.0 112.988 -173.817 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 55.4 -122.29 25.86 Favored Glycine 0 CA--C 1.535 1.313 0 N-CA-C 114.867 0.707 . . . . 0.0 114.867 178.571 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 13.0 mmt180 -132.19 163.94 27.44 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 126.464 1.906 . . . . 0.0 111.523 174.063 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 5.0 t -84.45 16.04 3.35 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 126.699 2.0 . . . . 0.0 114.672 -175.517 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 16.1 m120 -80.28 22.91 0.51 Allowed 'General case' 0 CA--C 1.55 0.962 0 O-C-N 120.059 -1.651 . . . . 0.0 114.681 -169.945 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 6.9 p-10 -106.0 11.12 31.96 Favored 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 126.18 1.792 . . . . 0.0 114.305 -173.956 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -125.94 22.63 7.35 Favored 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 125.004 1.322 . . . . 0.0 114.236 -166.409 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.23 -11.92 27.17 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 124.302 1.041 . . . . 0.0 113.583 178.234 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 15.0 t -153.37 121.97 6.34 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 125.161 1.384 . . . . 0.0 110.205 175.745 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -143.44 6.68 0.34 Allowed 'Isoleucine or valine' 0 CA--C 1.549 0.929 0 C-N-CA 125.294 1.438 . . . . 0.0 113.554 -175.525 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 77.26 -8.35 32.74 Favored Glycine 0 N--CA 1.476 1.312 0 O-C-N 120.74 -1.225 . . . . 0.0 114.899 -168.573 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 4.5 mp 53.69 84.64 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.638 0 C-N-CA 127.221 2.208 . . . . 0.0 110.088 -170.057 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 41.9 tp -58.5 92.36 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 126.295 1.838 . . . . 0.0 112.773 -168.951 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 88.2 mt-30 -138.65 -59.34 0.61 Allowed 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 124.919 1.288 . . . . 0.0 112.548 -179.108 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 63.5 mm-40 -144.77 162.15 37.46 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 125.495 1.518 . . . . 0.0 112.247 -175.364 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -123.09 101.53 7.46 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 125.308 1.443 . . . . 0.0 110.244 174.219 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 8.5 p -149.94 131.54 5.34 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 C-N-CA 124.982 1.313 . . . . 0.0 110.874 177.814 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 45.4 t -162.8 -64.93 0.05 OUTLIER 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 124.135 0.974 . . . . 0.0 112.247 173.697 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 11.1 t -89.31 -27.84 20.26 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 124.09 0.956 . . . . 0.0 113.336 -175.303 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 65.5 mtt -130.89 134.66 46.98 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 125.67 1.588 . . . . 0.0 110.259 173.359 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -136.5 5.26 2.93 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 125.449 1.5 . . . . 0.0 113.924 -175.364 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -114.64 159.49 20.42 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.871 1.669 . . . . 0.0 113.003 -174.595 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 9.5 mtpm? -112.17 108.2 17.38 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 125.739 1.616 . . . . 0.0 110.309 179.666 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 6.8 t -149.58 61.44 1.01 Allowed 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 124.851 1.26 . . . . 0.0 111.107 -178.106 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 55.6 mtt -132.54 164.89 25.62 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 125.891 1.676 . . . . 0.0 112.016 179.59 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 10.0 t -124.81 159.23 31.47 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 125.304 1.442 . . . . 0.0 112.626 179.206 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 107' ' ' TRP . . . . . . . . . . . . . 1.5 m-90 . . . . . 0 C--O 1.253 1.28 0 C-N-CA 126.812 2.045 . . . . 0.0 111.944 -179.016 . . . . . . . . 0 0 . 1 stop_ save_