data_3ua0_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 3ua0 _Structure_validation_residue.Date_analyzed 2016-10-12 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 ecloud orig full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 24.7 m-85 . . . . . 0 N--CA 1.471 0.581 0 N-CA-C 113.175 0.806 . . . . 107.95 113.175 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -51.2 -50.8 58.35 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-O 121.204 0.526 . . . . 105.55 109.869 178.545 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 51.7 mm-40 -142.35 143.19 32.62 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 115.619 -0.719 . . . . 97.379999999999995 109.987 173.945 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 29.7 t0 -134.75 117.03 15.55 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 113.366 0.876 . . . . 108.98 113.366 173.729 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 21.9 m-85 -115.74 21.62 13.75 Favored 'General case' 0 CA--C 1.511 -0.533 0 CA-C-N 115.386 -0.824 . . . . 108.11 109.234 178.483 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 36.1 t80 -62.08 -36.75 82.62 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 115.171 -0.922 . . . . 121.78 109.941 177.597 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -76.23 -28.96 59.21 Favored Glycine 0 CA--C 1.524 0.61 0 N-CA-C 114.624 0.61 . . . . 123.7 114.624 177.622 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 50.4 m -75.21 166.34 23.79 Favored 'General case' 0 C--O 1.24 0.56 0 N-CA-C 113.648 0.981 . . . . 120.95999999999999 113.648 -173.563 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 1.5 p-10 -76.4 -19.61 57.96 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 115.277 -0.874 . . . . 127.48 112.464 177.021 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 1.9 m -133.32 -177.97 2.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-O 121.466 0.651 . . . . 115.41 111.063 179.282 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 5.0 m -132.23 108.42 9.23 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.637 -0.711 . . . . 106.15000000000001 110.907 175.586 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 82.5 t -64.46 117.28 4.84 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.431 0 CA-C-N 115.945 -0.57 . . . . 90.590000000000003 109.758 172.379 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 34.4 mt-30 -95.61 -7.1 38.63 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.173 -0.467 . . . . 89.489999999999995 110.769 -177.194 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 4.2 t -171.83 157.26 4.47 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.29 -0.414 . . . . 84.969999999999999 110.23 -174.115 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 10.4 t -154.59 153.65 31.75 Favored 'General case' 0 N--CA 1.452 -0.35 0 CA-C-N 116.005 -0.543 . . . . 84.349999999999994 110.696 172.56 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 17.1 t30 -148.26 158.49 44.12 Favored 'General case' 0 N--CA 1.444 -0.756 0 N-CA-C 107.047 -1.464 . . . . 90.150000000000006 107.047 -178.661 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 6.7 m -154.63 122.25 5.77 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.024 0.44 . . . . 87.790000000000006 110.34 175.357 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 20.7 m -124.27 157.01 35.88 Favored 'General case' 0 CA--C 1.508 -0.667 0 N-CA-C 108.468 -0.938 . . . . 95.280000000000001 108.468 178.533 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -118.9 133.09 56.06 Favored 'General case' 0 N--CA 1.443 -0.818 0 CA-C-O 121.924 0.869 . . . . 102.42 111.265 176.282 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 33.3 mm-40 -111.74 134.52 53.26 Favored 'General case' 0 N--CA 1.435 -1.198 0 N-CA-C 105.361 -2.088 . . . . 99.939999999999998 105.361 177.059 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 17.6 mm -109.02 124.36 65.62 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.9 0 C-N-CA 117.901 -1.52 . . . . 98.609999999999999 109.232 168.774 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 3.3 mp -111.22 106.43 20.75 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.596 0 CA-C-N 114.249 -1.341 . . . . 102.53 109.417 179.696 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 14.8 ttt180 -86.43 134.04 33.73 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 101.131 -3.655 . . . . 110.29000000000001 101.131 163.372 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' ASP . . . . . 0.625 ' OD1' ' N ' ' A' ' 51' ' ' SER . 3.3 p30 -106.24 -163.56 0.94 Allowed 'General case' 0 C--O 1.236 0.357 0 C-N-CA 119.144 -1.023 . . . . 109.48 112.845 -179.613 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -58.0 -29.53 65.35 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.635 -0.712 . . . . 115.41 111.94 178.952 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' SER . . . . . 0.625 ' N ' ' OD1' ' A' ' 49' ' ' ASP . 0.7 OUTLIER -96.8 18.61 14.09 Favored 'General case' 0 C--O 1.241 0.656 0 C-N-CA 123.057 0.543 . . . . 117.52 111.531 179.197 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 61.48 -5.22 0.3 Allowed Glycine 0 N--CA 1.449 -0.448 0 N-CA-C 111.181 -0.767 . . . . 113.98 111.181 -176.087 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' ALA . . . . . 0.418 ' N ' ' C ' ' A' ' 51' ' ' SER . . . -55.46 140.89 38.73 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 108.603 -0.888 . . . . 106.72 108.603 178.677 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 57.8 t -113.03 132.16 62.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.853 -0.612 . . . . 103.3 111.657 -169.228 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 11.3 mt -125.88 127.13 70.96 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.486 0 CA-C-N 115.751 -0.659 . . . . 101.63 109.977 -176.146 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -93.31 133.48 36.51 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 119.633 -0.827 . . . . 115.51000000000001 109.964 168.785 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 -123.97 107.87 11.8 Favored 'General case' 0 N--CA 1.444 -0.756 0 CA-C-N 115.721 -0.672 . . . . 104.01000000000001 110.181 175.076 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 2.0 pt20 -97.05 128.22 43.78 Favored 'General case' 0 CA--C 1.515 -0.389 0 CA-C-O 121.951 0.882 . . . . 112.23 112.554 175.199 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 3.1 mt -120.93 95.74 3.76 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.977 0 CA-C-N 114.016 -1.447 . . . . 88.859999999999999 111.2 -168.434 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 1.3 m -83.85 132.62 34.79 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 114.54 -1.209 . . . . 83.629999999999995 109.495 172.68 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 5.3 m -128.55 104.73 7.84 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 115.956 -0.565 . . . . 85.400000000000006 109.915 179.036 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 21.1 mttt -103.17 144.54 31.18 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-O 121.418 0.628 . . . . 85.969999999999999 111.815 -178.771 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 9.6 tptp -121.37 118.98 30.81 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 107.633 -1.247 . . . . 86.989999999999995 107.633 169.767 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' MSE . . . . . . . . . . . . . 2.1 mtp -127.8 149.16 50.39 Favored 'General case' 0 C--O 1.212 -0.894 0 N-CA-C 107.538 -1.282 . . . . 119.68000000000001 107.538 -176.365 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' GLN . . . . . 0.565 ' O ' ' CB ' ' A' ' 66' ' ' ARG . 1.7 tt0 -132.74 131.15 40.88 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 107.86 -1.163 . . . . 102.58 107.86 177.632 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' ARG . . . . . 0.565 ' CB ' ' O ' ' A' ' 65' ' ' GLN . 0.4 OUTLIER 137.66 139.57 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 116.976 2.213 . . . . 131.63 116.976 170.195 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 1.1 ttpp -168.8 -40.53 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 105.005 -2.221 . . . . 130.44 105.005 169.636 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 4.5 t-20 . . . . . 0 C--O 1.236 0.351 0 N-CA-C 115.334 1.605 . . . . 126.48 115.334 178.576 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.532 0.283 0 N-CA-C 112.037 0.384 . . . . 137.22 112.037 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 9.5 mt -49.85 131.64 22.33 Favored 'General case' 0 C--O 1.235 0.292 0 N-CA-C 107.912 -1.144 . . . . 128.08000000000001 107.912 174.237 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -116.91 -111.29 2.64 Favored Glycine 0 N--CA 1.449 -0.434 0 N-CA-C 110.882 -0.887 . . . . 122.97 110.882 179.757 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 12.0 mttt 55.99 -95.41 0.05 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.251 0.548 . . . . 125.88 112.134 177.095 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 4.6 p30 -116.12 27.91 8.95 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 115.371 -0.831 . . . . 126.94 111.963 -173.291 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -117.36 159.37 22.85 Favored 'General case' 0 CA--C 1.534 0.347 0 N-CA-C 114.308 1.225 . . . . 118.44 114.308 -167.937 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 39.5 ttmt -153.11 128.57 9.96 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 115.613 -0.721 . . . . 107.20999999999999 109.964 177.736 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' MSE . . . . . . . . . . . . . 0.0 OUTLIER -95.94 135.39 37.75 Favored 'General case' 0 C--O 1.219 -0.502 0 N-CA-C 114.004 1.113 . . . . 119.81999999999999 114.004 177.356 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 9.0 mt -135.61 88.18 0.75 Allowed 'Isoleucine or valine' 0 N--CA 1.438 -1.065 0 CA-C-O 122.296 1.046 . . . . 84.590000000000003 108.961 177.316 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 10.8 mttp -83.83 137.58 33.63 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-N 114.53 -1.214 . . . . 103.76000000000001 109.969 170.141 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 3.2 m -122.58 129.81 52.32 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 108.336 -0.987 . . . . 83.340000000000003 108.336 175.193 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 94.2 m-85 -118.74 153.83 33.77 Favored 'General case' 0 CA--C 1.508 -0.659 0 C-N-CA 120.55 -0.46 . . . . 92.370000000000005 111.081 178.42 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 53.3 t -151.76 80.05 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 N-CA-C 108.791 -0.818 . . . . 92.650000000000006 108.791 -175.989 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 4.9 mt -92.25 137.07 22.97 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.743 0 CA-C-N 115.024 -0.989 . . . . 97.370000000000005 110.909 -174.3 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 62.3 m -121.5 136.59 54.94 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 108.888 -0.782 . . . . 104.42 108.888 175.202 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -136.81 156.87 47.93 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 116.659 -0.246 . . . . 116.64 111.52 -172.269 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 57.2 p30 -131.56 165.64 23.17 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.104 0.562 . . . . 131.78999999999999 110.974 175.21 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 3.4 p -75.02 -1.01 20.81 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 112.505 0.558 . . . . 138.13999999999999 112.505 -177.415 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 77.8 m-20 -70.31 -61.72 1.66 Allowed 'General case' 0 C--O 1.237 0.402 0 N-CA-C 108.734 -0.839 . . . . 140.36000000000001 108.734 167.617 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 150.88 -8.29 0.7 Allowed Glycine 0 C--N 1.331 0.271 0 N-CA-C 111.455 -0.658 . . . . 132.93000000000001 111.455 179.475 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 5.0 m-80 -72.5 146.39 46.87 Favored 'General case' 0 N--CA 1.465 0.28 0 N-CA-C 114.799 1.407 . . . . 137.25999999999999 114.799 -173.781 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -123.97 -175.67 3.29 Favored 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 114.514 1.301 . . . . 122.92 114.514 -177.874 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 35.9 t -174.85 75.7 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.689 -0.687 . . . . 104.20999999999999 110.716 -174.024 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 2.7 mt -81.54 129.88 36.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 N-CA-C 114.369 1.248 . . . . 102.95 114.369 -179.537 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 69.2 t -113.88 127.13 71.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 N-CA-C 107.88 -1.156 . . . . 91.400000000000006 107.88 169.454 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 76.9 tt0 -119.07 139.27 52.02 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.656 -0.418 . . . . 96.420000000000002 111.73 -179.311 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -135.07 114.68 12.65 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-O 121.324 0.583 . . . . 92.219999999999999 111.185 172.779 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -103.17 134.58 46.34 Favored 'General case' 0 CA--C 1.51 -0.593 0 CA-C-N 115.378 -0.828 . . . . 97.510000000000005 109.629 177.497 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 16.2 t -132.17 101.84 5.14 Favored 'Isoleucine or valine' 0 C--O 1.238 0.49 0 CA-C-N 115.473 -0.785 . . . . 96.310000000000002 109.353 -179.562 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 29.0 tp -88.55 130.73 35.17 Favored 'General case' 0 CA--C 1.517 -0.301 0 CA-C-N 115.0 -1.0 . . . . 105.27 109.875 175.132 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' MSE . . . . . . . . . . . . . 1.3 mtm -118.29 102.06 8.67 Favored 'General case' 0 CA--C 1.506 -0.721 0 CA-C-N 116.124 -0.489 . . . . 110.18000000000001 110.267 -177.939 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 27.3 tttp -97.83 120.55 38.42 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 105.624 -1.991 . . . . 123.0 105.624 167.34 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 3.3 p -81.78 126.63 32.06 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.474 -0.784 . . . . 113.63 109.788 176.836 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 44.1 mt -92.42 -37.38 12.6 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 113.168 0.803 . . . . 109.27 113.168 -172.385 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 1.2 p -160.44 177.14 10.87 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 120.433 0.158 . . . . 114.86 110.736 171.781 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 5.4 p30 . . . . . 0 N--CA 1.465 0.277 0 N-CA-C 112.702 0.63 . . . . 123.90000000000001 112.702 -177.801 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 23' ' ' ILE . . . . . . . . . . . . . 3.6 mm . . . . . 0 CA--C 1.534 0.327 0 CA-C-O 121.059 0.457 . . . . 134.16999999999999 111.131 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 24' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -83.67 13.25 4.83 Favored 'General case' 0 C--O 1.234 0.284 0 N-CA-C 108.911 -0.774 . . . . 135.94 108.911 172.083 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -55.04 -14.53 1.58 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.309 -0.859 . . . . 133.00999999999999 110.381 179.999 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 26' ' ' PHE . . . . . . . . . . . . . 75.1 m-85 -61.89 -8.44 5.03 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 115.168 -0.924 . . . . 126.08 112.689 -178.662 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 27.2 m-20 -101.68 39.53 1.44 Allowed 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.691 -0.485 . . . . 126.08 109.691 178.393 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 20.5 pt-20 . . . . . 0 N--CA 1.466 0.345 0 CA-C-N 115.829 -0.623 . . . . 127.43000000000001 112.33 -179.297 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 13.3 t . . . . . 0 CA--C 1.538 0.49 0 N-CA-C 113.686 0.995 . . . . 118.56 113.686 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 36' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -71.64 118.65 14.73 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 113.007 0.743 . . . . 115.8 113.007 177.933 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 24.8 t -89.49 87.64 2.78 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.397 0 CA-C-N 115.838 -0.619 . . . . 110.18000000000001 111.989 177.847 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 38' ' ' GLN . . . . . . . . . . . . . 87.3 mt-30 -69.54 -1.59 9.11 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 116.772 2.138 . . . . 123.31 116.772 -171.635 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 6.6 t -174.42 158.93 2.95 Favored 'General case' 0 N--CA 1.467 0.389 0 N-CA-C 113.047 0.758 . . . . 104.56 113.047 -176.465 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 40' ' ' SER . . . . . . . . . . . . . 14.1 t -175.13 127.48 0.28 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.585 -0.734 . . . . 108.69 109.712 176.602 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 8.6 p30 -147.61 155.37 41.74 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.969 -0.56 . . . . 113.53 110.417 172.165 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 90.1 m -134.55 101.73 5.06 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.223 -0.444 . . . . 106.81999999999999 111.609 -172.258 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 43' ' ' THR . . . . . 0.604 ' CG2' ' N ' ' B' ' 44' ' ' ASP . 1.2 m -90.86 170.65 9.91 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 123.456 0.702 . . . . 106.16 111.559 179.429 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 44' ' ' ASP . . . . . 0.604 ' N ' ' CG2' ' B' ' 43' ' ' THR . 9.5 t70 -135.82 116.62 14.06 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-O 121.411 0.624 . . . . 104.81999999999999 111.698 172.692 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 45' ' ' GLU . . . . . . . . . . . . . 24.2 mt-10 -112.53 147.06 37.4 Favored 'General case' 0 CA--C 1.515 -0.376 0 CA-C-N 115.205 -0.907 . . . . 123.36 110.687 177.466 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 46' ' ' ILE . . . . . . . . . . . . . 4.4 mm -115.47 124.13 71.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 N-CA-C 107.98 -1.118 . . . . 98.060000000000002 107.98 173.52 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 47' ' ' ILE . . . . . . . . . . . . . 21.7 mm -114.48 151.31 16.27 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.555 0 CA-C-N 115.593 -0.73 . . . . 98.879999999999995 110.651 -175.163 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 3.2 ttm180 -108.55 123.69 49.3 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 108.133 -1.062 . . . . 120.41 108.133 160.312 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 49' ' ' ASP . . . . . 0.428 ' OD1' ' N ' ' B' ' 52' ' ' GLY . 25.2 p-10 -84.76 -156.04 0.23 Allowed 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.014 -0.539 . . . . 112.48999999999999 110.168 179.33 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -76.48 27.5 0.13 Allowed 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 115.306 -0.861 . . . . 109.13 109.775 172.977 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 13.7 m -165.29 -91.9 0.02 OUTLIER 'General case' 0 CA--C 1.554 1.117 0 N-CA-C 114.312 1.227 . . . . 114.87 114.312 176.436 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 52' ' ' GLY . . . . . 0.428 ' N ' ' OD1' ' B' ' 49' ' ' ASP . . . -103.71 -167.75 25.36 Favored Glycine 0 CA--C 1.526 0.725 0 N-CA-C 118.068 1.987 . . . . 106.27 118.068 -173.058 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -94.18 129.08 40.91 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 113.734 1.013 . . . . 104.7 113.734 -177.212 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 24.6 t -125.51 128.52 72.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.8 -0.636 . . . . 102.09999999999999 110.714 178.189 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 1.4 tt -76.56 154.92 5.74 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.475 0 N-CA-C 106.754 -1.572 . . . . 107.05 106.754 167.311 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 12.4 mt-10 -147.01 131.45 17.64 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.337 -0.392 . . . . 103.08 110.178 177.133 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 57' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -115.66 101.15 8.58 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-O 121.182 0.515 . . . . 125.81999999999999 112.275 -176.058 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 58' ' ' GLN . . . . . . . . . . . . . 24.5 mp0 -97.0 89.3 4.78 Favored 'General case' 0 C--O 1.235 0.307 0 N-CA-C 115.267 1.58 . . . . 105.53 115.267 -171.685 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 59' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -69.83 132.7 32.9 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.427 0 N-CA-C 105.896 -1.891 . . . . 102.23999999999999 105.896 161.526 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 60' ' ' THR . . . . . . . . . . . . . 44.9 m -136.86 111.13 8.42 Favored 'General case' 0 C--O 1.238 0.497 0 CA-C-O 120.8 0.333 . . . . 102.12 110.339 175.686 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 1.3 p -132.02 124.12 28.64 Favored 'General case' 0 CA--C 1.548 0.876 0 N-CA-C 116.687 2.106 . . . . 101.0 116.687 -166.093 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 62' ' ' LYS . . . . . . . . . . . . . 5.7 tptt -94.1 121.45 35.61 Favored 'General case' 0 C--O 1.219 -0.508 0 CA-C-N 115.786 -0.643 . . . . 112.55 111.481 179.587 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 33.5 mtmm -116.03 -168.07 1.37 Allowed 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 120.463 -0.495 . . . . 105.92 111.427 175.295 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 64' ' ' MSE . . . . . . . . . . . . . 25.2 ttt -178.96 165.66 1.56 Allowed 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 108.852 -0.796 . . . . 187.50999999999999 108.852 -177.888 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 65' ' ' GLN . . . . . 0.409 ' O ' ' C ' ' B' ' 66' ' ' ARG . 10.7 pt20 -173.07 -147.79 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 114.505 1.298 . . . . 123.56999999999999 114.505 -176.547 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 66' ' ' ARG . . . . . 0.511 ' CA ' ' NE ' ' B' ' 66' ' ' ARG . 0.1 OUTLIER . . . . . 0 N--CA 1.467 0.378 0 N-CA-C 115.145 1.535 . . . . 144.81 115.145 -170.128 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 9.0 t-20 . . . . . 0 C--O 1.237 0.425 0 CA-C-O 121.208 0.528 . . . . 128.41 111.328 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 78' ' ' GLU . . . . . . . . . . . . . 6.3 mt-10 -125.53 159.0 33.14 Favored 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 113.591 0.959 . . . . 125.76000000000001 113.591 -170.481 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 79' ' ' LYS . . . . . . . . . . . . . 37.6 tttt -124.92 131.63 53.4 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 108.327 -0.99 . . . . 112.44 108.327 171.25 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 80' ' ' MSE . . . . . . . . . . . . . 54.6 tpp -112.03 111.49 22.45 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 112.39 0.515 . . . . 122.65000000000001 112.39 179.903 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 81' ' ' ILE . . . . . . . . . . . . . 39.3 mt -110.18 93.14 2.33 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 CA-C-N 116.125 -0.489 . . . . 96.989999999999995 110.959 175.635 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 25.5 mtpt -87.21 142.77 27.66 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 122.014 0.911 . . . . 93.420000000000002 112.46 175.248 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -125.71 141.88 51.79 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 115.747 -0.661 . . . . 83.680000000000007 110.135 -179.903 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 84' ' ' PHE . . . . . . . . . . . . . 69.3 m-85 -135.6 141.41 45.11 Favored 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 109.292 -0.632 . . . . 86.379999999999995 109.292 179.724 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 85' ' ' VAL . . . . . . . . . . . . . 96.0 t -137.51 101.74 2.2 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.685 0 N-CA-C 107.967 -1.123 . . . . 82.120000000000005 107.967 174.798 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 86' ' ' ILE . . . . . . . . . . . . . 3.6 mp -102.22 112.74 36.5 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.152 0 CA-C-N 115.035 -0.984 . . . . 90.310000000000002 111.867 -177.469 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 9.3 m -98.11 121.79 40.46 Favored 'General case' 0 N--CA 1.447 -0.597 0 N-CA-C 108.21 -1.033 . . . . 90.109999999999999 108.21 173.716 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 1.5 m -119.92 157.27 29.13 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 107.766 -1.198 . . . . 99.340000000000003 107.766 176.877 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 89' ' ' ASP . . . . . . . . . . . . . 17.7 p-10 -137.52 177.41 7.89 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 113.293 0.849 . . . . 116.2 113.293 -177.891 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -65.33 5.66 0.37 Allowed 'General case' 0 N--CA 1.468 0.438 0 N-CA-C 113.506 0.928 . . . . 123.45999999999999 113.506 -176.507 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 91' ' ' ASP . . . . . . . . . . . . . 76.9 m-20 -120.62 28.09 8.17 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 115.964 -0.562 . . . . 128.18000000000001 111.329 176.178 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 92' ' ' GLY . . . . . . . . . . . . . . . 63.07 -7.89 0.27 Allowed Glycine 0 CA--C 1.522 0.513 0 N-CA-C 114.772 0.669 . . . . 122.23999999999999 114.772 -179.968 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 93' ' ' ASN . . . . . . . . . . . . . 1.8 m120 -68.14 114.57 6.75 Favored 'General case' 0 N--CA 1.466 0.343 0 N-CA-C 114.96 1.467 . . . . 121.01000000000001 114.96 -175.731 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 94' ' ' GLU . . . . . . . . . . . . . 15.4 mt-10 -105.6 134.01 49.41 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 112.996 0.739 . . . . 109.59999999999999 112.996 179.392 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 95' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -124.78 121.01 33.39 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 121.475 0.655 . . . . 94.390000000000001 109.946 168.65 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 96' ' ' ILE . . . . . 0.422 ' N ' ' CD1' ' B' ' 96' ' ' ILE . 2.1 mp -101.58 154.72 4.82 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.441 0 CA-C-N 114.543 -1.208 . . . . 86.269999999999996 110.0 -179.584 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 97' ' ' VAL . . . . . . . . . . . . . 3.5 t -142.31 111.24 2.36 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.632 0 N-CA-C 105.752 -1.944 . . . . 82.170000000000002 105.752 172.207 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 75.3 tt0 -99.61 151.69 20.89 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 115.614 -0.721 . . . . 87.030000000000001 109.625 178.637 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 99' ' ' GLU . . . . . . . . . . . . . 10.5 tt0 -144.6 113.8 6.97 Favored 'General case' 0 N--CA 1.445 -0.714 0 N-CA-C 108.721 -0.844 . . . . 90.0 108.721 170.228 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 33.0 m-20 -97.48 122.42 40.51 Favored 'General case' 0 N--CA 1.441 -0.894 0 N-CA-C 108.136 -1.061 . . . . 88.799999999999997 108.136 178.473 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 101' ' ' VAL . . . . . . . . . . . . . 53.1 t -115.67 91.94 1.95 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.424 0 CA-C-N 115.736 -0.665 . . . . 98.819999999999993 109.91 173.263 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 102' ' ' LEU . . . . . . . . . . . . . 33.4 tp -83.45 148.53 27.2 Favored 'General case' 0 CA--C 1.512 -0.511 0 CA-C-N 115.082 -0.963 . . . . 108.58 109.541 179.107 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 103' ' ' MSE . . . . . . . . . . . . . 93.4 mtp -142.8 104.99 4.42 Favored 'General case' 0 CA--C 1.504 -0.802 0 C-N-CA 120.605 -0.438 . . . . 132.16 111.926 -175.964 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 6.0 pttt -101.78 157.64 16.69 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.257 -0.646 . . . . 120.26000000000001 109.257 168.669 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 105' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -103.88 119.46 38.97 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.572 -0.74 . . . . 116.47 109.922 170.715 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 106' ' ' LEU . . . . . 0.409 ' O ' ' O ' ' B' ' 107' ' ' SER . 0.3 OUTLIER -102.54 137.54 40.64 Favored 'General case' 0 C--O 1.234 0.274 0 N-CA-C 107.747 -1.205 . . . . 111.19 107.747 175.424 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 107' ' ' SER . . . . . 0.409 ' O ' ' O ' ' B' ' 106' ' ' LEU . 0.7 OUTLIER 47.87 177.44 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 115.996 1.85 . . . . 111.97 115.996 173.246 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 49.0 m-20 . . . . . 0 N--CA 1.473 0.697 0 N-CA-C 115.477 1.658 . . . . 116.56 115.477 -177.955 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 24.7 m-85 . . . . . 0 N--CA 1.471 0.581 0 N-CA-C 113.175 0.806 . . . . 107.95 113.175 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -51.2 -50.8 58.35 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-O 121.204 0.526 . . . . 105.55 109.869 178.545 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 51.7 mm-40 -142.35 143.19 32.62 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 115.619 -0.719 . . . . 97.379999999999995 109.987 173.945 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 29.7 t0 -134.75 117.03 15.55 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 113.366 0.876 . . . . 108.98 113.366 173.729 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 21.9 m-85 -115.74 21.62 13.75 Favored 'General case' 0 CA--C 1.511 -0.533 0 CA-C-N 115.386 -0.824 . . . . 108.11 109.234 178.483 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 36.1 t80 -62.08 -36.75 82.62 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 115.171 -0.922 . . . . 121.78 109.941 177.597 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -76.23 -28.96 59.21 Favored Glycine 0 CA--C 1.524 0.61 0 N-CA-C 114.624 0.61 . . . . 123.7 114.624 177.622 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 50.4 m -75.21 166.34 23.79 Favored 'General case' 0 C--O 1.24 0.56 0 N-CA-C 113.648 0.981 . . . . 120.95999999999999 113.648 -173.563 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 1.5 p-10 -76.4 -19.61 57.96 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 115.277 -0.874 . . . . 127.48 112.464 177.021 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' VAL . . . . . 0.751 HG21 ' HE2' ' A' ' 64' ' ' MSE . 1.9 m -133.32 -177.97 2.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-O 121.466 0.651 . . . . 115.41 111.063 179.282 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 36' ' ' THR . . . . . 0.423 ' N ' HG23 ' A' ' 35' ' ' VAL . 5.0 m -132.23 108.42 9.23 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.637 -0.711 . . . . 106.15000000000001 110.907 175.586 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 37' ' ' VAL . . . . . 0.505 HG22 ' HG2' ' A' ' 64' ' ' MSE . 82.5 t -64.46 117.28 4.84 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.431 0 CA-C-N 115.945 -0.57 . . . . 90.590000000000003 109.758 172.379 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 8.6 mt-30 -95.61 -7.1 38.63 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.173 -0.467 . . . . 89.489999999999995 110.769 -177.194 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 4.2 t -171.83 157.26 4.47 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.29 -0.414 . . . . 84.969999999999999 110.23 -174.115 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 10.4 t -154.59 153.65 31.75 Favored 'General case' 0 N--CA 1.452 -0.35 0 CA-C-N 116.005 -0.543 . . . . 84.349999999999994 110.696 172.56 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' ASN . . . . . 0.424 ' O ' ' HA ' ' A' ' 60' ' ' THR . 17.1 t30 -148.26 158.49 44.12 Favored 'General case' 0 N--CA 1.444 -0.756 0 N-CA-C 107.047 -1.464 . . . . 90.150000000000006 107.047 -178.661 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 6.7 m -154.63 122.25 5.77 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.024 0.44 . . . . 87.790000000000006 110.34 175.357 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 20.7 m -124.27 157.01 35.88 Favored 'General case' 0 CA--C 1.508 -0.667 0 N-CA-C 108.468 -0.938 . . . . 95.280000000000001 108.468 178.533 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -118.9 133.09 56.06 Favored 'General case' 0 N--CA 1.443 -0.818 0 CA-C-O 121.924 0.869 . . . . 102.42 111.265 176.282 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' GLU . . . . . 0.589 ' HB2' ' HB2' ' A' ' 57' ' ' GLU . 33.3 mm-40 -111.74 134.52 53.26 Favored 'General case' 0 N--CA 1.435 -1.198 0 N-CA-C 105.361 -2.088 . . . . 99.939999999999998 105.361 177.059 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 17.6 mm -109.02 124.36 65.62 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.9 0 C-N-CA 117.901 -1.52 . . . . 98.609999999999999 109.232 168.774 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' ILE . . . . . 0.567 HD13 ' HG3' ' A' ' 57' ' ' GLU . 3.3 mp -111.22 106.43 20.75 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.596 0 CA-C-N 114.249 -1.341 . . . . 102.53 109.417 179.696 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 14.8 ttt180 -86.43 134.04 33.73 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 101.131 -3.655 . . . . 110.29000000000001 101.131 163.372 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' ASP . . . . . 0.548 ' OD1' ' N ' ' A' ' 51' ' ' SER . 3.3 p30 -106.24 -163.56 0.94 Allowed 'General case' 0 C--O 1.236 0.357 0 C-N-CA 119.144 -1.023 . . . . 109.48 112.845 -179.613 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -58.0 -29.53 65.35 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.635 -0.712 . . . . 115.41 111.94 178.952 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' SER . . . . . 0.548 ' N ' ' OD1' ' A' ' 49' ' ' ASP . 0.7 OUTLIER -96.8 18.61 14.09 Favored 'General case' 0 C--O 1.241 0.656 0 C-N-CA 123.057 0.543 . . . . 117.52 111.531 179.197 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 61.48 -5.22 0.3 Allowed Glycine 0 N--CA 1.449 -0.448 0 N-CA-C 111.181 -0.767 . . . . 113.98 111.181 -176.087 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' ALA . . . . . 0.529 ' H ' ' C ' ' A' ' 51' ' ' SER . . . -55.46 140.89 38.73 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 108.603 -0.888 . . . . 106.72 108.603 178.677 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 57.8 t -113.03 132.16 62.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.853 -0.612 . . . . 103.3 111.657 -169.228 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' ILE . . . . . 0.551 ' HB ' ' HB ' ' A' ' 47' ' ' ILE . 11.3 mt -125.88 127.13 70.96 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.486 0 CA-C-N 115.751 -0.659 . . . . 101.63 109.977 -176.146 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 56' ' ' GLU . . . . . 0.774 ' HB2' HD11 ' B' ' 106' ' ' LEU . 34.7 tt0 -93.31 133.48 36.51 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 119.633 -0.827 . . . . 115.51000000000001 109.964 168.785 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 57' ' ' GLU . . . . . 0.589 ' HB2' ' HB2' ' A' ' 45' ' ' GLU . 9.3 mt-10 -123.97 107.87 11.8 Favored 'General case' 0 N--CA 1.444 -0.756 0 CA-C-N 115.721 -0.672 . . . . 104.01000000000001 110.181 175.076 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 2.0 pt20 -97.05 128.22 43.78 Favored 'General case' 0 CA--C 1.515 -0.389 0 CA-C-O 121.951 0.882 . . . . 112.23 112.554 175.199 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' ILE . . . . . 0.43 HG12 HG22 ' B' ' 101' ' ' VAL . 3.1 mt -120.93 95.74 3.76 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.977 0 CA-C-N 114.016 -1.447 . . . . 88.859999999999999 111.2 -168.434 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 60' ' ' THR . . . . . 0.424 ' HA ' ' O ' ' A' ' 41' ' ' ASN . 1.3 m -83.85 132.62 34.79 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 114.54 -1.209 . . . . 83.629999999999995 109.495 172.68 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 5.3 m -128.55 104.73 7.84 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 115.956 -0.565 . . . . 85.400000000000006 109.915 179.036 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 21.1 mttt -103.17 144.54 31.18 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-O 121.418 0.628 . . . . 85.969999999999999 111.815 -178.771 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 9.6 tptp -121.37 118.98 30.81 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 107.633 -1.247 . . . . 86.989999999999995 107.633 169.767 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' MSE . . . . . 0.751 ' HE2' HG21 ' A' ' 35' ' ' VAL . 2.1 mtp -127.8 149.16 50.39 Favored 'General case' 0 C--O 1.212 -0.894 0 N-CA-C 107.538 -1.282 . . . . 119.68000000000001 107.538 -176.365 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 65' ' ' GLN . . . . . 0.668 ' O ' ' HB3' ' A' ' 66' ' ' ARG . 1.7 tt0 -132.74 131.15 40.88 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 107.86 -1.163 . . . . 102.58 107.86 177.632 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 66' ' ' ARG . . . . . 0.668 ' HB3' ' O ' ' A' ' 65' ' ' GLN . 0.4 OUTLIER 137.66 139.57 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 116.976 2.213 . . . . 131.63 116.976 170.195 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 67' ' ' LYS . . . . . 0.55 ' N ' ' HG3' ' A' ' 66' ' ' ARG . 1.1 ttpp -168.8 -40.53 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 105.005 -2.221 . . . . 130.44 105.005 169.636 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 4.5 t-20 . . . . . 0 C--O 1.236 0.351 0 N-CA-C 115.334 1.605 . . . . 126.48 115.334 178.576 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 73' ' ' ILE . . . . . 0.414 ' O ' HG12 ' A' ' 73' ' ' ILE . 0.2 OUTLIER . . . . . 0 CA--C 1.532 0.283 0 N-CA-C 112.037 0.384 . . . . 137.22 112.037 . . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 74' ' ' LEU . . . . . 0.687 ' HB3' ' OE1' ' A' ' 78' ' ' GLU . 9.5 mt -49.85 131.64 22.33 Favored 'General case' 0 C--O 1.235 0.292 0 N-CA-C 107.912 -1.144 . . . . 128.08000000000001 107.912 174.237 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -116.91 -111.29 2.64 Favored Glycine 0 N--CA 1.449 -0.434 0 N-CA-C 110.882 -0.887 . . . . 122.97 110.882 179.757 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 12.0 mttt 55.99 -95.41 0.05 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.251 0.548 . . . . 125.88 112.134 177.095 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 4.6 p30 -116.12 27.91 8.95 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 115.371 -0.831 . . . . 126.94 111.963 -173.291 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' GLU . . . . . 0.687 ' OE1' ' HB3' ' A' ' 74' ' ' LEU . 24.6 mt-10 -117.36 159.37 22.85 Favored 'General case' 0 CA--C 1.534 0.347 0 N-CA-C 114.308 1.225 . . . . 118.44 114.308 -167.937 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 39.5 ttmt -153.11 128.57 9.96 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 115.613 -0.721 . . . . 107.20999999999999 109.964 177.736 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' MSE . . . . . . . . . . . . . 0.0 OUTLIER -95.94 135.39 37.75 Favored 'General case' 0 C--O 1.219 -0.502 0 N-CA-C 114.004 1.113 . . . . 119.81999999999999 114.004 177.356 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 9.0 mt -135.61 88.18 0.75 Allowed 'Isoleucine or valine' 0 N--CA 1.438 -1.065 0 CA-C-O 122.296 1.046 . . . . 84.590000000000003 108.961 177.316 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 10.8 mttp -83.83 137.58 33.63 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-N 114.53 -1.214 . . . . 103.76000000000001 109.969 170.141 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 3.2 m -122.58 129.81 52.32 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 108.336 -0.987 . . . . 83.340000000000003 108.336 175.193 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' PHE . . . . . 0.458 ' HB2' ' HB2' ' B' ' 84' ' ' PHE . 94.2 m-85 -118.74 153.83 33.77 Favored 'General case' 0 CA--C 1.508 -0.659 0 C-N-CA 120.55 -0.46 . . . . 92.370000000000005 111.081 178.42 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 85' ' ' VAL . . . . . 0.451 HG12 ' O ' ' A' ' 85' ' ' VAL . 53.3 t -151.76 80.05 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 N-CA-C 108.791 -0.818 . . . . 92.650000000000006 108.791 -175.989 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 4.9 mt -92.25 137.07 22.97 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.743 0 CA-C-N 115.024 -0.989 . . . . 97.370000000000005 110.909 -174.3 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' THR . . . . . 0.441 HG21 ' HE2' ' B' ' 79' ' ' LYS . 62.3 m -121.5 136.59 54.94 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 108.888 -0.782 . . . . 104.42 108.888 175.202 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -136.81 156.87 47.93 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 116.659 -0.246 . . . . 116.64 111.52 -172.269 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 57.2 p30 -131.56 165.64 23.17 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.104 0.562 . . . . 131.78999999999999 110.974 175.21 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 3.4 p -75.02 -1.01 20.81 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 112.505 0.558 . . . . 138.13999999999999 112.505 -177.415 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 77.8 m-20 -70.31 -61.72 1.66 Allowed 'General case' 0 C--O 1.237 0.402 0 N-CA-C 108.734 -0.839 . . . . 140.36000000000001 108.734 167.617 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 150.88 -8.29 0.7 Allowed Glycine 0 C--N 1.331 0.271 0 N-CA-C 111.455 -0.658 . . . . 132.93000000000001 111.455 179.475 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 5.0 m-80 -72.5 146.39 46.87 Favored 'General case' 0 N--CA 1.465 0.28 0 N-CA-C 114.799 1.407 . . . . 137.25999999999999 114.799 -173.781 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' GLU . . . . . 0.414 ' HB2' ' HG3' ' B' ' 65' ' ' GLN . 2.2 mt-10 -123.97 -175.67 3.29 Favored 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 114.514 1.301 . . . . 122.92 114.514 -177.874 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 35.9 t -174.85 75.7 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.689 -0.687 . . . . 104.20999999999999 110.716 -174.024 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 2.7 mt -81.54 129.88 36.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 N-CA-C 114.369 1.248 . . . . 102.95 114.369 -179.537 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 69.2 t -113.88 127.13 71.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 N-CA-C 107.88 -1.156 . . . . 91.400000000000006 107.88 169.454 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 76.9 tt0 -119.07 139.27 52.02 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.656 -0.418 . . . . 96.420000000000002 111.73 -179.311 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -135.07 114.68 12.65 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-O 121.324 0.583 . . . . 92.219999999999999 111.185 172.779 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -103.17 134.58 46.34 Favored 'General case' 0 CA--C 1.51 -0.593 0 CA-C-N 115.378 -0.828 . . . . 97.510000000000005 109.629 177.497 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' VAL . . . . . 0.622 HG22 ' HG3' ' B' ' 58' ' ' GLN . 16.2 t -132.17 101.84 5.14 Favored 'Isoleucine or valine' 0 C--O 1.238 0.49 0 CA-C-N 115.473 -0.785 . . . . 96.310000000000002 109.353 -179.562 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 102' ' ' LEU . . . . . 0.601 ' O ' ' HA ' ' B' ' 56' ' ' GLU . 29.0 tp -88.55 130.73 35.17 Favored 'General case' 0 CA--C 1.517 -0.301 0 CA-C-N 115.0 -1.0 . . . . 105.27 109.875 175.132 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 103' ' ' MSE . . . . . 0.45 ' O ' ' HA ' ' A' ' 78' ' ' GLU . 1.3 mtm -118.29 102.06 8.67 Favored 'General case' 0 CA--C 1.506 -0.721 0 CA-C-N 116.124 -0.489 . . . . 110.18000000000001 110.267 -177.939 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 104' ' ' LYS . . . . . 0.426 ' O ' HG22 ' B' ' 55' ' ' ILE . 27.3 tttp -97.83 120.55 38.42 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 105.624 -1.991 . . . . 123.0 105.624 167.34 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 105' ' ' THR . . . . . 0.911 HG22 HG22 ' B' ' 54' ' ' VAL . 3.3 p -81.78 126.63 32.06 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.474 -0.784 . . . . 113.63 109.788 176.836 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 44.1 mt -92.42 -37.38 12.6 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 113.168 0.803 . . . . 109.27 113.168 -172.385 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 1.2 p -160.44 177.14 10.87 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 120.433 0.158 . . . . 114.86 110.736 171.781 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 5.4 p30 . . . . . 0 N--CA 1.465 0.277 0 N-CA-C 112.702 0.63 . . . . 123.90000000000001 112.702 -177.801 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 23' ' ' ILE . . . . . 0.674 HG23 ' OD2' ' B' ' 25' ' ' ASP . 3.6 mm . . . . . 0 CA--C 1.534 0.327 0 CA-C-O 121.059 0.457 . . . . 134.16999999999999 111.131 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 24' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -83.67 13.25 4.83 Favored 'General case' 0 C--O 1.234 0.284 0 N-CA-C 108.911 -0.774 . . . . 135.94 108.911 172.083 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 25' ' ' ASP . . . . . 0.674 ' OD2' HG23 ' B' ' 23' ' ' ILE . 2.1 m-20 -55.04 -14.53 1.58 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.309 -0.859 . . . . 133.00999999999999 110.381 179.999 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 26' ' ' PHE . . . . . . . . . . . . . 75.1 m-85 -61.89 -8.44 5.03 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 115.168 -0.924 . . . . 126.08 112.689 -178.662 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 27.2 m-20 -101.68 39.53 1.44 Allowed 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.691 -0.485 . . . . 126.08 109.691 178.393 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 20.5 pt-20 . . . . . 0 N--CA 1.466 0.345 0 CA-C-N 115.829 -0.623 . . . . 127.43000000000001 112.33 -179.297 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 13.3 t . . . . . 0 CA--C 1.538 0.49 0 N-CA-C 113.686 0.995 . . . . 118.56 113.686 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 36' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -71.64 118.65 14.73 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 113.007 0.743 . . . . 115.8 113.007 177.933 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 24.8 t -89.49 87.64 2.78 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.397 0 CA-C-N 115.838 -0.619 . . . . 110.18000000000001 111.989 177.847 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 38' ' ' GLN . . . . . . . . . . . . . 87.3 mt-30 -69.54 -1.59 9.11 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 116.772 2.138 . . . . 123.31 116.772 -171.635 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 6.6 t -174.42 158.93 2.95 Favored 'General case' 0 N--CA 1.467 0.389 0 N-CA-C 113.047 0.758 . . . . 104.56 113.047 -176.465 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 40' ' ' SER . . . . . . . . . . . . . 14.1 t -175.13 127.48 0.28 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.585 -0.734 . . . . 108.69 109.712 176.602 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 8.6 p30 -147.61 155.37 41.74 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.969 -0.56 . . . . 113.53 110.417 172.165 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 42' ' ' THR . . . . . 0.705 HG23 HD13 ' B' ' 59' ' ' ILE . 90.1 m -134.55 101.73 5.06 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.223 -0.444 . . . . 106.81999999999999 111.609 -172.258 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 43' ' ' THR . . . . . 0.604 ' CG2' ' N ' ' B' ' 44' ' ' ASP . 1.2 m -90.86 170.65 9.91 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 123.456 0.702 . . . . 106.16 111.559 179.429 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 44' ' ' ASP . . . . . 0.604 ' N ' ' CG2' ' B' ' 43' ' ' THR . 9.5 t70 -135.82 116.62 14.06 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-O 121.411 0.624 . . . . 104.81999999999999 111.698 172.692 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 45' ' ' GLU . . . . . . . . . . . . . 24.2 mt-10 -112.53 147.06 37.4 Favored 'General case' 0 CA--C 1.515 -0.376 0 CA-C-N 115.205 -0.907 . . . . 123.36 110.687 177.466 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 46' ' ' ILE . . . . . 0.699 HD13 ' HA ' ' B' ' 55' ' ' ILE . 4.4 mm -115.47 124.13 71.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 N-CA-C 107.98 -1.118 . . . . 98.060000000000002 107.98 173.52 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 47' ' ' ILE . . . . . . . . . . . . . 21.7 mm -114.48 151.31 16.27 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.555 0 CA-C-N 115.593 -0.73 . . . . 98.879999999999995 110.651 -175.163 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 3.2 ttm180 -108.55 123.69 49.3 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 108.133 -1.062 . . . . 120.41 108.133 160.312 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 49' ' ' ASP . . . . . 0.446 ' C ' ' H ' ' B' ' 51' ' ' SER . 25.2 p-10 -84.76 -156.04 0.23 Allowed 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.014 -0.539 . . . . 112.48999999999999 110.168 179.33 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -76.48 27.5 0.13 Allowed 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 115.306 -0.861 . . . . 109.13 109.775 172.977 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 51' ' ' SER . . . . . 0.446 ' H ' ' C ' ' B' ' 49' ' ' ASP . 13.7 m -165.29 -91.9 0.02 OUTLIER 'General case' 0 CA--C 1.554 1.117 0 N-CA-C 114.312 1.227 . . . . 114.87 114.312 176.436 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 52' ' ' GLY . . . . . 0.428 ' N ' ' OD1' ' B' ' 49' ' ' ASP . . . -103.71 -167.75 25.36 Favored Glycine 0 CA--C 1.526 0.725 0 N-CA-C 118.068 1.987 . . . . 106.27 118.068 -173.058 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -94.18 129.08 40.91 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 113.734 1.013 . . . . 104.7 113.734 -177.212 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 54' ' ' VAL . . . . . 0.911 HG22 HG22 ' A' ' 105' ' ' THR . 24.6 t -125.51 128.52 72.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.8 -0.636 . . . . 102.09999999999999 110.714 178.189 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 55' ' ' ILE . . . . . 0.699 ' HA ' HD13 ' B' ' 46' ' ' ILE . 1.4 tt -76.56 154.92 5.74 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.475 0 N-CA-C 106.754 -1.572 . . . . 107.05 106.754 167.311 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 56' ' ' GLU . . . . . 0.601 ' HA ' ' O ' ' A' ' 102' ' ' LEU . 12.4 mt-10 -147.01 131.45 17.64 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.337 -0.392 . . . . 103.08 110.178 177.133 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 57' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -115.66 101.15 8.58 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-O 121.182 0.515 . . . . 125.81999999999999 112.275 -176.058 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 58' ' ' GLN . . . . . 0.622 ' HG3' HG22 ' A' ' 101' ' ' VAL . 24.5 mp0 -97.0 89.3 4.78 Favored 'General case' 0 C--O 1.235 0.307 0 N-CA-C 115.267 1.58 . . . . 105.53 115.267 -171.685 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 59' ' ' ILE . . . . . 0.705 HD13 HG23 ' B' ' 42' ' ' THR . 0.2 OUTLIER -69.83 132.7 32.9 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.427 0 N-CA-C 105.896 -1.891 . . . . 102.23999999999999 105.896 161.526 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 60' ' ' THR . . . . . . . . . . . . . 44.9 m -136.86 111.13 8.42 Favored 'General case' 0 C--O 1.238 0.497 0 CA-C-O 120.8 0.333 . . . . 102.12 110.339 175.686 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 1.3 p -132.02 124.12 28.64 Favored 'General case' 0 CA--C 1.548 0.876 0 N-CA-C 116.687 2.106 . . . . 101.0 116.687 -166.093 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 62' ' ' LYS . . . . . . . . . . . . . 5.7 tptt -94.1 121.45 35.61 Favored 'General case' 0 C--O 1.219 -0.508 0 CA-C-N 115.786 -0.643 . . . . 112.55 111.481 179.587 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 33.5 mtmm -116.03 -168.07 1.37 Allowed 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 120.463 -0.495 . . . . 105.92 111.427 175.295 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 64' ' ' MSE . . . . . . . . . . . . . 25.2 ttt -178.96 165.66 1.56 Allowed 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 108.852 -0.796 . . . . 187.50999999999999 108.852 -177.888 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 65' ' ' GLN . . . . . 0.414 ' HG3' ' HB2' ' A' ' 94' ' ' GLU . 10.7 pt20 -173.07 -147.79 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 114.505 1.298 . . . . 123.56999999999999 114.505 -176.547 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 66' ' ' ARG . . . . . 0.991 ' HA ' ' HE ' ' B' ' 66' ' ' ARG . 0.1 OUTLIER . . . . . 0 N--CA 1.467 0.378 0 N-CA-C 115.145 1.535 . . . . 144.81 115.145 -170.128 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 9.0 t-20 . . . . . 0 C--O 1.237 0.425 0 CA-C-O 121.208 0.528 . . . . 128.41 111.328 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 78' ' ' GLU . . . . . 0.563 ' HA ' ' O ' ' B' ' 103' ' ' MSE . 6.3 mt-10 -125.53 159.0 33.14 Favored 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 113.591 0.959 . . . . 125.76000000000001 113.591 -170.481 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 79' ' ' LYS . . . . . 0.441 ' HE2' HG21 ' A' ' 87' ' ' THR . 37.6 tttt -124.92 131.63 53.4 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 108.327 -0.99 . . . . 112.44 108.327 171.25 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 80' ' ' MSE . . . . . 0.575 ' HE1' ' HB2' ' B' ' 102' ' ' LEU . 54.6 tpp -112.03 111.49 22.45 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 112.39 0.515 . . . . 122.65000000000001 112.39 179.903 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 81' ' ' ILE . . . . . . . . . . . . . 39.3 mt -110.18 93.14 2.33 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 CA-C-N 116.125 -0.489 . . . . 96.989999999999995 110.959 175.635 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 25.5 mtpt -87.21 142.77 27.66 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 122.014 0.911 . . . . 93.420000000000002 112.46 175.248 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -125.71 141.88 51.79 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 115.747 -0.661 . . . . 83.680000000000007 110.135 -179.903 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 84' ' ' PHE . . . . . 0.458 ' HB2' ' HB2' ' A' ' 84' ' ' PHE . 69.3 m-85 -135.6 141.41 45.11 Favored 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 109.292 -0.632 . . . . 86.379999999999995 109.292 179.724 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 85' ' ' VAL . . . . . . . . . . . . . 96.0 t -137.51 101.74 2.2 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.685 0 N-CA-C 107.967 -1.123 . . . . 82.120000000000005 107.967 174.798 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 86' ' ' ILE . . . . . 0.522 ' N ' HD12 ' B' ' 86' ' ' ILE . 3.6 mp -102.22 112.74 36.5 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.152 0 CA-C-N 115.035 -0.984 . . . . 90.310000000000002 111.867 -177.469 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 9.3 m -98.11 121.79 40.46 Favored 'General case' 0 N--CA 1.447 -0.597 0 N-CA-C 108.21 -1.033 . . . . 90.109999999999999 108.21 173.716 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 88' ' ' THR . . . . . 0.777 HG23 ' HG2' ' B' ' 94' ' ' GLU . 1.5 m -119.92 157.27 29.13 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 107.766 -1.198 . . . . 99.340000000000003 107.766 176.877 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 89' ' ' ASP . . . . . . . . . . . . . 17.7 p-10 -137.52 177.41 7.89 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 113.293 0.849 . . . . 116.2 113.293 -177.891 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -65.33 5.66 0.37 Allowed 'General case' 0 N--CA 1.468 0.438 0 N-CA-C 113.506 0.928 . . . . 123.45999999999999 113.506 -176.507 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 91' ' ' ASP . . . . . . . . . . . . . 76.9 m-20 -120.62 28.09 8.17 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 115.964 -0.562 . . . . 128.18000000000001 111.329 176.178 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 92' ' ' GLY . . . . . . . . . . . . . . . 63.07 -7.89 0.27 Allowed Glycine 0 CA--C 1.522 0.513 0 N-CA-C 114.772 0.669 . . . . 122.23999999999999 114.772 -179.968 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 93' ' ' ASN . . . . . . . . . . . . . 27.7 m-20 -68.14 114.57 6.75 Favored 'General case' 0 N--CA 1.466 0.343 0 N-CA-C 114.96 1.467 . . . . 121.01000000000001 114.96 -175.731 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 94' ' ' GLU . . . . . 0.777 ' HG2' HG23 ' B' ' 88' ' ' THR . 15.4 mt-10 -105.6 134.01 49.41 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 112.996 0.739 . . . . 109.59999999999999 112.996 179.392 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 95' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -124.78 121.01 33.39 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 121.475 0.655 . . . . 94.390000000000001 109.946 168.65 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 96' ' ' ILE . . . . . 0.635 ' N ' HD12 ' B' ' 96' ' ' ILE . 2.1 mp -101.58 154.72 4.82 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.441 0 CA-C-N 114.543 -1.208 . . . . 86.269999999999996 110.0 -179.584 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 97' ' ' VAL . . . . . . . . . . . . . 3.5 t -142.31 111.24 2.36 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.632 0 N-CA-C 105.752 -1.944 . . . . 82.170000000000002 105.752 172.207 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 75.3 tt0 -99.61 151.69 20.89 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 115.614 -0.721 . . . . 87.030000000000001 109.625 178.637 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 99' ' ' GLU . . . . . . . . . . . . . 10.5 tt0 -144.6 113.8 6.97 Favored 'General case' 0 N--CA 1.445 -0.714 0 N-CA-C 108.721 -0.844 . . . . 90.0 108.721 170.228 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 33.0 m-20 -97.48 122.42 40.51 Favored 'General case' 0 N--CA 1.441 -0.894 0 N-CA-C 108.136 -1.061 . . . . 88.799999999999997 108.136 178.473 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 101' ' ' VAL . . . . . 0.43 HG22 HG12 ' A' ' 59' ' ' ILE . 53.1 t -115.67 91.94 1.95 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.424 0 CA-C-N 115.736 -0.665 . . . . 98.819999999999993 109.91 173.263 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 102' ' ' LEU . . . . . 0.575 ' HB2' ' HE1' ' B' ' 80' ' ' MSE . 33.4 tp -83.45 148.53 27.2 Favored 'General case' 0 CA--C 1.512 -0.511 0 CA-C-N 115.082 -0.963 . . . . 108.58 109.541 179.107 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 103' ' ' MSE . . . . . 0.581 ' HE3' ' OE2' ' A' ' 57' ' ' GLU . 93.4 mtp -142.8 104.99 4.42 Favored 'General case' 0 CA--C 1.504 -0.802 0 C-N-CA 120.605 -0.438 . . . . 132.16 111.926 -175.964 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 104' ' ' LYS . . . . . 0.461 ' HE3' ' OE1' ' A' ' 56' ' ' GLU . 6.0 pttt -101.78 157.64 16.69 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.257 -0.646 . . . . 120.26000000000001 109.257 168.669 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 105' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -103.88 119.46 38.97 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.572 -0.74 . . . . 116.47 109.922 170.715 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 106' ' ' LEU . . . . . 0.774 HD11 ' HB2' ' A' ' 56' ' ' GLU . 0.3 OUTLIER -102.54 137.54 40.64 Favored 'General case' 0 C--O 1.234 0.274 0 N-CA-C 107.747 -1.205 . . . . 111.19 107.747 175.424 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 107' ' ' SER . . . . . 0.409 ' O ' ' O ' ' B' ' 106' ' ' LEU . 0.7 OUTLIER 47.87 177.44 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 115.996 1.85 . . . . 111.97 115.996 173.246 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 49.0 m-20 . . . . . 0 N--CA 1.473 0.697 0 N-CA-C 115.477 1.658 . . . . 116.56 115.477 -177.955 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 24.7 m-85 . . . . . 0 N--CA 1.471 0.581 0 N-CA-C 113.175 0.806 . . . . 107.95 113.175 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -51.2 -50.8 58.35 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-O 121.204 0.526 . . . . 105.55 109.869 178.545 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 51.7 mm-40 -142.35 143.19 32.62 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 115.619 -0.719 . . . . 97.379999999999995 109.987 173.945 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 29.7 t0 -134.75 117.03 15.55 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 113.366 0.876 . . . . 108.98 113.366 173.729 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 21.9 m-85 -115.74 21.62 13.75 Favored 'General case' 0 CA--C 1.511 -0.533 0 CA-C-N 115.386 -0.824 . . . . 108.11 109.234 178.483 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 36.1 t80 -62.08 -36.75 82.62 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 115.171 -0.922 . . . . 121.78 109.941 177.597 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -76.23 -28.96 59.21 Favored Glycine 0 CA--C 1.524 0.61 0 N-CA-C 114.624 0.61 . . . . 123.7 114.624 177.622 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 50.4 m -75.21 166.34 23.79 Favored 'General case' 0 C--O 1.24 0.56 0 N-CA-C 113.648 0.981 . . . . 120.95999999999999 113.648 -173.563 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 1.5 p-10 -76.4 -19.61 57.96 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 115.277 -0.874 . . . . 127.48 112.464 177.021 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.751 HG21 ' HE2' ' A' ' 64' ' ' MSE . 1.9 m -133.32 -177.97 2.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-O 121.466 0.651 . . . . 115.41 111.063 179.282 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' THR . . . . . 0.423 ' N ' HG23 ' A' ' 35' ' ' VAL . 5.0 m -132.23 108.42 9.23 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.637 -0.711 . . . . 106.15000000000001 110.907 175.586 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.505 HG22 ' HG2' ' A' ' 64' ' ' MSE . 82.5 t -64.46 117.28 4.84 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.431 0 CA-C-N 115.945 -0.57 . . . . 90.590000000000003 109.758 172.379 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 34.4 mt-30 -95.61 -7.1 38.63 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.173 -0.467 . . . . 89.489999999999995 110.769 -177.194 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 4.2 t -171.83 157.26 4.47 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.29 -0.414 . . . . 84.969999999999999 110.23 -174.115 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 10.4 t -154.59 153.65 31.75 Favored 'General case' 0 N--CA 1.452 -0.35 0 CA-C-N 116.005 -0.543 . . . . 84.349999999999994 110.696 172.56 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.424 ' O ' ' HA ' ' A' ' 60' ' ' THR . 17.1 t30 -148.26 158.49 44.12 Favored 'General case' 0 N--CA 1.444 -0.756 0 N-CA-C 107.047 -1.464 . . . . 90.150000000000006 107.047 -178.661 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 6.7 m -154.63 122.25 5.77 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.024 0.44 . . . . 87.790000000000006 110.34 175.357 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 20.7 m -124.27 157.01 35.88 Favored 'General case' 0 CA--C 1.508 -0.667 0 N-CA-C 108.468 -0.938 . . . . 95.280000000000001 108.468 178.533 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -118.9 133.09 56.06 Favored 'General case' 0 N--CA 1.443 -0.818 0 CA-C-O 121.924 0.869 . . . . 102.42 111.265 176.282 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.589 ' HB2' ' HB2' ' A' ' 57' ' ' GLU . 33.3 mm-40 -111.74 134.52 53.26 Favored 'General case' 0 N--CA 1.435 -1.198 0 N-CA-C 105.361 -2.088 . . . . 99.939999999999998 105.361 177.059 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 17.6 mm -109.02 124.36 65.62 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.9 0 C-N-CA 117.901 -1.52 . . . . 98.609999999999999 109.232 168.774 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.567 HD13 ' HG3' ' A' ' 57' ' ' GLU . 3.3 mp -111.22 106.43 20.75 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.596 0 CA-C-N 114.249 -1.341 . . . . 102.53 109.417 179.696 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 14.8 ttt180 -86.43 134.04 33.73 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 101.131 -3.655 . . . . 110.29000000000001 101.131 163.372 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' ASP . . . . . 0.548 ' OD1' ' N ' ' A' ' 51' ' ' SER . 3.3 p30 -106.24 -163.56 0.94 Allowed 'General case' 0 C--O 1.236 0.357 0 C-N-CA 119.144 -1.023 . . . . 109.48 112.845 -179.613 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -58.0 -29.53 65.35 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.635 -0.712 . . . . 115.41 111.94 178.952 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' SER . . . . . 0.548 ' N ' ' OD1' ' A' ' 49' ' ' ASP . 0.7 OUTLIER -96.8 18.61 14.09 Favored 'General case' 0 C--O 1.241 0.656 0 C-N-CA 123.057 0.543 . . . . 117.52 111.531 179.197 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 61.48 -5.22 0.3 Allowed Glycine 0 N--CA 1.449 -0.448 0 N-CA-C 111.181 -0.767 . . . . 113.98 111.181 -176.087 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.529 ' H ' ' C ' ' A' ' 51' ' ' SER . . . -55.46 140.89 38.73 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 108.603 -0.888 . . . . 106.72 108.603 178.677 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 57.8 t -113.03 132.16 62.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.853 -0.612 . . . . 103.3 111.657 -169.228 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.551 ' HB ' ' HB ' ' A' ' 47' ' ' ILE . 11.3 mt -125.88 127.13 70.96 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.486 0 CA-C-N 115.751 -0.659 . . . . 101.63 109.977 -176.146 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.774 ' HB2' HD11 ' B' ' 106' ' ' LEU . 34.7 tt0 -93.31 133.48 36.51 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 119.633 -0.827 . . . . 115.51000000000001 109.964 168.785 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.589 ' HB2' ' HB2' ' A' ' 45' ' ' GLU . 9.3 mt-10 -123.97 107.87 11.8 Favored 'General case' 0 N--CA 1.444 -0.756 0 CA-C-N 115.721 -0.672 . . . . 104.01000000000001 110.181 175.076 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 2.0 pt20 -97.05 128.22 43.78 Favored 'General case' 0 CA--C 1.515 -0.389 0 CA-C-O 121.951 0.882 . . . . 112.23 112.554 175.199 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.43 HG12 HG22 ' B' ' 101' ' ' VAL . 3.1 mt -120.93 95.74 3.76 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.977 0 CA-C-N 114.016 -1.447 . . . . 88.859999999999999 111.2 -168.434 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' THR . . . . . 0.424 ' HA ' ' O ' ' A' ' 41' ' ' ASN . 1.3 m -83.85 132.62 34.79 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 114.54 -1.209 . . . . 83.629999999999995 109.495 172.68 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 5.3 m -128.55 104.73 7.84 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 115.956 -0.565 . . . . 85.400000000000006 109.915 179.036 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 21.1 mttt -103.17 144.54 31.18 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-O 121.418 0.628 . . . . 85.969999999999999 111.815 -178.771 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 9.6 tptp -121.37 118.98 30.81 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 107.633 -1.247 . . . . 86.989999999999995 107.633 169.767 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' MSE . . . . . 0.751 ' HE2' HG21 ' A' ' 35' ' ' VAL . 2.1 mtp -127.8 149.16 50.39 Favored 'General case' 0 C--O 1.212 -0.894 0 N-CA-C 107.538 -1.282 . . . . 119.68000000000001 107.538 -176.365 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' GLN . . . . . 0.668 ' O ' ' HB3' ' A' ' 66' ' ' ARG . 1.7 tt0 -132.74 131.15 40.88 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 107.86 -1.163 . . . . 102.58 107.86 177.632 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' ARG . . . . . 0.668 ' HB3' ' O ' ' A' ' 65' ' ' GLN . 0.4 OUTLIER 137.66 139.57 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 116.976 2.213 . . . . 131.63 116.976 170.195 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.55 ' N ' ' HG3' ' A' ' 66' ' ' ARG . 1.1 ttpp -168.8 -40.53 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 105.005 -2.221 . . . . 130.44 105.005 169.636 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 4.5 t-20 . . . . . 0 C--O 1.236 0.351 0 N-CA-C 115.334 1.605 . . . . 126.48 115.334 178.576 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.414 ' O ' HG12 ' A' ' 73' ' ' ILE . 0.2 OUTLIER . . . . . 0 CA--C 1.532 0.283 0 N-CA-C 112.037 0.384 . . . . 137.22 112.037 . . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.687 ' HB3' ' OE1' ' A' ' 78' ' ' GLU . 9.5 mt -49.85 131.64 22.33 Favored 'General case' 0 C--O 1.235 0.292 0 N-CA-C 107.912 -1.144 . . . . 128.08000000000001 107.912 174.237 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -116.91 -111.29 2.64 Favored Glycine 0 N--CA 1.449 -0.434 0 N-CA-C 110.882 -0.887 . . . . 122.97 110.882 179.757 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 12.0 mttt 55.99 -95.41 0.05 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.251 0.548 . . . . 125.88 112.134 177.095 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 4.6 p30 -116.12 27.91 8.95 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 115.371 -0.831 . . . . 126.94 111.963 -173.291 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.687 ' OE1' ' HB3' ' A' ' 74' ' ' LEU . 24.6 mt-10 -117.36 159.37 22.85 Favored 'General case' 0 CA--C 1.534 0.347 0 N-CA-C 114.308 1.225 . . . . 118.44 114.308 -167.937 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 39.5 ttmt -153.11 128.57 9.96 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 115.613 -0.721 . . . . 107.20999999999999 109.964 177.736 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' MSE . . . . . . . . . . . . . 0.0 OUTLIER -95.94 135.39 37.75 Favored 'General case' 0 C--O 1.219 -0.502 0 N-CA-C 114.004 1.113 . . . . 119.81999999999999 114.004 177.356 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 9.0 mt -135.61 88.18 0.75 Allowed 'Isoleucine or valine' 0 N--CA 1.438 -1.065 0 CA-C-O 122.296 1.046 . . . . 84.590000000000003 108.961 177.316 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 10.8 mttp -83.83 137.58 33.63 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-N 114.53 -1.214 . . . . 103.76000000000001 109.969 170.141 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 3.2 m -122.58 129.81 52.32 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 108.336 -0.987 . . . . 83.340000000000003 108.336 175.193 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' PHE . . . . . 0.458 ' HB2' ' HB2' ' B' ' 84' ' ' PHE . 94.2 m-85 -118.74 153.83 33.77 Favored 'General case' 0 CA--C 1.508 -0.659 0 C-N-CA 120.55 -0.46 . . . . 92.370000000000005 111.081 178.42 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.451 HG12 ' O ' ' A' ' 85' ' ' VAL . 53.3 t -151.76 80.05 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 N-CA-C 108.791 -0.818 . . . . 92.650000000000006 108.791 -175.989 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 4.9 mt -92.25 137.07 22.97 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.743 0 CA-C-N 115.024 -0.989 . . . . 97.370000000000005 110.909 -174.3 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' THR . . . . . 0.441 HG21 ' HE2' ' B' ' 79' ' ' LYS . 62.3 m -121.5 136.59 54.94 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 108.888 -0.782 . . . . 104.42 108.888 175.202 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -136.81 156.87 47.93 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 116.659 -0.246 . . . . 116.64 111.52 -172.269 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 57.2 p30 -131.56 165.64 23.17 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.104 0.562 . . . . 131.78999999999999 110.974 175.21 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 3.4 p -75.02 -1.01 20.81 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 112.505 0.558 . . . . 138.13999999999999 112.505 -177.415 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 77.8 m-20 -70.31 -61.72 1.66 Allowed 'General case' 0 C--O 1.237 0.402 0 N-CA-C 108.734 -0.839 . . . . 140.36000000000001 108.734 167.617 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 150.88 -8.29 0.7 Allowed Glycine 0 C--N 1.331 0.271 0 N-CA-C 111.455 -0.658 . . . . 132.93000000000001 111.455 179.475 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 5.0 m-80 -72.5 146.39 46.87 Favored 'General case' 0 N--CA 1.465 0.28 0 N-CA-C 114.799 1.407 . . . . 137.25999999999999 114.799 -173.781 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' GLU . . . . . 0.414 ' HB2' ' HG3' ' B' ' 65' ' ' GLN . 2.2 mt-10 -123.97 -175.67 3.29 Favored 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 114.514 1.301 . . . . 122.92 114.514 -177.874 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 35.9 t -174.85 75.7 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.689 -0.687 . . . . 104.20999999999999 110.716 -174.024 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 2.7 mt -81.54 129.88 36.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 N-CA-C 114.369 1.248 . . . . 102.95 114.369 -179.537 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 69.2 t -113.88 127.13 71.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 N-CA-C 107.88 -1.156 . . . . 91.400000000000006 107.88 169.454 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 76.9 tt0 -119.07 139.27 52.02 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.656 -0.418 . . . . 96.420000000000002 111.73 -179.311 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -135.07 114.68 12.65 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-O 121.324 0.583 . . . . 92.219999999999999 111.185 172.779 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -103.17 134.58 46.34 Favored 'General case' 0 CA--C 1.51 -0.593 0 CA-C-N 115.378 -0.828 . . . . 97.510000000000005 109.629 177.497 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.622 HG22 ' HG3' ' B' ' 58' ' ' GLN . 16.2 t -132.17 101.84 5.14 Favored 'Isoleucine or valine' 0 C--O 1.238 0.49 0 CA-C-N 115.473 -0.785 . . . . 96.310000000000002 109.353 -179.562 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.601 ' O ' ' HA ' ' B' ' 56' ' ' GLU . 29.0 tp -88.55 130.73 35.17 Favored 'General case' 0 CA--C 1.517 -0.301 0 CA-C-N 115.0 -1.0 . . . . 105.27 109.875 175.132 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' MSE . . . . . 0.45 ' O ' ' HA ' ' A' ' 78' ' ' GLU . 1.3 mtm -118.29 102.06 8.67 Favored 'General case' 0 CA--C 1.506 -0.721 0 CA-C-N 116.124 -0.489 . . . . 110.18000000000001 110.267 -177.939 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.426 ' O ' HG22 ' B' ' 55' ' ' ILE . 27.3 tttp -97.83 120.55 38.42 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 105.624 -1.991 . . . . 123.0 105.624 167.34 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' THR . . . . . 0.911 HG22 HG22 ' B' ' 54' ' ' VAL . 3.3 p -81.78 126.63 32.06 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.474 -0.784 . . . . 113.63 109.788 176.836 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 44.1 mt -92.42 -37.38 12.6 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 113.168 0.803 . . . . 109.27 113.168 -172.385 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 1.2 p -160.44 177.14 10.87 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 120.433 0.158 . . . . 114.86 110.736 171.781 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 5.4 p30 . . . . . 0 N--CA 1.465 0.277 0 N-CA-C 112.702 0.63 . . . . 123.90000000000001 112.702 -177.801 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 23' ' ' ILE . . . . . 0.674 HG23 ' OD2' ' B' ' 25' ' ' ASP . 3.6 mm . . . . . 0 CA--C 1.534 0.327 0 CA-C-O 121.059 0.457 . . . . 134.16999999999999 111.131 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 24' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -83.67 13.25 4.83 Favored 'General case' 0 C--O 1.234 0.284 0 N-CA-C 108.911 -0.774 . . . . 135.94 108.911 172.083 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 25' ' ' ASP . . . . . 0.674 ' OD2' HG23 ' B' ' 23' ' ' ILE . 2.1 m-20 -55.04 -14.53 1.58 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.309 -0.859 . . . . 133.00999999999999 110.381 179.999 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 26' ' ' PHE . . . . . . . . . . . . . 75.1 m-85 -61.89 -8.44 5.03 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 115.168 -0.924 . . . . 126.08 112.689 -178.662 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 27.2 m-20 -101.68 39.53 1.44 Allowed 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.691 -0.485 . . . . 126.08 109.691 178.393 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 20.5 pt-20 . . . . . 0 N--CA 1.466 0.345 0 CA-C-N 115.829 -0.623 . . . . 127.43000000000001 112.33 -179.297 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 13.3 t . . . . . 0 CA--C 1.538 0.49 0 N-CA-C 113.686 0.995 . . . . 118.56 113.686 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 36' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -71.64 118.65 14.73 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 113.007 0.743 . . . . 115.8 113.007 177.933 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 24.8 t -89.49 87.64 2.78 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.397 0 CA-C-N 115.838 -0.619 . . . . 110.18000000000001 111.989 177.847 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 38' ' ' GLN . . . . . . . . . . . . . 87.3 mt-30 -69.54 -1.59 9.11 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 116.772 2.138 . . . . 123.31 116.772 -171.635 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 6.6 t -174.42 158.93 2.95 Favored 'General case' 0 N--CA 1.467 0.389 0 N-CA-C 113.047 0.758 . . . . 104.56 113.047 -176.465 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 40' ' ' SER . . . . . . . . . . . . . 14.1 t -175.13 127.48 0.28 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.585 -0.734 . . . . 108.69 109.712 176.602 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 8.6 p30 -147.61 155.37 41.74 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.969 -0.56 . . . . 113.53 110.417 172.165 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 42' ' ' THR . . . . . 0.705 HG23 HD13 ' B' ' 59' ' ' ILE . 90.1 m -134.55 101.73 5.06 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.223 -0.444 . . . . 106.81999999999999 111.609 -172.258 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 43' ' ' THR . . . . . 0.604 ' CG2' ' N ' ' B' ' 44' ' ' ASP . 1.2 m -90.86 170.65 9.91 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 123.456 0.702 . . . . 106.16 111.559 179.429 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 44' ' ' ASP . . . . . 0.604 ' N ' ' CG2' ' B' ' 43' ' ' THR . 9.5 t70 -135.82 116.62 14.06 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-O 121.411 0.624 . . . . 104.81999999999999 111.698 172.692 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 45' ' ' GLU . . . . . . . . . . . . . 24.2 mt-10 -112.53 147.06 37.4 Favored 'General case' 0 CA--C 1.515 -0.376 0 CA-C-N 115.205 -0.907 . . . . 123.36 110.687 177.466 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 46' ' ' ILE . . . . . 0.699 HD13 ' HA ' ' B' ' 55' ' ' ILE . 4.4 mm -115.47 124.13 71.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 N-CA-C 107.98 -1.118 . . . . 98.060000000000002 107.98 173.52 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 47' ' ' ILE . . . . . . . . . . . . . 21.7 mm -114.48 151.31 16.27 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.555 0 CA-C-N 115.593 -0.73 . . . . 98.879999999999995 110.651 -175.163 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 3.2 ttm180 -108.55 123.69 49.3 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 108.133 -1.062 . . . . 120.41 108.133 160.312 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 49' ' ' ASP . . . . . 0.446 ' C ' ' H ' ' B' ' 51' ' ' SER . 25.2 p-10 -84.76 -156.04 0.23 Allowed 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.014 -0.539 . . . . 112.48999999999999 110.168 179.33 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -76.48 27.5 0.13 Allowed 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 115.306 -0.861 . . . . 109.13 109.775 172.977 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 51' ' ' SER . . . . . 0.446 ' H ' ' C ' ' B' ' 49' ' ' ASP . 13.7 m -165.29 -91.9 0.02 OUTLIER 'General case' 0 CA--C 1.554 1.117 0 N-CA-C 114.312 1.227 . . . . 114.87 114.312 176.436 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 52' ' ' GLY . . . . . 0.428 ' N ' ' OD1' ' B' ' 49' ' ' ASP . . . -103.71 -167.75 25.36 Favored Glycine 0 CA--C 1.526 0.725 0 N-CA-C 118.068 1.987 . . . . 106.27 118.068 -173.058 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -94.18 129.08 40.91 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 113.734 1.013 . . . . 104.7 113.734 -177.212 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 54' ' ' VAL . . . . . 0.911 HG22 HG22 ' A' ' 105' ' ' THR . 24.6 t -125.51 128.52 72.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.8 -0.636 . . . . 102.09999999999999 110.714 178.189 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 55' ' ' ILE . . . . . 0.699 ' HA ' HD13 ' B' ' 46' ' ' ILE . 1.4 tt -76.56 154.92 5.74 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.475 0 N-CA-C 106.754 -1.572 . . . . 107.05 106.754 167.311 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 56' ' ' GLU . . . . . 0.601 ' HA ' ' O ' ' A' ' 102' ' ' LEU . 12.4 mt-10 -147.01 131.45 17.64 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.337 -0.392 . . . . 103.08 110.178 177.133 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 57' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -115.66 101.15 8.58 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-O 121.182 0.515 . . . . 125.81999999999999 112.275 -176.058 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 58' ' ' GLN . . . . . 0.622 ' HG3' HG22 ' A' ' 101' ' ' VAL . 24.5 mp0 -97.0 89.3 4.78 Favored 'General case' 0 C--O 1.235 0.307 0 N-CA-C 115.267 1.58 . . . . 105.53 115.267 -171.685 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 59' ' ' ILE . . . . . 0.705 HD13 HG23 ' B' ' 42' ' ' THR . 0.2 OUTLIER -69.83 132.7 32.9 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.427 0 N-CA-C 105.896 -1.891 . . . . 102.23999999999999 105.896 161.526 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 60' ' ' THR . . . . . . . . . . . . . 44.9 m -136.86 111.13 8.42 Favored 'General case' 0 C--O 1.238 0.497 0 CA-C-O 120.8 0.333 . . . . 102.12 110.339 175.686 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 1.3 p -132.02 124.12 28.64 Favored 'General case' 0 CA--C 1.548 0.876 0 N-CA-C 116.687 2.106 . . . . 101.0 116.687 -166.093 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 62' ' ' LYS . . . . . . . . . . . . . 5.7 tptt -94.1 121.45 35.61 Favored 'General case' 0 C--O 1.219 -0.508 0 CA-C-N 115.786 -0.643 . . . . 112.55 111.481 179.587 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 33.5 mtmm -116.03 -168.07 1.37 Allowed 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 120.463 -0.495 . . . . 105.92 111.427 175.295 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 64' ' ' MSE . . . . . . . . . . . . . 25.2 ttt -178.96 165.66 1.56 Allowed 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 108.852 -0.796 . . . . 187.50999999999999 108.852 -177.888 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 65' ' ' GLN . . . . . 0.414 ' HG3' ' HB2' ' A' ' 94' ' ' GLU . 10.7 pt20 -173.07 -147.79 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 114.505 1.298 . . . . 123.56999999999999 114.505 -176.547 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 66' ' ' ARG . . . . . 0.991 ' HA ' ' HE ' ' B' ' 66' ' ' ARG . 0.1 OUTLIER . . . . . 0 N--CA 1.467 0.378 0 N-CA-C 115.145 1.535 . . . . 144.81 115.145 -170.128 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 9.0 t-20 . . . . . 0 C--O 1.237 0.425 0 CA-C-O 121.208 0.528 . . . . 128.41 111.328 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 78' ' ' GLU . . . . . 0.563 ' HA ' ' O ' ' B' ' 103' ' ' MSE . 6.3 mt-10 -125.53 159.0 33.14 Favored 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 113.591 0.959 . . . . 125.76000000000001 113.591 -170.481 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 79' ' ' LYS . . . . . 0.441 ' HE2' HG21 ' A' ' 87' ' ' THR . 37.6 tttt -124.92 131.63 53.4 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 108.327 -0.99 . . . . 112.44 108.327 171.25 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 80' ' ' MSE . . . . . 0.575 ' HE1' ' HB2' ' B' ' 102' ' ' LEU . 54.6 tpp -112.03 111.49 22.45 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 112.39 0.515 . . . . 122.65000000000001 112.39 179.903 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 81' ' ' ILE . . . . . . . . . . . . . 39.3 mt -110.18 93.14 2.33 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 CA-C-N 116.125 -0.489 . . . . 96.989999999999995 110.959 175.635 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 25.5 mtpt -87.21 142.77 27.66 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 122.014 0.911 . . . . 93.420000000000002 112.46 175.248 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -125.71 141.88 51.79 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 115.747 -0.661 . . . . 83.680000000000007 110.135 -179.903 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 84' ' ' PHE . . . . . 0.458 ' HB2' ' HB2' ' A' ' 84' ' ' PHE . 69.3 m-85 -135.6 141.41 45.11 Favored 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 109.292 -0.632 . . . . 86.379999999999995 109.292 179.724 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 85' ' ' VAL . . . . . . . . . . . . . 96.0 t -137.51 101.74 2.2 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.685 0 N-CA-C 107.967 -1.123 . . . . 82.120000000000005 107.967 174.798 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 86' ' ' ILE . . . . . 0.522 ' N ' HD12 ' B' ' 86' ' ' ILE . 3.6 mp -102.22 112.74 36.5 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.152 0 CA-C-N 115.035 -0.984 . . . . 90.310000000000002 111.867 -177.469 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 9.3 m -98.11 121.79 40.46 Favored 'General case' 0 N--CA 1.447 -0.597 0 N-CA-C 108.21 -1.033 . . . . 90.109999999999999 108.21 173.716 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 88' ' ' THR . . . . . 0.777 HG23 ' HG2' ' B' ' 94' ' ' GLU . 1.5 m -119.92 157.27 29.13 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 107.766 -1.198 . . . . 99.340000000000003 107.766 176.877 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 89' ' ' ASP . . . . . . . . . . . . . 17.7 p-10 -137.52 177.41 7.89 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 113.293 0.849 . . . . 116.2 113.293 -177.891 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -65.33 5.66 0.37 Allowed 'General case' 0 N--CA 1.468 0.438 0 N-CA-C 113.506 0.928 . . . . 123.45999999999999 113.506 -176.507 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 91' ' ' ASP . . . . . . . . . . . . . 76.9 m-20 -120.62 28.09 8.17 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 115.964 -0.562 . . . . 128.18000000000001 111.329 176.178 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 92' ' ' GLY . . . . . . . . . . . . . . . 63.07 -7.89 0.27 Allowed Glycine 0 CA--C 1.522 0.513 0 N-CA-C 114.772 0.669 . . . . 122.23999999999999 114.772 -179.968 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 93' ' ' ASN . . . . . . . . . . . . . 1.8 m120 -68.14 114.57 6.75 Favored 'General case' 0 N--CA 1.466 0.343 0 N-CA-C 114.96 1.467 . . . . 121.01000000000001 114.96 -175.731 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 94' ' ' GLU . . . . . 0.777 ' HG2' HG23 ' B' ' 88' ' ' THR . 15.4 mt-10 -105.6 134.01 49.41 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 112.996 0.739 . . . . 109.59999999999999 112.996 179.392 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 95' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -124.78 121.01 33.39 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 121.475 0.655 . . . . 94.390000000000001 109.946 168.65 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 96' ' ' ILE . . . . . 0.635 ' N ' HD12 ' B' ' 96' ' ' ILE . 2.1 mp -101.58 154.72 4.82 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.441 0 CA-C-N 114.543 -1.208 . . . . 86.269999999999996 110.0 -179.584 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 97' ' ' VAL . . . . . . . . . . . . . 3.5 t -142.31 111.24 2.36 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.632 0 N-CA-C 105.752 -1.944 . . . . 82.170000000000002 105.752 172.207 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 75.3 tt0 -99.61 151.69 20.89 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 115.614 -0.721 . . . . 87.030000000000001 109.625 178.637 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 99' ' ' GLU . . . . . . . . . . . . . 10.5 tt0 -144.6 113.8 6.97 Favored 'General case' 0 N--CA 1.445 -0.714 0 N-CA-C 108.721 -0.844 . . . . 90.0 108.721 170.228 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 33.0 m-20 -97.48 122.42 40.51 Favored 'General case' 0 N--CA 1.441 -0.894 0 N-CA-C 108.136 -1.061 . . . . 88.799999999999997 108.136 178.473 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 101' ' ' VAL . . . . . 0.43 HG22 HG12 ' A' ' 59' ' ' ILE . 53.1 t -115.67 91.94 1.95 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.424 0 CA-C-N 115.736 -0.665 . . . . 98.819999999999993 109.91 173.263 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 102' ' ' LEU . . . . . 0.575 ' HB2' ' HE1' ' B' ' 80' ' ' MSE . 33.4 tp -83.45 148.53 27.2 Favored 'General case' 0 CA--C 1.512 -0.511 0 CA-C-N 115.082 -0.963 . . . . 108.58 109.541 179.107 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 103' ' ' MSE . . . . . 0.581 ' HE3' ' OE2' ' A' ' 57' ' ' GLU . 93.4 mtp -142.8 104.99 4.42 Favored 'General case' 0 CA--C 1.504 -0.802 0 C-N-CA 120.605 -0.438 . . . . 132.16 111.926 -175.964 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 104' ' ' LYS . . . . . 0.461 ' HE3' ' OE1' ' A' ' 56' ' ' GLU . 6.0 pttt -101.78 157.64 16.69 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.257 -0.646 . . . . 120.26000000000001 109.257 168.669 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 105' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -103.88 119.46 38.97 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.572 -0.74 . . . . 116.47 109.922 170.715 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 106' ' ' LEU . . . . . 0.774 HD11 ' HB2' ' A' ' 56' ' ' GLU . 0.3 OUTLIER -102.54 137.54 40.64 Favored 'General case' 0 C--O 1.234 0.274 0 N-CA-C 107.747 -1.205 . . . . 111.19 107.747 175.424 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 107' ' ' SER . . . . . 0.409 ' O ' ' O ' ' B' ' 106' ' ' LEU . 0.7 OUTLIER 47.87 177.44 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 115.996 1.85 . . . . 111.97 115.996 173.246 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 49.0 m-20 . . . . . 0 N--CA 1.473 0.697 0 N-CA-C 115.477 1.658 . . . . 116.56 115.477 -177.955 . . . . . . . . 0 0 . 1 stop_ save_