data_6p38_residue ############################ # Computer software used # ############################ 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 6p38 _Structure_validation_residue.Date_analyzed 2020-05-22 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 1521 ' ' MET . . . . . . . . . . . . . . . . . . . . 0 C--O 1.239 0.511 0 N-CA-C 109.789 -0.448 . . . . 174.24 109.789 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1522 ' ' ASP . . . . . . . . . . . . . 41.9 t0 -61.1 -13.15 15.19 Favored 'General case' 0 C--O 1.243 0.728 0 CA-C-N 115.788 -0.642 . . . . 167.15 112.69 177.626 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1523 ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -57.5 -24.78 57.91 Favored 'General case' 0 C--O 1.238 0.486 0 C-N-CA 123.145 0.578 . . . . 181.09 112.445 -170.756 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1524 ' ' ASP . . . . . . . . . . . . . 64.5 m-20 -61.42 -53.06 61.43 Favored 'General case' 0 C--O 1.239 0.505 0 C-N-CA 119.395 -0.922 . . . . 124.24 110.924 -172.088 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1525 ' ' GLN . . . . . . . . . . . . . 52.2 tp60 -61.53 -40.65 95.44 Favored 'General case' 0 C--O 1.239 0.511 0 C-N-CA 120.086 -0.646 . . . . 105.81 112.051 179.025 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1526 ' ' VAL . . . . . . . . . . . . . 2.1 p -68.29 -36.29 74.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 C-N-CA 117.869 -1.532 . . . . 110.75 110.449 -177.337 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1527 ' ' ALA . . . . . . . . . . . . . . . -66.67 -42.52 86.44 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 118.564 -1.254 . . . . 93.44 110.734 178.091 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1528 ' ' PHE . . . . . . . . . . . . . 60.6 t80 -57.9 -51.69 68.58 Favored 'General case' 0 C--O 1.243 0.752 0 C-N-CA 120.535 -0.466 . . . . 94.69 111.505 178.281 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1529 ' ' SER . . . . . . . . . . . . . 1.5 m -64.02 -30.36 71.44 Favored 'General case' 0 CA--C 1.511 -0.546 0 C-N-CA 118.579 -1.249 . . . . 93.68 110.799 178.375 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1530 ' ' PHE . . . . . . . . . . . . . 23.0 t80 -61.75 -47.41 85.34 Favored 'General case' 0 C--O 1.242 0.683 0 C-N-CA 118.1 -1.44 . . . . 96.84 110.875 177.134 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1531 ' ' ILE . . . . . . . . . . . . . 10.7 mt -64.76 -37.44 80.16 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.697 0 C-N-CA 120.171 -0.611 . . . . 93.99 110.321 -177.956 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1532 ' ' LEU . . . . . . . . . . . . . 11.7 mt -60.92 -51.77 67.86 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 120.649 -0.42 . . . . 84.28 110.807 176.581 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1533 ' ' ASP . . . . . . . . . . . . . 8.3 t70 -53.62 -38.38 63.98 Favored 'General case' 0 C--O 1.238 0.492 0 C-N-CA 118.873 -1.131 . . . . 92.98 111.464 -178.735 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1534 ' ' ASN . . . . . . . . . . . . . 32.6 m120 -76.9 -35.61 57.25 Favored 'General case' 0 CA--C 1.509 -0.612 0 C-N-CA 117.944 -1.502 . . . . 110.59 111.039 -172.813 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1535 ' ' ILE . . . . . . . . . . . . . 45.9 mt -55.3 -49.8 69.85 Favored 'Isoleucine or valine' 0 C--O 1.237 0.446 0 C-N-CA 119.997 -0.681 . . . . 94.02 109.942 171.533 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1536 ' ' VAL . . . . . . . . . . . . . 59.3 t -55.21 -56.75 9.75 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.252 0 C-N-CA 118.896 -1.122 . . . . 98.17 110.293 174.844 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1537 ' ' THR . . . . . . . . . . . . . 56.4 p -71.34 -43.36 67.13 Favored 'General case' 0 CA--C 1.513 -0.458 0 C-N-CA 118.291 -1.364 . . . . 92.03 111.894 -167.559 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1538 ' ' GLN . . . . . . . . . . . . . 6.1 pt20 -103.74 -14.72 15.98 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 117.583 -1.647 . . . . 157.47 113.201 -168.645 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1539 ' ' LYS . . . . . . . . . . . . . 2.5 mmpt? -110.89 -47.67 3.2 Favored 'General case' 0 C--O 1.24 0.568 0 C-N-CA 117.686 -1.606 . . . . 123.1 113.069 168.956 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1540 ' ' MET . . . . . . . . . . . . . 22.2 mtp -70.62 -49.71 44.68 Favored 'General case' 0 C--O 1.242 0.676 0 O-C-N 120.751 -1.218 . . . . 96.11 112.646 -176.029 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1541 ' ' MET . . . . . . . . . . . . . 80.8 mtp -69.17 -6.87 31.46 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 117.227 -1.789 . . . . 96.89 112.764 -179.339 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1542 ' ' ALA . . . . . . . . . . . . . . . -83.78 -5.43 59.2 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 113.629 0.974 . . . . 118.07 113.629 177.673 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1543 ' ' VAL . . . . . 0.417 ' O ' ' OG ' ' A' 1546 ' ' SER . 76.2 t -59.9 134.78 89.94 Favored Pre-proline 0 C--O 1.245 0.859 0 C-N-CA 119.208 -0.997 . . . . 106.16 108.516 176.67 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A 1544 ' ' PRO . . . . . . . . . . . . . 33.7 Cg_exo -54.1 138.52 71.11 Favored 'Trans proline' 0 CA--C 1.515 -0.447 0 CA-C-N 119.81 0.968 . . . . 117.6 110.105 177.016 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1545 ' ' ASP . . . . . . . . . . . . . 40.2 m-20 58.24 37.68 26.13 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 115.779 -0.646 . . . . 119.15 111.735 172.257 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1546 ' ' SER . . . . . 0.417 ' OG ' ' O ' ' A' 1543 ' ' VAL . 2.3 p -99.87 -5.36 28.54 Favored 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 117.307 -1.757 . . . . 99.58 112.618 179.476 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A 1547 ' ' TRP . . . . . . . . . . . . . 44.7 p-90 -43.37 -39.05 4.19 Favored Pre-proline 0 C--O 1.238 0.5 0 N-CA-C 115.294 1.59 . . . . 132.04 115.294 -177.699 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1548 ' ' PRO . . . . . . . . . . . . . 23.6 Cg_endo -59.66 -21.32 62.32 Favored 'Trans proline' 0 C--O 1.244 0.811 0 CA-C-N 121.503 1.572 . . . . 92.01 113.299 178.314 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1549 ' ' PHE . . . . . . . . . . . . . 83.9 m-85 -93.46 1.32 56.86 Favored 'General case' 0 C--O 1.238 0.498 0 N-CA-C 112.561 0.578 . . . . 103.47 112.561 179.504 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1550 ' ' HIS . . . . . . . . . . . . . 37.4 m170 -76.77 -31.75 57.25 Favored 'General case' 0 C--O 1.239 0.506 0 C-N-CA 119.486 -0.886 . . . . 93.81 111.642 -175.935 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1551 ' ' HIS . . . . . . . . . . . . . 5.3 m-70 -129.84 166.05 28.92 Favored Pre-proline 0 CA--C 1.508 -0.659 0 CA-C-O 121.298 0.57 . . . . 106.58 110.52 -173.056 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1552 ' ' PRO . . . . . . . . . . . . . 84.2 Cg_exo -54.91 144.06 69.12 Favored 'Trans proline' 0 N--CA 1.453 -0.858 0 N-CA-C 108.611 -1.342 . . . . 96.38 108.611 171.998 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1553 ' ' VAL . . . . . 0.422 ' O ' ' OH ' ' A' 1562 ' ' TYR . 26.7 t -57.78 130.88 21.37 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.544 0 N-CA-C 108.192 -1.04 . . . . 87.5 108.192 173.971 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A 1554 ' ' ASN . . . . . . . . . . . . . 64.1 t-20 -79.07 115.3 18.66 Favored 'General case' 0 C--O 1.242 0.673 0 CA-C-O 121.188 0.518 . . . . 102.04 110.783 175.278 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1555 ' ' LYS . . . . . . . . . . . . . . . -53.25 -34.57 57.73 Favored 'General case' 0 C--O 1.227 -0.098 0 CA-C-N 115.905 -0.589 . . . . 105.79 111.682 178.392 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1556 ' ' LYS . . . . . . . . . . . . . 60.1 tttt -55.26 -27.86 49.41 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 117.921 0.328 . . . . 108.7 111.67 -179.918 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1557 ' ' PHE . . . . . . . . . . . . . 33.3 m-85 -102.99 -22.58 13.79 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 113.199 0.814 . . . . 101.65 113.199 -175.683 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1558 ' ' VAL . . . . . . . . . . . . . 48.5 t -138.26 84.86 19.33 Favored Pre-proline 0 C--N 1.321 -0.661 0 N-CA-C 104.416 -2.438 . . . . 103.75 104.416 -173.079 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1559 ' ' PRO . . . . . . . . . . . . . 6.1 Cg_endo -70.5 -21.44 30.04 Favored 'Trans proline' 0 CA--C 1.515 -0.467 0 N-CA-C 114.322 0.855 . . . . 106.05 114.322 -165.857 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1560 ' ' ASP . . . . . . . . . . . . . 20.2 p-10 -92.55 -0.27 57.35 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 119.724 1.147 . . . . 123.07 113.933 179.206 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1561 ' ' TYR . . . . . . . . . . . . . 43.5 t80 -58.15 -53.79 54.34 Favored 'General case' 0 C--O 1.238 0.457 0 CA-C-N 119.649 1.113 . . . . 105.55 111.369 -164.2 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1562 ' ' TYR . . . . . 0.422 ' OH ' ' O ' ' A' 1553 ' ' VAL . 98.0 m-85 -73.83 1.63 10.16 Favored 'General case' 0 CA--C 1.513 -0.453 0 C-N-CA 122.792 0.437 . . . . 113.01 111.792 -175.199 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A 1563 ' ' LYS . . . . . . . . . . . . . 19.4 mttt -98.84 -23.01 15.54 Favored 'General case' 0 N--CA 1.448 -0.565 0 N-CA-C 112.993 0.738 . . . . 137.79 112.993 171.249 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1564 ' ' VAL . . . . . . . . . . . . . 2.3 p -107.88 -24.72 3.91 Favored 'Isoleucine or valine' 0 C--O 1.237 0.414 0 CA-C-N 119.138 0.881 . . . . 119.79 109.843 178.499 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1565 ' ' ILE . . . . . . . . . . . . . 18.8 mm -100.9 112.18 32.95 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 N-CA-C 108.131 -1.063 . . . . 111.06 108.131 173.744 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1566 ' ' VAL . . . . . . . . . . . . . 2.2 p -89.96 -27.61 5.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 C-N-CA 118.785 -1.166 . . . . 131.61 112.094 -170.805 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1567 ' ' ASN . . . . . . . . . . . . . 80.5 m-20 -121.05 91.96 48.23 Favored Pre-proline 0 C--O 1.242 0.661 0 N-CA-C 109.06 -0.718 . . . . 118.12 109.06 172.049 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1568 ' ' PRO . . . . . . . . . . . . . 10.6 Cg_exo -71.42 158.5 54.01 Favored 'Trans proline' 0 C--N 1.323 -0.785 0 CA-C-O 122.071 0.78 . . . . 98.71 110.352 179.89 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1569 ' ' MET . . . . . . . . . . . . . 36.8 tpp -161.29 149.95 15.99 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 114.619 -1.173 . . . . 96.08 108.43 178.386 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1570 ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -162.63 170.79 17.92 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 114.708 -1.133 . . . . 101.46 108.188 -179.241 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1571 ' ' LEU . . . . . . . . . . . . . 99.2 mt -68.05 -36.89 80.62 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 114.234 -1.348 . . . . 100.71 111.787 -174.327 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1572 ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -64.75 -41.94 95.53 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 118.043 -1.463 . . . . 117.02 110.688 -177.56 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1573 ' ' THR . . . . . . . . . . . . . 2.6 p -67.85 -38.47 83.18 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 118.396 -1.322 . . . . 102.65 110.114 179.174 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1574 ' ' ILE . . . . . . . . . . . . . 15.3 mt -54.64 -47.9 72.17 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.498 0 C-N-CA 119.331 -0.948 . . . . 87.49 110.126 171.822 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1575 ' ' ARG . . . . . . . . . . . . . 52.8 mtp180 -56.0 -43.45 77.7 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 119.395 -0.922 . . . . 98.95 111.643 175.077 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1576 ' ' LYS . . . . . . . . . . . . . 12.0 mttp -60.72 -36.82 79.8 Favored 'General case' 0 C--O 1.239 0.51 0 C-N-CA 119.494 -0.883 . . . . 127.98 111.166 177.91 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1577 ' ' ASN . . . . . . . . . . . . . 97.7 m-20 -67.7 -34.28 76.56 Favored 'General case' 0 C--O 1.239 0.532 0 C-N-CA 118.597 -1.241 . . . . 93.65 110.617 176.805 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1578 ' ' ILE . . . . . . . . . . . . . 86.7 mt -66.7 -38.61 81.92 Favored 'Isoleucine or valine' 0 C--O 1.242 0.684 0 C-N-CA 120.064 -0.655 . . . . 87.63 110.128 178.283 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1579 ' ' SER . . . . . . . . . . . . . 85.9 p -60.21 -34.36 73.53 Favored 'General case' 0 CA--C 1.518 -0.269 0 C-N-CA 120.901 -0.319 . . . . 111.61 110.659 177.047 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1580 ' ' LYS . . . . . . . . . . . . . 40.0 mttt -94.8 19.39 10.18 Favored 'General case' 0 C--O 1.24 0.593 0 N-CA-C 112.432 0.53 . . . . 125.85 112.432 177.457 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1581 ' ' HIS . . . . . . . . . . . . . 82.7 m-70 45.19 52.08 8.8 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-O 121.509 0.671 . . . . 107.85 111.566 176.49 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1582 ' ' LYS . . . . . . . . . . . . . 19.5 tttt -73.95 -40.5 63.0 Favored 'General case' 0 CA--C 1.512 -0.509 0 CA-C-N 115.746 -0.661 . . . . 105.13 110.509 178.627 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1583 ' ' TYR . . . . . . . . . . . . . 22.5 m-85 -93.5 124.85 37.77 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 108.622 -0.881 . . . . 101.89 108.622 -175.018 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1584 ' ' GLN . . . . . . . . . . . . . 36.2 mt-30 -108.74 -13.45 14.78 Favored 'General case' 0 CA--C 1.515 -0.388 0 C-N-CA 124.392 1.077 . . . . 137.82 112.394 176.438 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1585 ' ' SER . . . . . . . . . . . . . 27.1 p -136.72 164.14 28.96 Favored 'General case' 0 C--N 1.323 -0.547 0 C-N-CA 125.254 1.421 . . . . 111.24 107.817 175.009 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1586 ' ' ARG . . . . . 0.487 ' NH2' ' OD2' ' A' 1629 ' ' ASP . 7.6 mtm180 -47.87 -32.45 6.24 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 113.468 0.914 . . . . 106.84 113.468 169.823 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A 1587 ' ' GLU . . . . . . . . . . . . . 23.0 mp0 -82.62 -45.45 14.54 Favored 'General case' 0 C--N 1.322 -0.619 0 C-N-CA 118.579 -1.248 . . . . 151.28 112.225 -154.875 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1588 ' ' SER . . . . . . . . . . . . . 1.7 p -61.0 -27.49 68.35 Favored 'General case' 0 C--O 1.238 0.488 0 O-C-N 121.696 -0.627 . . . . 123.67 111.331 172.495 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1589 ' ' PHE . . . . . . . . . . . . . 61.3 t80 -69.15 -53.5 19.79 Favored 'General case' 0 C--O 1.241 0.64 0 CA-C-O 120.782 0.325 . . . . 94.24 110.392 175.832 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1590 ' ' LEU . . . . . . . . . . . . . 19.1 mt -57.85 -38.22 75.3 Favored 'General case' 0 C--O 1.242 0.667 0 N-CA-C 112.219 0.451 . . . . 92.86 112.219 178.5 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1591 ' ' ASP . . . . . . . . . . . . . 82.5 m-20 -42.38 -55.83 3.24 Favored 'General case' 0 C--O 1.238 0.498 0 C-N-CA 120.454 -0.498 . . . . 97.97 110.629 168.999 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1592 ' ' ASP . . . . . . . . . . . . . 81.2 m-20 -72.95 -33.76 66.09 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 119.409 -0.916 . . . . 93.55 111.496 -172.952 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1593 ' ' VAL . . . . . . . . . . . . . 2.9 m -69.35 -46.75 76.14 Favored 'Isoleucine or valine' 0 C--O 1.235 0.308 0 C-N-CA 116.111 -2.236 . . . . 91.4 109.519 177.126 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1594 ' ' ASN . . . . . . . . . . . . . 32.1 m-20 -55.02 -31.19 60.88 Favored 'General case' 0 C--O 1.244 0.789 0 O-C-N 121.818 -0.551 . . . . 97.46 111.509 179.58 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1595 ' ' LEU . . . . . . . . . . . . . 45.8 tp -61.57 -37.95 85.71 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 116.178 -0.465 . . . . 96.88 111.866 178.245 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1596 ' ' ILE . . . . . . . . . . . . . 70.0 mt -57.9 -40.44 76.32 Favored 'Isoleucine or valine' 0 C--O 1.241 0.643 0 O-C-N 122.087 -0.383 . . . . 90.17 111.02 178.378 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1597 ' ' LEU . . . . . . . . . . . . . 44.5 tp -72.49 -51.0 22.02 Favored 'General case' 0 CA--C 1.515 -0.396 0 N-CA-C 110.151 -0.314 . . . . 106.6 110.151 178.317 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1598 ' ' ALA . . . . . . . . . . . . . . . -47.17 -39.02 12.84 Favored 'General case' 0 C--O 1.238 0.492 0 CA-C-O 120.678 0.275 . . . . 108.93 111.359 173.643 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1599 ' ' ASN . . . . . . . . . . . . . 70.1 m-20 -73.11 -32.81 65.19 Favored 'General case' 0 CA--C 1.513 -0.454 0 C-N-CA 118.505 -1.278 . . . . 105.73 111.555 -178.859 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1600 ' ' SER . . . . . . . . . . . . . 40.7 t -70.5 -34.19 72.06 Favored 'General case' 0 C--N 1.324 -0.517 0 C-N-CA 118.476 -1.29 . . . . 98.28 111.059 -179.115 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1601 ' ' VAL . . . . . . . . . . . . . 3.8 m -66.28 -41.02 88.33 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.783 0 C-N-CA 118.945 -1.102 . . . . 120.53 110.107 -179.848 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1602 ' ' LYS . . . . . . . . . . . . . 20.5 mttp -67.21 -46.32 74.19 Favored 'General case' 0 C--N 1.339 0.137 0 C-N-CA 118.197 -1.401 . . . . 142.61 110.754 178.956 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1603 ' ' TYR . . . . . . . . . . . . . 30.5 t80 -78.48 -44.16 25.22 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 116.588 -2.045 . . . . 108.28 112.657 -175.428 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1604 ' ' ASN . . . . . . . . . . . . . 75.1 m-20 -98.07 -17.49 19.08 Favored 'General case' 0 CA--C 1.51 -0.58 0 O-C-N 121.376 -0.827 . . . . 116.35 112.659 -171.446 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1605 ' ' GLY . . . . . . . . . . . . . . . 98.07 159.28 30.33 Favored Glycine 0 N--CA 1.433 -1.51 0 CA-C-O 122.502 1.057 . . . . 113.21 111.667 -178.53 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1606 ' ' PRO . . . . . . . . . . . . . 4.6 Cg_exo -67.72 -31.55 32.2 Favored 'Trans proline' 0 C--N 1.329 -0.47 0 CA-C-O 118.592 -0.67 . . . . 119.3 113.822 -170.221 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1607 ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -120.83 42.0 3.14 Favored 'General case' 0 CA--C 1.528 0.128 0 C-N-CA 117.634 -1.626 . . . . 179.57 111.928 179.854 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1608 ' ' SER . . . . . . . . . . . . . 37.5 t -82.29 144.03 30.9 Favored 'General case' 0 N--CA 1.456 -0.172 0 CA-C-O 121.351 0.596 . . . . 131.61 110.848 167.711 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1609 ' ' GLN . . . . . . . . . . . . . 2.5 pt20 -59.27 -29.89 67.9 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 115.954 -0.567 . . . . 164.03 111.671 179.844 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1610 ' ' TYR . . . . . . . . . . . . . 51.2 m-85 -67.97 -42.21 81.21 Favored 'General case' 0 C--O 1.241 0.624 0 C-N-CA 120.864 -0.334 . . . . 159.61 111.356 173.884 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1611 ' ' THR . . . . . . . . . . . . . 65.6 m -59.53 -34.44 72.65 Favored 'General case' 0 C--O 1.242 0.695 0 C-N-CA 120.138 -0.625 . . . . 108.96 110.931 172.624 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1612 ' ' LYS . . . . . . . . . . . . . 11.5 mttt -70.89 -34.83 71.97 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 119.405 -0.918 . . . . 134.03 111.861 -177.672 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1613 ' ' THR . . . . . . . . . . . . . 1.5 p -74.78 -36.88 62.52 Favored 'General case' 0 C--O 1.238 0.463 0 C-N-CA 117.581 -1.648 . . . . 116.11 110.43 177.919 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1614 ' ' ALA . . . . . . . . . . . . . . . -55.95 -43.54 77.59 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 119.217 -0.993 . . . . 90.83 111.222 169.575 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1615 ' ' GLN . . . . . . . . . . . . . 41.9 tp60 -53.78 -46.28 70.94 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 118.654 -1.219 . . . . 105.51 110.818 176.358 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1616 ' ' GLU . . . . . . . . . . . . . 5.9 tt0 -68.96 -35.83 77.2 Favored 'General case' 0 C--O 1.246 0.88 0 C-N-CA 117.326 -1.749 . . . . 145.48 111.369 -176.35 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1617 ' ' ILE . . . . . . . . . . . . . 94.7 mt -52.96 -52.62 27.18 Favored 'Isoleucine or valine' 0 C--O 1.24 0.555 0 C-N-CA 119.399 -0.92 . . . . 91.25 110.461 169.477 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1618 ' ' VAL . . . . . . . . . . . . . 78.6 t -54.29 -37.64 37.22 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.179 0 C-N-CA 118.712 -1.195 . . . . 89.77 110.597 174.969 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1619 ' ' ASN . . . . . . . . . . . . . 87.7 m-20 -69.97 -52.38 24.8 Favored 'General case' 0 C--O 1.242 0.661 0 C-N-CA 118.138 -1.425 . . . . 103.9 110.324 -172.803 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1620 ' ' VAL . . . . . . . . . . . . . 6.7 p -61.78 -27.36 42.08 Favored 'Isoleucine or valine' 0 C--O 1.241 0.618 0 C-N-CA 120.106 -0.638 . . . . 100.17 109.837 -177.044 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1621 ' ' CYS . . . . . . . . . . . . . 42.4 t -61.83 -53.96 48.79 Favored 'General case' 0 N--CA 1.449 -0.488 0 C-N-CA 118.361 -1.335 . . . . 96.86 110.328 174.373 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1622 ' ' TYR . . . . . . . . . . . . . 44.3 m-85 -60.5 -39.65 88.5 Favored 'General case' 0 C--O 1.238 0.475 0 O-C-N 121.284 -0.885 . . . . 98.4 111.092 -179.956 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1623 ' ' GLN . . . . . . . . . . . . . 81.8 mt-30 -57.17 -48.35 78.95 Favored 'General case' 0 C--O 1.241 0.625 0 CA-C-O 121.105 0.479 . . . . 140.85 110.404 -179.933 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1624 ' ' THR . . . . . . . . . . . . . 24.4 m -62.72 -44.57 95.87 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 119.669 -0.812 . . . . 108.58 111.288 178.515 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1625 ' ' LEU . . . . . . . . . . . . . 22.4 mt -61.48 -37.16 82.63 Favored 'General case' 0 C--O 1.238 0.462 0 C-N-CA 118.187 -1.405 . . . . 92.94 111.959 -175.723 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1626 ' ' THR . . . . . . . . . . . . . 40.1 p -72.9 -32.97 65.71 Favored 'General case' 0 C--O 1.238 0.468 0 C-N-CA 116.987 -1.885 . . . . 110.62 111.059 179.845 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1627 ' ' GLU . . . . . . . . . . . . . 18.0 mt-10 -54.2 -40.99 68.11 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-O 120.925 0.393 . . . . 151.32 111.434 173.309 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1628 ' ' TYR . . . . . . . . . . . . . 10.7 m-30 -101.86 20.47 16.34 Favored 'General case' 0 N--CA 1.447 -0.593 0 C-N-CA 123.092 0.557 . . . . 123.08 112.283 179.775 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1629 ' ' ASP . . . . . 0.487 ' OD2' ' NH2' ' A' 1586 ' ' ARG . 20.2 t70 -56.01 -56.79 16.53 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 120.022 -0.671 . . . . 107.21 111.216 -171.23 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A 1630 ' ' GLU . . . . . . . . . . . . . 7.3 mt-10 -59.93 -41.68 92.33 Favored 'General case' 0 C--O 1.238 0.468 0 C-N-CA 119.981 -0.688 . . . . 147.54 111.044 -176.086 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1631 ' ' HIS . . . . . . . . . . . . . 50.5 t-80 -60.37 -49.71 76.51 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-O 120.882 0.373 . . . . 110.15 111.875 175.96 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1632 ' ' LEU . . . . . . . . . . . . . 70.3 mt -66.11 -35.9 81.72 Favored 'General case' 0 C--N 1.333 -0.141 0 C-N-CA 119.176 -1.009 . . . . 86.95 112.222 -179.907 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1633 ' ' THR . . . . . . . . . . . . . 9.0 m -57.22 -41.43 79.46 Favored 'General case' 0 C--O 1.242 0.66 0 C-N-CA 118.972 -1.091 . . . . 92.16 110.711 179.05 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1634 ' ' GLN . . . . . . . . . . . . . 63.1 tp60 -59.35 -60.11 4.38 Favored 'General case' 0 C--O 1.24 0.601 0 CA-C-O 121.029 0.442 . . . . 114.96 110.652 178.73 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1635 ' ' LEU . . . . . . . . . . . . . 41.2 mt -44.27 -47.1 9.39 Favored 'General case' 0 C--O 1.238 0.479 0 N-CA-C 113.29 0.848 . . . . 91.07 113.29 172.442 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1636 ' ' GLU . . . . . 0.466 ' OE2' ' N ' ' A' 1586 ' ' ARG . 70.2 mt-10 -61.88 -42.37 98.98 Favored 'General case' 0 C--O 1.24 0.59 0 O-C-N 122.174 -0.328 . . . . 107.43 111.399 -177.564 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A 1637 ' ' LYS . . . . . . . . . . . . . 20.2 tttt -62.56 -52.79 62.02 Favored 'General case' 0 C--O 1.24 0.564 0 CA-C-O 120.748 0.308 . . . . 116.86 111.121 178.887 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1638 ' ' ASP . . . . . . . . . . . . . 89.7 m-20 -59.68 -33.33 71.44 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 120.085 -0.646 . . . . 111.09 110.576 -175.297 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1639 ' ' ILE . . . . . . . . . . . . . 89.2 mt -69.12 -41.5 81.48 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 C-N-CA 118.793 -1.163 . . . . 101.87 111.225 179.509 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1640 ' ' CYS . . . . . 1.462 ' CB ' ' SG ' ' A' 1640 ' ' CYS . 0.0 OUTLIER -69.34 -37.67 77.78 Favored 'General case' 0 C--O 1.24 0.576 0 O-C-N 121.584 -0.698 . . . . 124.31 111.302 -179.031 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A 1641 ' ' THR . . . . . . . . . . . . . 38.8 p -66.51 -44.87 81.37 Favored 'General case' 0 C--O 1.238 0.485 0 C-N-CA 118.953 -1.099 . . . . 117.56 110.813 178.641 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1642 ' ' ALA . . . . . . . . . . . . . . . -54.26 -56.08 21.87 Favored 'General case' 0 C--O 1.237 0.439 0 CA-C-O 121.128 0.489 . . . . 120.29 111.213 174.099 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1643 ' ' LYS . . . . . . . . . . . . . 10.3 tttt -51.03 -61.21 2.37 Favored 'General case' 0 C--O 1.238 0.466 0 CA-C-O 120.85 0.357 . . . . 150.62 111.059 176.319 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1644 ' ' GLU . . . . . . . . . . . . . . . -61.47 -26.56 67.98 Favored 'General case' 0 C--O 1.234 0.238 0 C-N-CA 120.498 -0.481 . . . . 158.97 112.296 -174.823 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1645 ' ' ALA . . . . . . . . . . . . . . . -94.93 -12.09 27.44 Favored 'General case' 0 C--O 1.236 0.39 0 N-CA-C 113.249 0.833 . . . . 151.57 113.249 176.436 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1646 ' ' ALA . . . . . . . . . . . . . . . -63.97 -18.05 63.89 Favored 'General case' 0 C--O 1.235 0.333 0 C-N-CA 120.147 -0.621 . . . . 171.21 111.59 172.549 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1647 ' ' LEU . . . . . . . . . . . . . 4.7 mp -92.45 50.05 1.57 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.573 0.701 . . . . 165.67 111.174 -175.436 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1648 ' ' GLU . . . . . 0.712 ' C ' ' OE1' ' A' 1648 ' ' GLU . 0.7 OUTLIER . . . . . 0 CA--C 1.54 0.578 0 CA-C-O 121.679 0.752 . . . . 198.95 112.998 -177.93 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A 4000 ' ' NQV . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1521 ' ' MET . . . . . . . . . . . . . . . . . . . . 0 C--O 1.239 0.511 0 N-CA-C 109.789 -0.448 . . . . 174.24000000000001 109.789 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1522 ' ' ASP . . . . . . . . . . . . . 41.9 t0 -61.1 -13.15 15.19 Favored 'General case' 0 C--O 1.243 0.728 0 CA-C-N 115.788 -0.642 . . . . 167.15000000000001 112.69 177.626 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1523 ' ' ASP . . . . . 0.404 ' HA ' ' CG1' ' A' 1526 ' ' VAL . 1.2 m-20 -57.5 -24.78 57.91 Favored 'General case' 0 C--O 1.238 0.486 0 C-N-CA 123.145 0.578 . . . . 181.09 112.445 -170.756 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A 1524 ' ' ASP . . . . . . . . . . . . . 64.5 m-20 -61.42 -53.06 61.43 Favored 'General case' 0 C--O 1.239 0.505 0 C-N-CA 119.395 -0.922 . . . . 124.23999999999999 110.924 -172.088 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1525 ' ' GLN . . . . . . . . . . . . . 52.2 tp60 -61.53 -40.65 95.44 Favored 'General case' 0 C--O 1.239 0.511 0 C-N-CA 120.086 -0.646 . . . . 105.81 112.051 179.025 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1526 ' ' VAL . . . . . 0.404 ' CG1' ' HA ' ' A' 1523 ' ' ASP . 2.1 p -68.29 -36.29 74.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 C-N-CA 117.869 -1.532 . . . . 110.75 110.449 -177.337 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A 1527 ' ' ALA . . . . . . . . . . . . . . . -66.67 -42.52 86.44 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 118.564 -1.254 . . . . 93.439999999999998 110.734 178.091 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1528 ' ' PHE . . . . . . . . . . . . . 60.6 t80 -57.9 -51.69 68.58 Favored 'General case' 0 C--O 1.243 0.752 0 C-N-CA 120.535 -0.466 . . . . 94.689999999999998 111.505 178.281 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1529 ' ' SER . . . . . 0.456 ' HB3' HG23 ' A' 1578 ' ' ILE . 1.5 m -64.02 -30.36 71.44 Favored 'General case' 0 CA--C 1.511 -0.546 0 C-N-CA 118.579 -1.249 . . . . 93.680000000000007 110.799 178.375 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A 1530 ' ' PHE . . . . . . . . . . . . . 23.0 t80 -61.75 -47.41 85.34 Favored 'General case' 0 C--O 1.242 0.683 0 C-N-CA 118.1 -1.44 . . . . 96.840000000000003 110.875 177.134 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1531 ' ' ILE . . . . . 0.43 ' O ' HG13 ' A' 1535 ' ' ILE . 10.7 mt -64.76 -37.44 80.16 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.697 0 C-N-CA 120.171 -0.611 . . . . 93.989999999999995 110.321 -177.956 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A 1532 ' ' LEU . . . . . 0.41 HD23 ' HA ' ' A' 1532 ' ' LEU . 11.7 mt -60.92 -51.77 67.86 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 120.649 -0.42 . . . . 84.280000000000001 110.807 176.581 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A 1533 ' ' ASP . . . . . . . . . . . . . 8.3 t70 -53.62 -38.38 63.98 Favored 'General case' 0 C--O 1.238 0.492 0 C-N-CA 118.873 -1.131 . . . . 92.980000000000004 111.464 -178.735 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1534 ' ' ASN . . . . . . . . . . . . . 32.6 m120 -76.9 -35.61 57.25 Favored 'General case' 0 CA--C 1.509 -0.612 0 C-N-CA 117.944 -1.502 . . . . 110.59 111.039 -172.813 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1535 ' ' ILE . . . . . 0.43 HG13 ' O ' ' A' 1531 ' ' ILE . 45.9 mt -55.3 -49.8 69.85 Favored 'Isoleucine or valine' 0 C--O 1.237 0.446 0 C-N-CA 119.997 -0.681 . . . . 94.019999999999996 109.942 171.533 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A 1536 ' ' VAL . . . . . . . . . . . . . 59.3 t -55.21 -56.75 9.75 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.252 0 C-N-CA 118.896 -1.122 . . . . 98.170000000000002 110.293 174.844 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1537 ' ' THR . . . . . . . . . . . . . 56.4 p -71.34 -43.36 67.13 Favored 'General case' 0 CA--C 1.513 -0.458 0 C-N-CA 118.291 -1.364 . . . . 92.030000000000001 111.894 -167.559 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1538 ' ' GLN . . . . . . . . . . . . . 6.1 pt20 -103.74 -14.72 15.98 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 117.583 -1.647 . . . . 157.47 113.201 -168.645 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1539 ' ' LYS . . . . . . . . . . . . . 2.5 mmpt? -110.89 -47.67 3.2 Favored 'General case' 0 C--O 1.24 0.568 0 C-N-CA 117.686 -1.606 . . . . 123.09999999999999 113.069 168.956 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1540 ' ' MET . . . . . . . . . . . . . 22.2 mtp -70.62 -49.71 44.68 Favored 'General case' 0 C--O 1.242 0.676 0 O-C-N 120.751 -1.218 . . . . 96.109999999999999 112.646 -176.029 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1541 ' ' MET . . . . . . . . . . . . . 80.8 mtp -69.17 -6.87 31.46 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 117.227 -1.789 . . . . 96.890000000000001 112.764 -179.339 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1542 ' ' ALA . . . . . . . . . . . . . . . -83.78 -5.43 59.2 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 113.629 0.974 . . . . 118.06999999999999 113.629 177.673 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1543 ' ' VAL . . . . . . . . . . . . . 76.2 t -59.9 134.78 89.94 Favored Pre-proline 0 C--O 1.245 0.859 0 C-N-CA 119.208 -0.997 . . . . 106.16 108.516 176.67 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1544 ' ' PRO . . . . . . . . . . . . . 33.7 Cg_exo -54.1 138.52 71.11 Favored 'Trans proline' 0 CA--C 1.515 -0.447 0 CA-C-N 119.81 0.968 . . . . 117.59999999999999 110.105 177.016 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1545 ' ' ASP . . . . . . . . . . . . . 40.2 m-20 58.24 37.68 26.13 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 115.779 -0.646 . . . . 119.15000000000001 111.735 172.257 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1546 ' ' SER . . . . . . . . . . . . . 2.3 p -99.87 -5.36 28.54 Favored 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 117.307 -1.757 . . . . 99.579999999999998 112.618 179.476 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1547 ' ' TRP . . . . . 0.484 ' CD2' ' HD3' ' A' 1548 ' ' PRO . 44.7 p-90 -43.37 -39.05 4.19 Favored Pre-proline 0 C--O 1.238 0.5 0 N-CA-C 115.294 1.59 . . . . 132.03999999999999 115.294 -177.699 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A 1548 ' ' PRO . . . . . 0.484 ' HD3' ' CD2' ' A' 1547 ' ' TRP . 23.6 Cg_endo -59.66 -21.32 62.32 Favored 'Trans proline' 0 C--O 1.244 0.811 0 CA-C-N 121.503 1.572 . . . . 92.010000000000005 113.299 178.314 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A 1549 ' ' PHE . . . . . . . . . . . . . 83.9 m-85 -93.46 1.32 56.86 Favored 'General case' 0 C--O 1.238 0.498 0 N-CA-C 112.561 0.578 . . . . 103.47 112.561 179.504 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1550 ' ' HIS . . . . . . . . . . . . . 37.4 m170 -76.77 -31.75 57.25 Favored 'General case' 0 C--O 1.239 0.506 0 C-N-CA 119.486 -0.886 . . . . 93.810000000000002 111.642 -175.935 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1551 ' ' HIS . . . . . . . . . . . . . 5.3 m-70 -129.84 166.05 28.92 Favored Pre-proline 0 CA--C 1.508 -0.659 0 CA-C-O 121.298 0.57 . . . . 106.58 110.52 -173.056 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1552 ' ' PRO . . . . . . . . . . . . . 84.2 Cg_exo -54.91 144.06 69.12 Favored 'Trans proline' 0 N--CA 1.453 -0.858 0 N-CA-C 108.611 -1.342 . . . . 96.379999999999995 108.611 171.998 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1553 ' ' VAL . . . . . . . . . . . . . 26.7 t -57.78 130.88 21.37 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.544 0 N-CA-C 108.192 -1.04 . . . . 87.5 108.192 173.971 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1554 ' ' ASN . . . . . . . . . . . . . 64.1 t-20 -79.07 115.3 18.66 Favored 'General case' 0 C--O 1.242 0.673 0 CA-C-O 121.188 0.518 . . . . 102.04000000000001 110.783 175.278 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1555 ' ' LYS . . . . . . . . . . . . . . . -53.25 -34.57 57.73 Favored 'General case' 0 C--O 1.227 -0.098 0 CA-C-N 115.905 -0.589 . . . . 105.79000000000001 111.682 178.392 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1556 ' ' LYS . . . . . . . . . . . . . 60.1 tttt -55.26 -27.86 49.41 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 117.921 0.328 . . . . 108.7 111.67 -179.918 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1557 ' ' PHE . . . . . . . . . . . . . 33.3 m-85 -102.99 -22.58 13.79 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 113.199 0.814 . . . . 101.65000000000001 113.199 -175.683 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1558 ' ' VAL . . . . . . . . . . . . . 48.5 t -138.26 84.86 19.33 Favored Pre-proline 0 C--N 1.321 -0.661 0 N-CA-C 104.416 -2.438 . . . . 103.75 104.416 -173.079 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1559 ' ' PRO . . . . . . . . . . . . . 6.1 Cg_endo -70.5 -21.44 30.04 Favored 'Trans proline' 0 CA--C 1.515 -0.467 0 N-CA-C 114.322 0.855 . . . . 106.05 114.322 -165.857 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1560 ' ' ASP . . . . . . . . . . . . . 20.2 p-10 -92.55 -0.27 57.35 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 119.724 1.147 . . . . 123.06999999999999 113.933 179.206 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1561 ' ' TYR . . . . . 0.461 ' CZ ' HG13 ' A' 1565 ' ' ILE . 43.5 t80 -58.15 -53.79 54.34 Favored 'General case' 0 C--O 1.238 0.457 0 CA-C-N 119.649 1.113 . . . . 105.55 111.369 -164.2 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A 1562 ' ' TYR . . . . . . . . . . . . . 98.0 m-85 -73.83 1.63 10.16 Favored 'General case' 0 CA--C 1.513 -0.453 0 C-N-CA 122.792 0.437 . . . . 113.01000000000001 111.792 -175.199 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1563 ' ' LYS . . . . . . . . . . . . . 19.4 mttt -98.84 -23.01 15.54 Favored 'General case' 0 N--CA 1.448 -0.565 0 N-CA-C 112.993 0.738 . . . . 137.78999999999999 112.993 171.249 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1564 ' ' VAL . . . . . . . . . . . . . 2.3 p -107.88 -24.72 3.91 Favored 'Isoleucine or valine' 0 C--O 1.237 0.414 0 CA-C-N 119.138 0.881 . . . . 119.79000000000001 109.843 178.499 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1565 ' ' ILE . . . . . 0.461 HG13 ' CZ ' ' A' 1561 ' ' TYR . 18.8 mm -100.9 112.18 32.95 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 N-CA-C 108.131 -1.063 . . . . 111.06 108.131 173.744 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A 1566 ' ' VAL . . . . . . . . . . . . . 2.2 p -89.96 -27.61 5.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 C-N-CA 118.785 -1.166 . . . . 131.61000000000001 112.094 -170.805 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1567 ' ' ASN . . . . . . . . . . . . . 80.5 m-20 -121.05 91.96 48.23 Favored Pre-proline 0 C--O 1.242 0.661 0 N-CA-C 109.06 -0.718 . . . . 118.12 109.06 172.049 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1568 ' ' PRO . . . . . . . . . . . . . 10.6 Cg_exo -71.42 158.5 54.01 Favored 'Trans proline' 0 C--N 1.323 -0.785 0 CA-C-O 122.071 0.78 . . . . 98.709999999999994 110.352 179.89 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1569 ' ' MET . . . . . . . . . . . . . 36.8 tpp -161.29 149.95 15.99 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 114.619 -1.173 . . . . 96.079999999999998 108.43 178.386 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1570 ' ' ASP . . . . . 0.482 ' OD2' HG23 ' A' 1573 ' ' THR . 4.2 p-10 -162.63 170.79 17.92 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 114.708 -1.133 . . . . 101.45999999999999 108.188 -179.241 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A 1571 ' ' LEU . . . . . . . . . . . . . 99.2 mt -68.05 -36.89 80.62 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 114.234 -1.348 . . . . 100.70999999999999 111.787 -174.327 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1572 ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -64.75 -41.94 95.53 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 118.043 -1.463 . . . . 117.02 110.688 -177.56 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1573 ' ' THR . . . . . 0.482 HG23 ' OD2' ' A' 1570 ' ' ASP . 2.6 p -67.85 -38.47 83.18 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 118.396 -1.322 . . . . 102.65000000000001 110.114 179.174 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A 1574 ' ' ILE . . . . . . . . . . . . . 15.3 mt -54.64 -47.9 72.17 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.498 0 C-N-CA 119.331 -0.948 . . . . 87.489999999999995 110.126 171.822 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1575 ' ' ARG . . . . . . . . . . . . . 52.8 mtp180 -56.0 -43.45 77.7 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 119.395 -0.922 . . . . 98.950000000000003 111.643 175.077 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1576 ' ' LYS . . . . . . . . . . . . . 12.0 mttp -60.72 -36.82 79.8 Favored 'General case' 0 C--O 1.239 0.51 0 C-N-CA 119.494 -0.883 . . . . 127.98 111.166 177.91 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1577 ' ' ASN . . . . . . . . . . . . . 97.7 m-20 -67.7 -34.28 76.56 Favored 'General case' 0 C--O 1.239 0.532 0 C-N-CA 118.597 -1.241 . . . . 93.650000000000006 110.617 176.805 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1578 ' ' ILE . . . . . 0.456 HG23 ' HB3' ' A' 1529 ' ' SER . 86.7 mt -66.7 -38.61 81.92 Favored 'Isoleucine or valine' 0 C--O 1.242 0.684 0 C-N-CA 120.064 -0.655 . . . . 87.629999999999995 110.128 178.283 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A 1579 ' ' SER . . . . . . . . . . . . . 85.9 p -60.21 -34.36 73.53 Favored 'General case' 0 CA--C 1.518 -0.269 0 C-N-CA 120.901 -0.319 . . . . 111.61 110.659 177.047 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1580 ' ' LYS . . . . . . . . . . . . . 40.0 mttt -94.8 19.39 10.18 Favored 'General case' 0 C--O 1.24 0.593 0 N-CA-C 112.432 0.53 . . . . 125.84999999999999 112.432 177.457 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1581 ' ' HIS . . . . . . . . . . . . . 82.7 m-70 45.19 52.08 8.8 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-O 121.509 0.671 . . . . 107.84999999999999 111.566 176.49 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1582 ' ' LYS . . . . . . . . . . . . . 19.5 tttt -73.95 -40.5 63.0 Favored 'General case' 0 CA--C 1.512 -0.509 0 CA-C-N 115.746 -0.661 . . . . 105.13 110.509 178.627 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1583 ' ' TYR . . . . . . . . . . . . . 22.5 m-85 -93.5 124.85 37.77 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 108.622 -0.881 . . . . 101.89 108.622 -175.018 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1584 ' ' GLN . . . . . . . . . . . . . 36.2 mt-30 -108.74 -13.45 14.78 Favored 'General case' 0 CA--C 1.515 -0.388 0 C-N-CA 124.392 1.077 . . . . 137.81999999999999 112.394 176.438 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1585 ' ' SER . . . . . . . . . . . . . 27.1 p -136.72 164.14 28.96 Favored 'General case' 0 C--N 1.323 -0.547 0 C-N-CA 125.254 1.421 . . . . 111.23999999999999 107.817 175.009 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1586 ' ' ARG . . . . . 0.487 ' NH2' ' OD2' ' A' 1629 ' ' ASP . 7.6 mtm180 -47.87 -32.45 6.24 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 113.468 0.914 . . . . 106.84 113.468 169.823 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A 1587 ' ' GLU . . . . . . . . . . . . . 23.0 mp0 -82.62 -45.45 14.54 Favored 'General case' 0 C--N 1.322 -0.619 0 C-N-CA 118.579 -1.248 . . . . 151.28 112.225 -154.875 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1588 ' ' SER . . . . . . . . . . . . . 1.7 p -61.0 -27.49 68.35 Favored 'General case' 0 C--O 1.238 0.488 0 O-C-N 121.696 -0.627 . . . . 123.67 111.331 172.495 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1589 ' ' PHE . . . . . . . . . . . . . 61.3 t80 -69.15 -53.5 19.79 Favored 'General case' 0 C--O 1.241 0.64 0 CA-C-O 120.782 0.325 . . . . 94.239999999999995 110.392 175.832 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1590 ' ' LEU . . . . . . . . . . . . . 19.1 mt -57.85 -38.22 75.3 Favored 'General case' 0 C--O 1.242 0.667 0 N-CA-C 112.219 0.451 . . . . 92.859999999999999 112.219 178.5 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1591 ' ' ASP . . . . . . . . . . . . . 82.5 m-20 -42.38 -55.83 3.24 Favored 'General case' 0 C--O 1.238 0.498 0 C-N-CA 120.454 -0.498 . . . . 97.969999999999999 110.629 168.999 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1592 ' ' ASP . . . . . . . . . . . . . 81.2 m-20 -72.95 -33.76 66.09 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 119.409 -0.916 . . . . 93.549999999999997 111.496 -172.952 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1593 ' ' VAL . . . . . . . . . . . . . 2.9 m -69.35 -46.75 76.14 Favored 'Isoleucine or valine' 0 C--O 1.235 0.308 0 C-N-CA 116.111 -2.236 . . . . 91.400000000000006 109.519 177.126 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1594 ' ' ASN . . . . . . . . . . . . . 32.1 m-20 -55.02 -31.19 60.88 Favored 'General case' 0 C--O 1.244 0.789 0 O-C-N 121.818 -0.551 . . . . 97.459999999999994 111.509 179.58 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1595 ' ' LEU . . . . . . . . . . . . . 45.8 tp -61.57 -37.95 85.71 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 116.178 -0.465 . . . . 96.879999999999995 111.866 178.245 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1596 ' ' ILE . . . . . . . . . . . . . 70.0 mt -57.9 -40.44 76.32 Favored 'Isoleucine or valine' 0 C--O 1.241 0.643 0 O-C-N 122.087 -0.383 . . . . 90.170000000000002 111.02 178.378 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1597 ' ' LEU . . . . . 0.401 ' O ' HG13 ' A' 1601 ' ' VAL . 44.5 tp -72.49 -51.0 22.02 Favored 'General case' 0 CA--C 1.515 -0.396 0 N-CA-C 110.151 -0.314 . . . . 106.59999999999999 110.151 178.317 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A 1598 ' ' ALA . . . . . 0.526 ' O ' HG22 ' A' 1601 ' ' VAL . . . -47.17 -39.02 12.84 Favored 'General case' 0 C--O 1.238 0.492 0 CA-C-O 120.678 0.275 . . . . 108.93000000000001 111.359 173.643 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A 1599 ' ' ASN . . . . . . . . . . . . . 70.1 m-20 -73.11 -32.81 65.19 Favored 'General case' 0 CA--C 1.513 -0.454 0 C-N-CA 118.505 -1.278 . . . . 105.73 111.555 -178.859 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1600 ' ' SER . . . . . . . . . . . . . 40.7 t -70.5 -34.19 72.06 Favored 'General case' 0 C--N 1.324 -0.517 0 C-N-CA 118.476 -1.29 . . . . 98.280000000000001 111.059 -179.115 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1601 ' ' VAL . . . . . 0.526 HG22 ' O ' ' A' 1598 ' ' ALA . 3.8 m -66.28 -41.02 88.33 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.783 0 C-N-CA 118.945 -1.102 . . . . 120.53 110.107 -179.848 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A 1602 ' ' LYS . . . . . . . . . . . . . 20.5 mttp -67.21 -46.32 74.19 Favored 'General case' 0 C--N 1.339 0.137 0 C-N-CA 118.197 -1.401 . . . . 142.61000000000001 110.754 178.956 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1603 ' ' TYR . . . . . . . . . . . . . 30.5 t80 -78.48 -44.16 25.22 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 116.588 -2.045 . . . . 108.28 112.657 -175.428 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1604 ' ' ASN . . . . . . . . . . . . . 75.1 m-20 -98.07 -17.49 19.08 Favored 'General case' 0 CA--C 1.51 -0.58 0 O-C-N 121.376 -0.827 . . . . 116.34999999999999 112.659 -171.446 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1605 ' ' GLY . . . . . . . . . . . . . . . 98.07 159.28 30.33 Favored Glycine 0 N--CA 1.433 -1.51 0 CA-C-O 122.502 1.057 . . . . 113.20999999999999 111.667 -178.53 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1606 ' ' PRO . . . . . . . . . . . . . 4.6 Cg_exo -67.72 -31.55 32.2 Favored 'Trans proline' 0 C--N 1.329 -0.47 0 CA-C-O 118.592 -0.67 . . . . 119.3 113.822 -170.221 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1607 ' ' GLU . . . . . 0.47 ' OE2' ' HA ' ' A' 1607 ' ' GLU . 2.1 tp10 -120.83 42.0 3.14 Favored 'General case' 0 CA--C 1.528 0.128 0 C-N-CA 117.634 -1.626 . . . . 179.56999999999999 111.928 179.854 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A 1608 ' ' SER . . . . . . . . . . . . . 37.5 t -82.29 144.03 30.9 Favored 'General case' 0 N--CA 1.456 -0.172 0 CA-C-O 121.351 0.596 . . . . 131.61000000000001 110.848 167.711 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1609 ' ' GLN . . . . . . . . . . . . . 2.5 pt20 -59.27 -29.89 67.9 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 115.954 -0.567 . . . . 164.03 111.671 179.844 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1610 ' ' TYR . . . . . . . . . . . . . 51.2 m-85 -67.97 -42.21 81.21 Favored 'General case' 0 C--O 1.241 0.624 0 C-N-CA 120.864 -0.334 . . . . 159.61000000000001 111.356 173.884 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1611 ' ' THR . . . . . . . . . . . . . 65.6 m -59.53 -34.44 72.65 Favored 'General case' 0 C--O 1.242 0.695 0 C-N-CA 120.138 -0.625 . . . . 108.95999999999999 110.931 172.624 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1612 ' ' LYS . . . . . . . . . . . . . 11.5 mttt -70.89 -34.83 71.97 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 119.405 -0.918 . . . . 134.03 111.861 -177.672 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1613 ' ' THR . . . . . . . . . . . . . 1.5 p -74.78 -36.88 62.52 Favored 'General case' 0 C--O 1.238 0.463 0 C-N-CA 117.581 -1.648 . . . . 116.11 110.43 177.919 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1614 ' ' ALA . . . . . . . . . . . . . . . -55.95 -43.54 77.59 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 119.217 -0.993 . . . . 90.829999999999998 111.222 169.575 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1615 ' ' GLN . . . . . . . . . . . . . 41.9 tp60 -53.78 -46.28 70.94 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 118.654 -1.219 . . . . 105.51000000000001 110.818 176.358 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1616 ' ' GLU . . . . . . . . . . . . . 5.9 tt0 -68.96 -35.83 77.2 Favored 'General case' 0 C--O 1.246 0.88 0 C-N-CA 117.326 -1.749 . . . . 145.47999999999999 111.369 -176.35 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1617 ' ' ILE . . . . . . . . . . . . . 94.7 mt -52.96 -52.62 27.18 Favored 'Isoleucine or valine' 0 C--O 1.24 0.555 0 C-N-CA 119.399 -0.92 . . . . 91.25 110.461 169.477 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1618 ' ' VAL . . . . . . . . . . . . . 78.6 t -54.29 -37.64 37.22 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.179 0 C-N-CA 118.712 -1.195 . . . . 89.769999999999996 110.597 174.969 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1619 ' ' ASN . . . . . . . . . . . . . 87.7 m-20 -69.97 -52.38 24.8 Favored 'General case' 0 C--O 1.242 0.661 0 C-N-CA 118.138 -1.425 . . . . 103.90000000000001 110.324 -172.803 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1620 ' ' VAL . . . . . . . . . . . . . 6.7 p -61.78 -27.36 42.08 Favored 'Isoleucine or valine' 0 C--O 1.241 0.618 0 C-N-CA 120.106 -0.638 . . . . 100.17 109.837 -177.044 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1621 ' ' CYS . . . . . . . . . . . . . 42.4 t -61.83 -53.96 48.79 Favored 'General case' 0 N--CA 1.449 -0.488 0 C-N-CA 118.361 -1.335 . . . . 96.859999999999999 110.328 174.373 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1622 ' ' TYR . . . . . . . . . . . . . 44.3 m-85 -60.5 -39.65 88.5 Favored 'General case' 0 C--O 1.238 0.475 0 O-C-N 121.284 -0.885 . . . . 98.400000000000006 111.092 -179.956 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1623 ' ' GLN . . . . . . . . . . . . . 81.8 mt-30 -57.17 -48.35 78.95 Favored 'General case' 0 C--O 1.241 0.625 0 CA-C-O 121.105 0.479 . . . . 140.84999999999999 110.404 -179.933 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1624 ' ' THR . . . . . . . . . . . . . 24.4 m -62.72 -44.57 95.87 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 119.669 -0.812 . . . . 108.58 111.288 178.515 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1625 ' ' LEU . . . . . 0.467 HD22 ' HG2' ' A' 1586 ' ' ARG . 22.4 mt -61.48 -37.16 82.63 Favored 'General case' 0 C--O 1.238 0.462 0 C-N-CA 118.187 -1.405 . . . . 92.939999999999998 111.959 -175.723 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A 1626 ' ' THR . . . . . . . . . . . . . 40.1 p -72.9 -32.97 65.71 Favored 'General case' 0 C--O 1.238 0.468 0 C-N-CA 116.987 -1.885 . . . . 110.62 111.059 179.845 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1627 ' ' GLU . . . . . . . . . . . . . 18.0 mt-10 -54.2 -40.99 68.11 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-O 120.925 0.393 . . . . 151.31999999999999 111.434 173.309 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1628 ' ' TYR . . . . . . . . . . . . . 10.7 m-30 -101.86 20.47 16.34 Favored 'General case' 0 N--CA 1.447 -0.593 0 C-N-CA 123.092 0.557 . . . . 123.08 112.283 179.775 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1629 ' ' ASP . . . . . 0.487 ' OD2' ' NH2' ' A' 1586 ' ' ARG . 20.2 t70 -56.01 -56.79 16.53 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 120.022 -0.671 . . . . 107.20999999999999 111.216 -171.23 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A 1630 ' ' GLU . . . . . . . . . . . . . 7.3 mt-10 -59.93 -41.68 92.33 Favored 'General case' 0 C--O 1.238 0.468 0 C-N-CA 119.981 -0.688 . . . . 147.53999999999999 111.044 -176.086 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1631 ' ' HIS . . . . . . . . . . . . . 50.5 t-80 -60.37 -49.71 76.51 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-O 120.882 0.373 . . . . 110.15000000000001 111.875 175.96 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1632 ' ' LEU . . . . . 0.455 ' O ' ' HG3' ' A' 1636 ' ' GLU . 70.3 mt -66.11 -35.9 81.72 Favored 'General case' 0 C--N 1.333 -0.141 0 C-N-CA 119.176 -1.009 . . . . 86.950000000000003 112.222 -179.907 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A 1633 ' ' THR . . . . . . . . . . . . . 9.0 m -57.22 -41.43 79.46 Favored 'General case' 0 C--O 1.242 0.66 0 C-N-CA 118.972 -1.091 . . . . 92.159999999999997 110.711 179.05 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1634 ' ' GLN . . . . . . . . . . . . . 63.1 tp60 -59.35 -60.11 4.38 Favored 'General case' 0 C--O 1.24 0.601 0 CA-C-O 121.029 0.442 . . . . 114.95999999999999 110.652 178.73 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1635 ' ' LEU . . . . . . . . . . . . . 41.2 mt -44.27 -47.1 9.39 Favored 'General case' 0 C--O 1.238 0.479 0 N-CA-C 113.29 0.848 . . . . 91.069999999999993 113.29 172.442 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1636 ' ' GLU . . . . . 0.455 ' HG3' ' O ' ' A' 1632 ' ' LEU . 70.2 mt-10 -61.88 -42.37 98.98 Favored 'General case' 0 C--O 1.24 0.59 0 O-C-N 122.174 -0.328 . . . . 107.43000000000001 111.399 -177.564 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A 1637 ' ' LYS . . . . . . . . . . . . . 20.2 tttt -62.56 -52.79 62.02 Favored 'General case' 0 C--O 1.24 0.564 0 CA-C-O 120.748 0.308 . . . . 116.86 111.121 178.887 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1638 ' ' ASP . . . . . . . . . . . . . 89.7 m-20 -59.68 -33.33 71.44 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 120.085 -0.646 . . . . 111.09 110.576 -175.297 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1639 ' ' ILE . . . . . . . . . . . . . 89.2 mt -69.12 -41.5 81.48 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 C-N-CA 118.793 -1.163 . . . . 101.87 111.225 179.509 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1640 ' ' CYS . . . . . 1.462 ' CB ' ' SG ' ' A' 1640 ' ' CYS . 0.0 OUTLIER -69.34 -37.67 77.78 Favored 'General case' 0 C--O 1.24 0.576 0 O-C-N 121.584 -0.698 . . . . 124.31 111.302 -179.031 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A 1641 ' ' THR . . . . . . . . . . . . . 38.8 p -66.51 -44.87 81.37 Favored 'General case' 0 C--O 1.238 0.485 0 C-N-CA 118.953 -1.099 . . . . 117.56 110.813 178.641 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1642 ' ' ALA . . . . . . . . . . . . . . . -54.26 -56.08 21.87 Favored 'General case' 0 C--O 1.237 0.439 0 CA-C-O 121.128 0.489 . . . . 120.29000000000001 111.213 174.099 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1643 ' ' LYS . . . . . . . . . . . . . 10.3 tttt -51.03 -61.21 2.37 Favored 'General case' 0 C--O 1.238 0.466 0 CA-C-O 120.85 0.357 . . . . 150.62 111.059 176.319 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1644 ' ' GLU . . . . . . . . . . . . . . . -61.47 -26.56 67.98 Favored 'General case' 0 C--O 1.234 0.238 0 C-N-CA 120.498 -0.481 . . . . 158.97 112.296 -174.823 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1645 ' ' ALA . . . . . . . . . . . . . . . -94.93 -12.09 27.44 Favored 'General case' 0 C--O 1.236 0.39 0 N-CA-C 113.249 0.833 . . . . 151.56999999999999 113.249 176.436 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1646 ' ' ALA . . . . . . . . . . . . . . . -63.97 -18.05 63.89 Favored 'General case' 0 C--O 1.235 0.333 0 C-N-CA 120.147 -0.621 . . . . 171.21000000000001 111.59 172.549 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1647 ' ' LEU . . . . . . . . . . . . . 4.7 mp -92.45 50.05 1.57 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.573 0.701 . . . . 165.66999999999999 111.174 -175.436 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1648 ' ' GLU . . . . . 0.712 ' OE1' ' C ' ' A' 1648 ' ' GLU . 0.7 OUTLIER . . . . . 0 CA--C 1.54 0.578 0 CA-C-O 121.679 0.752 . . . . 198.94999999999999 112.998 -177.93 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A 4000 ' ' NQV . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1521 ' ' MET . . . . . . . . . . . . . . . . . . . . 0 C--O 1.239 0.511 0 N-CA-C 109.789 -0.448 . . . . 174.24 109.789 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1522 ' ' ASP . . . . . . . . . . . . . 41.9 t0 -61.1 -13.15 15.19 Favored 'General case' 0 C--O 1.243 0.728 0 CA-C-N 115.788 -0.642 . . . . 167.15 112.69 177.626 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1523 ' ' ASP . . . . . 0.404 ' HA ' ' CG1' ' A' 1526 ' ' VAL . 1.2 m-20 -57.5 -24.78 57.91 Favored 'General case' 0 C--O 1.238 0.486 0 C-N-CA 123.145 0.578 . . . . 181.09 112.445 -170.756 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A 1524 ' ' ASP . . . . . . . . . . . . . 64.5 m-20 -61.42 -53.06 61.43 Favored 'General case' 0 C--O 1.239 0.505 0 C-N-CA 119.395 -0.922 . . . . 124.24 110.924 -172.088 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1525 ' ' GLN . . . . . . . . . . . . . 52.2 tp60 -61.53 -40.65 95.44 Favored 'General case' 0 C--O 1.239 0.511 0 C-N-CA 120.086 -0.646 . . . . 105.81 112.051 179.025 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1526 ' ' VAL . . . . . 0.404 ' CG1' ' HA ' ' A' 1523 ' ' ASP . 2.1 p -68.29 -36.29 74.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 C-N-CA 117.869 -1.532 . . . . 110.75 110.449 -177.337 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A 1527 ' ' ALA . . . . . . . . . . . . . . . -66.67 -42.52 86.44 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 118.564 -1.254 . . . . 93.44 110.734 178.091 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1528 ' ' PHE . . . . . . . . . . . . . 60.6 t80 -57.9 -51.69 68.58 Favored 'General case' 0 C--O 1.243 0.752 0 C-N-CA 120.535 -0.466 . . . . 94.69 111.505 178.281 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1529 ' ' SER . . . . . 0.456 ' HB3' HG23 ' A' 1578 ' ' ILE . 1.5 m -64.02 -30.36 71.44 Favored 'General case' 0 CA--C 1.511 -0.546 0 C-N-CA 118.579 -1.249 . . . . 93.68 110.799 178.375 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A 1530 ' ' PHE . . . . . . . . . . . . . 23.0 t80 -61.75 -47.41 85.34 Favored 'General case' 0 C--O 1.242 0.683 0 C-N-CA 118.1 -1.44 . . . . 96.84 110.875 177.134 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1531 ' ' ILE . . . . . 0.43 ' O ' HG13 ' A' 1535 ' ' ILE . 10.7 mt -64.76 -37.44 80.16 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.697 0 C-N-CA 120.171 -0.611 . . . . 93.99 110.321 -177.956 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A 1532 ' ' LEU . . . . . 0.41 HD23 ' HA ' ' A' 1532 ' ' LEU . 11.7 mt -60.92 -51.77 67.86 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 120.649 -0.42 . . . . 84.28 110.807 176.581 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A 1533 ' ' ASP . . . . . . . . . . . . . 8.3 t70 -53.62 -38.38 63.98 Favored 'General case' 0 C--O 1.238 0.492 0 C-N-CA 118.873 -1.131 . . . . 92.98 111.464 -178.735 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1534 ' ' ASN . . . . . . . . . . . . . 32.6 m120 -76.9 -35.61 57.25 Favored 'General case' 0 CA--C 1.509 -0.612 0 C-N-CA 117.944 -1.502 . . . . 110.59 111.039 -172.813 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1535 ' ' ILE . . . . . 0.43 HG13 ' O ' ' A' 1531 ' ' ILE . 45.9 mt -55.3 -49.8 69.85 Favored 'Isoleucine or valine' 0 C--O 1.237 0.446 0 C-N-CA 119.997 -0.681 . . . . 94.02 109.942 171.533 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A 1536 ' ' VAL . . . . . . . . . . . . . 59.3 t -55.21 -56.75 9.75 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.252 0 C-N-CA 118.896 -1.122 . . . . 98.17 110.293 174.844 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1537 ' ' THR . . . . . . . . . . . . . 56.4 p -71.34 -43.36 67.13 Favored 'General case' 0 CA--C 1.513 -0.458 0 C-N-CA 118.291 -1.364 . . . . 92.03 111.894 -167.559 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1538 ' ' GLN . . . . . . . . . . . . . 6.1 pt20 -103.74 -14.72 15.98 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 117.583 -1.647 . . . . 157.47 113.201 -168.645 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1539 ' ' LYS . . . . . . . . . . . . . 2.5 mmpt? -110.89 -47.67 3.2 Favored 'General case' 0 C--O 1.24 0.568 0 C-N-CA 117.686 -1.606 . . . . 123.1 113.069 168.956 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1540 ' ' MET . . . . . . . . . . . . . 22.2 mtp -70.62 -49.71 44.68 Favored 'General case' 0 C--O 1.242 0.676 0 O-C-N 120.751 -1.218 . . . . 96.11 112.646 -176.029 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1541 ' ' MET . . . . . . . . . . . . . 80.8 mtp -69.17 -6.87 31.46 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 117.227 -1.789 . . . . 96.89 112.764 -179.339 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1542 ' ' ALA . . . . . . . . . . . . . . . -83.78 -5.43 59.2 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 113.629 0.974 . . . . 118.07 113.629 177.673 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1543 ' ' VAL . . . . . . . . . . . . . 76.2 t -59.9 134.78 89.94 Favored Pre-proline 0 C--O 1.245 0.859 0 C-N-CA 119.208 -0.997 . . . . 106.16 108.516 176.67 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1544 ' ' PRO . . . . . . . . . . . . . 33.7 Cg_exo -54.1 138.52 71.11 Favored 'Trans proline' 0 CA--C 1.515 -0.447 0 CA-C-N 119.81 0.968 . . . . 117.6 110.105 177.016 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1545 ' ' ASP . . . . . . . . . . . . . 40.2 m-20 58.24 37.68 26.13 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 115.779 -0.646 . . . . 119.15 111.735 172.257 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1546 ' ' SER . . . . . . . . . . . . . 2.3 p -99.87 -5.36 28.54 Favored 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 117.307 -1.757 . . . . 99.58 112.618 179.476 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1547 ' ' TRP . . . . . 0.484 ' CD2' ' HD3' ' A' 1548 ' ' PRO . 44.7 p-90 -43.37 -39.05 4.19 Favored Pre-proline 0 C--O 1.238 0.5 0 N-CA-C 115.294 1.59 . . . . 132.04 115.294 -177.699 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A 1548 ' ' PRO . . . . . 0.484 ' HD3' ' CD2' ' A' 1547 ' ' TRP . 23.6 Cg_endo -59.66 -21.32 62.32 Favored 'Trans proline' 0 C--O 1.244 0.811 0 CA-C-N 121.503 1.572 . . . . 92.01 113.299 178.314 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A 1549 ' ' PHE . . . . . . . . . . . . . 83.9 m-85 -93.46 1.32 56.86 Favored 'General case' 0 C--O 1.238 0.498 0 N-CA-C 112.561 0.578 . . . . 103.47 112.561 179.504 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1550 ' ' HIS . . . . . . . . . . . . . 37.4 m170 -76.77 -31.75 57.25 Favored 'General case' 0 C--O 1.239 0.506 0 C-N-CA 119.486 -0.886 . . . . 93.81 111.642 -175.935 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1551 ' ' HIS . . . . . . . . . . . . . 5.3 m-70 -129.84 166.05 28.92 Favored Pre-proline 0 CA--C 1.508 -0.659 0 CA-C-O 121.298 0.57 . . . . 106.58 110.52 -173.056 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1552 ' ' PRO . . . . . . . . . . . . . 84.2 Cg_exo -54.91 144.06 69.12 Favored 'Trans proline' 0 N--CA 1.453 -0.858 0 N-CA-C 108.611 -1.342 . . . . 96.38 108.611 171.998 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1553 ' ' VAL . . . . . . . . . . . . . 26.7 t -57.78 130.88 21.37 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.544 0 N-CA-C 108.192 -1.04 . . . . 87.5 108.192 173.971 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1554 ' ' ASN . . . . . . . . . . . . . 64.1 t-20 -79.07 115.3 18.66 Favored 'General case' 0 C--O 1.242 0.673 0 CA-C-O 121.188 0.518 . . . . 102.04 110.783 175.278 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1555 ' ' LYS . . . . . . . . . . . . . . . -53.25 -34.57 57.73 Favored 'General case' 0 C--O 1.227 -0.098 0 CA-C-N 115.905 -0.589 . . . . 105.79 111.682 178.392 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1556 ' ' LYS . . . . . . . . . . . . . 60.1 tttt -55.26 -27.86 49.41 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 117.921 0.328 . . . . 108.7 111.67 -179.918 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1557 ' ' PHE . . . . . . . . . . . . . 33.3 m-85 -102.99 -22.58 13.79 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 113.199 0.814 . . . . 101.65 113.199 -175.683 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1558 ' ' VAL . . . . . . . . . . . . . 48.5 t -138.26 84.86 19.33 Favored Pre-proline 0 C--N 1.321 -0.661 0 N-CA-C 104.416 -2.438 . . . . 103.75 104.416 -173.079 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1559 ' ' PRO . . . . . . . . . . . . . 6.1 Cg_endo -70.5 -21.44 30.04 Favored 'Trans proline' 0 CA--C 1.515 -0.467 0 N-CA-C 114.322 0.855 . . . . 106.05 114.322 -165.857 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1560 ' ' ASP . . . . . . . . . . . . . 20.2 p-10 -92.55 -0.27 57.35 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 119.724 1.147 . . . . 123.07 113.933 179.206 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1561 ' ' TYR . . . . . 0.461 ' CZ ' HG13 ' A' 1565 ' ' ILE . 43.5 t80 -58.15 -53.79 54.34 Favored 'General case' 0 C--O 1.238 0.457 0 CA-C-N 119.649 1.113 . . . . 105.55 111.369 -164.2 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A 1562 ' ' TYR . . . . . . . . . . . . . 98.0 m-85 -73.83 1.63 10.16 Favored 'General case' 0 CA--C 1.513 -0.453 0 C-N-CA 122.792 0.437 . . . . 113.01 111.792 -175.199 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1563 ' ' LYS . . . . . . . . . . . . . 19.4 mttt -98.84 -23.01 15.54 Favored 'General case' 0 N--CA 1.448 -0.565 0 N-CA-C 112.993 0.738 . . . . 137.79 112.993 171.249 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1564 ' ' VAL . . . . . . . . . . . . . 2.3 p -107.88 -24.72 3.91 Favored 'Isoleucine or valine' 0 C--O 1.237 0.414 0 CA-C-N 119.138 0.881 . . . . 119.79 109.843 178.499 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1565 ' ' ILE . . . . . 0.461 HG13 ' CZ ' ' A' 1561 ' ' TYR . 18.8 mm -100.9 112.18 32.95 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 N-CA-C 108.131 -1.063 . . . . 111.06 108.131 173.744 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A 1566 ' ' VAL . . . . . . . . . . . . . 2.2 p -89.96 -27.61 5.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 C-N-CA 118.785 -1.166 . . . . 131.61 112.094 -170.805 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1567 ' ' ASN . . . . . . . . . . . . . 80.5 m-20 -121.05 91.96 48.23 Favored Pre-proline 0 C--O 1.242 0.661 0 N-CA-C 109.06 -0.718 . . . . 118.12 109.06 172.049 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1568 ' ' PRO . . . . . . . . . . . . . 10.6 Cg_exo -71.42 158.5 54.01 Favored 'Trans proline' 0 C--N 1.323 -0.785 0 CA-C-O 122.071 0.78 . . . . 98.71 110.352 179.89 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1569 ' ' MET . . . . . . . . . . . . . 36.8 tpp -161.29 149.95 15.99 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 114.619 -1.173 . . . . 96.08 108.43 178.386 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1570 ' ' ASP . . . . . 0.482 ' OD2' HG23 ' A' 1573 ' ' THR . 4.2 p-10 -162.63 170.79 17.92 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 114.708 -1.133 . . . . 101.46 108.188 -179.241 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A 1571 ' ' LEU . . . . . . . . . . . . . 99.2 mt -68.05 -36.89 80.62 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 114.234 -1.348 . . . . 100.71 111.787 -174.327 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1572 ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -64.75 -41.94 95.53 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 118.043 -1.463 . . . . 117.02 110.688 -177.56 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1573 ' ' THR . . . . . 0.482 HG23 ' OD2' ' A' 1570 ' ' ASP . 2.6 p -67.85 -38.47 83.18 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 118.396 -1.322 . . . . 102.65 110.114 179.174 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A 1574 ' ' ILE . . . . . . . . . . . . . 15.3 mt -54.64 -47.9 72.17 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.498 0 C-N-CA 119.331 -0.948 . . . . 87.49 110.126 171.822 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1575 ' ' ARG . . . . . . . . . . . . . 52.8 mtp180 -56.0 -43.45 77.7 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 119.395 -0.922 . . . . 98.95 111.643 175.077 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1576 ' ' LYS . . . . . . . . . . . . . 12.0 mttp -60.72 -36.82 79.8 Favored 'General case' 0 C--O 1.239 0.51 0 C-N-CA 119.494 -0.883 . . . . 127.98 111.166 177.91 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1577 ' ' ASN . . . . . . . . . . . . . 97.7 m-20 -67.7 -34.28 76.56 Favored 'General case' 0 C--O 1.239 0.532 0 C-N-CA 118.597 -1.241 . . . . 93.65 110.617 176.805 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1578 ' ' ILE . . . . . 0.456 HG23 ' HB3' ' A' 1529 ' ' SER . 86.7 mt -66.7 -38.61 81.92 Favored 'Isoleucine or valine' 0 C--O 1.242 0.684 0 C-N-CA 120.064 -0.655 . . . . 87.63 110.128 178.283 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A 1579 ' ' SER . . . . . . . . . . . . . 85.9 p -60.21 -34.36 73.53 Favored 'General case' 0 CA--C 1.518 -0.269 0 C-N-CA 120.901 -0.319 . . . . 111.61 110.659 177.047 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1580 ' ' LYS . . . . . . . . . . . . . 40.0 mttt -94.8 19.39 10.18 Favored 'General case' 0 C--O 1.24 0.593 0 N-CA-C 112.432 0.53 . . . . 125.85 112.432 177.457 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1581 ' ' HIS . . . . . . . . . . . . . 82.7 m-70 45.19 52.08 8.8 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-O 121.509 0.671 . . . . 107.85 111.566 176.49 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1582 ' ' LYS . . . . . . . . . . . . . 19.5 tttt -73.95 -40.5 63.0 Favored 'General case' 0 CA--C 1.512 -0.509 0 CA-C-N 115.746 -0.661 . . . . 105.13 110.509 178.627 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1583 ' ' TYR . . . . . . . . . . . . . 22.5 m-85 -93.5 124.85 37.77 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 108.622 -0.881 . . . . 101.89 108.622 -175.018 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1584 ' ' GLN . . . . . . . . . . . . . 36.2 mt-30 -108.74 -13.45 14.78 Favored 'General case' 0 CA--C 1.515 -0.388 0 C-N-CA 124.392 1.077 . . . . 137.82 112.394 176.438 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1585 ' ' SER . . . . . . . . . . . . . 27.1 p -136.72 164.14 28.96 Favored 'General case' 0 C--N 1.323 -0.547 0 C-N-CA 125.254 1.421 . . . . 111.24 107.817 175.009 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1586 ' ' ARG . . . . . 0.487 ' NH2' ' OD2' ' A' 1629 ' ' ASP . 7.6 mtm180 -47.87 -32.45 6.24 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 113.468 0.914 . . . . 106.84 113.468 169.823 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A 1587 ' ' GLU . . . . . . . . . . . . . 23.0 mp0 -82.62 -45.45 14.54 Favored 'General case' 0 C--N 1.322 -0.619 0 C-N-CA 118.579 -1.248 . . . . 151.28 112.225 -154.875 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1588 ' ' SER . . . . . . . . . . . . . 1.7 p -61.0 -27.49 68.35 Favored 'General case' 0 C--O 1.238 0.488 0 O-C-N 121.696 -0.627 . . . . 123.67 111.331 172.495 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1589 ' ' PHE . . . . . . . . . . . . . 61.3 t80 -69.15 -53.5 19.79 Favored 'General case' 0 C--O 1.241 0.64 0 CA-C-O 120.782 0.325 . . . . 94.24 110.392 175.832 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1590 ' ' LEU . . . . . . . . . . . . . 19.1 mt -57.85 -38.22 75.3 Favored 'General case' 0 C--O 1.242 0.667 0 N-CA-C 112.219 0.451 . . . . 92.86 112.219 178.5 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1591 ' ' ASP . . . . . . . . . . . . . 82.5 m-20 -42.38 -55.83 3.24 Favored 'General case' 0 C--O 1.238 0.498 0 C-N-CA 120.454 -0.498 . . . . 97.97 110.629 168.999 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1592 ' ' ASP . . . . . . . . . . . . . 81.2 m-20 -72.95 -33.76 66.09 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 119.409 -0.916 . . . . 93.55 111.496 -172.952 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1593 ' ' VAL . . . . . . . . . . . . . 2.9 m -69.35 -46.75 76.14 Favored 'Isoleucine or valine' 0 C--O 1.235 0.308 0 C-N-CA 116.111 -2.236 . . . . 91.4 109.519 177.126 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1594 ' ' ASN . . . . . . . . . . . . . 32.1 m-20 -55.02 -31.19 60.88 Favored 'General case' 0 C--O 1.244 0.789 0 O-C-N 121.818 -0.551 . . . . 97.46 111.509 179.58 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1595 ' ' LEU . . . . . . . . . . . . . 45.8 tp -61.57 -37.95 85.71 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 116.178 -0.465 . . . . 96.88 111.866 178.245 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1596 ' ' ILE . . . . . . . . . . . . . 70.0 mt -57.9 -40.44 76.32 Favored 'Isoleucine or valine' 0 C--O 1.241 0.643 0 O-C-N 122.087 -0.383 . . . . 90.17 111.02 178.378 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1597 ' ' LEU . . . . . 0.401 ' O ' HG13 ' A' 1601 ' ' VAL . 44.5 tp -72.49 -51.0 22.02 Favored 'General case' 0 CA--C 1.515 -0.396 0 N-CA-C 110.151 -0.314 . . . . 106.6 110.151 178.317 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A 1598 ' ' ALA . . . . . 0.526 ' O ' HG22 ' A' 1601 ' ' VAL . . . -47.17 -39.02 12.84 Favored 'General case' 0 C--O 1.238 0.492 0 CA-C-O 120.678 0.275 . . . . 108.93 111.359 173.643 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A 1599 ' ' ASN . . . . . . . . . . . . . 70.1 m-20 -73.11 -32.81 65.19 Favored 'General case' 0 CA--C 1.513 -0.454 0 C-N-CA 118.505 -1.278 . . . . 105.73 111.555 -178.859 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1600 ' ' SER . . . . . . . . . . . . . 40.7 t -70.5 -34.19 72.06 Favored 'General case' 0 C--N 1.324 -0.517 0 C-N-CA 118.476 -1.29 . . . . 98.28 111.059 -179.115 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1601 ' ' VAL . . . . . 0.526 HG22 ' O ' ' A' 1598 ' ' ALA . 3.8 m -66.28 -41.02 88.33 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.783 0 C-N-CA 118.945 -1.102 . . . . 120.53 110.107 -179.848 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A 1602 ' ' LYS . . . . . . . . . . . . . 20.5 mttp -67.21 -46.32 74.19 Favored 'General case' 0 C--N 1.339 0.137 0 C-N-CA 118.197 -1.401 . . . . 142.61 110.754 178.956 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1603 ' ' TYR . . . . . . . . . . . . . 30.5 t80 -78.48 -44.16 25.22 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 116.588 -2.045 . . . . 108.28 112.657 -175.428 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1604 ' ' ASN . . . . . . . . . . . . . 75.1 m-20 -98.07 -17.49 19.08 Favored 'General case' 0 CA--C 1.51 -0.58 0 O-C-N 121.376 -0.827 . . . . 116.35 112.659 -171.446 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1605 ' ' GLY . . . . . . . . . . . . . . . 98.07 159.28 30.33 Favored Glycine 0 N--CA 1.433 -1.51 0 CA-C-O 122.502 1.057 . . . . 113.21 111.667 -178.53 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1606 ' ' PRO . . . . . . . . . . . . . 4.6 Cg_exo -67.72 -31.55 32.2 Favored 'Trans proline' 0 C--N 1.329 -0.47 0 CA-C-O 118.592 -0.67 . . . . 119.3 113.822 -170.221 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1607 ' ' GLU . . . . . 0.47 ' HA ' ' OE2' ' A' 1607 ' ' GLU . 2.1 tp10 -120.83 42.0 3.14 Favored 'General case' 0 CA--C 1.528 0.128 0 C-N-CA 117.634 -1.626 . . . . 179.57 111.928 179.854 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A 1608 ' ' SER . . . . . . . . . . . . . 37.5 t -82.29 144.03 30.9 Favored 'General case' 0 N--CA 1.456 -0.172 0 CA-C-O 121.351 0.596 . . . . 131.61 110.848 167.711 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1609 ' ' GLN . . . . . . . . . . . . . 2.5 pt20 -59.27 -29.89 67.9 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 115.954 -0.567 . . . . 164.03 111.671 179.844 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1610 ' ' TYR . . . . . . . . . . . . . 51.2 m-85 -67.97 -42.21 81.21 Favored 'General case' 0 C--O 1.241 0.624 0 C-N-CA 120.864 -0.334 . . . . 159.61 111.356 173.884 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1611 ' ' THR . . . . . . . . . . . . . 65.6 m -59.53 -34.44 72.65 Favored 'General case' 0 C--O 1.242 0.695 0 C-N-CA 120.138 -0.625 . . . . 108.96 110.931 172.624 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1612 ' ' LYS . . . . . . . . . . . . . 11.5 mttt -70.89 -34.83 71.97 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 119.405 -0.918 . . . . 134.03 111.861 -177.672 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1613 ' ' THR . . . . . . . . . . . . . 1.5 p -74.78 -36.88 62.52 Favored 'General case' 0 C--O 1.238 0.463 0 C-N-CA 117.581 -1.648 . . . . 116.11 110.43 177.919 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1614 ' ' ALA . . . . . . . . . . . . . . . -55.95 -43.54 77.59 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 119.217 -0.993 . . . . 90.83 111.222 169.575 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1615 ' ' GLN . . . . . . . . . . . . . 41.9 tp60 -53.78 -46.28 70.94 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 118.654 -1.219 . . . . 105.51 110.818 176.358 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1616 ' ' GLU . . . . . . . . . . . . . 5.9 tt0 -68.96 -35.83 77.2 Favored 'General case' 0 C--O 1.246 0.88 0 C-N-CA 117.326 -1.749 . . . . 145.48 111.369 -176.35 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1617 ' ' ILE . . . . . . . . . . . . . 94.7 mt -52.96 -52.62 27.18 Favored 'Isoleucine or valine' 0 C--O 1.24 0.555 0 C-N-CA 119.399 -0.92 . . . . 91.25 110.461 169.477 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1618 ' ' VAL . . . . . . . . . . . . . 78.6 t -54.29 -37.64 37.22 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.179 0 C-N-CA 118.712 -1.195 . . . . 89.77 110.597 174.969 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1619 ' ' ASN . . . . . . . . . . . . . 87.7 m-20 -69.97 -52.38 24.8 Favored 'General case' 0 C--O 1.242 0.661 0 C-N-CA 118.138 -1.425 . . . . 103.9 110.324 -172.803 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1620 ' ' VAL . . . . . . . . . . . . . 6.7 p -61.78 -27.36 42.08 Favored 'Isoleucine or valine' 0 C--O 1.241 0.618 0 C-N-CA 120.106 -0.638 . . . . 100.17 109.837 -177.044 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1621 ' ' CYS . . . . . . . . . . . . . 42.4 t -61.83 -53.96 48.79 Favored 'General case' 0 N--CA 1.449 -0.488 0 C-N-CA 118.361 -1.335 . . . . 96.86 110.328 174.373 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1622 ' ' TYR . . . . . . . . . . . . . 44.3 m-85 -60.5 -39.65 88.5 Favored 'General case' 0 C--O 1.238 0.475 0 O-C-N 121.284 -0.885 . . . . 98.4 111.092 -179.956 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1623 ' ' GLN . . . . . . . . . . . . . 81.8 mt-30 -57.17 -48.35 78.95 Favored 'General case' 0 C--O 1.241 0.625 0 CA-C-O 121.105 0.479 . . . . 140.85 110.404 -179.933 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1624 ' ' THR . . . . . . . . . . . . . 24.4 m -62.72 -44.57 95.87 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 119.669 -0.812 . . . . 108.58 111.288 178.515 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1625 ' ' LEU . . . . . 0.467 HD22 ' HG2' ' A' 1586 ' ' ARG . 22.4 mt -61.48 -37.16 82.63 Favored 'General case' 0 C--O 1.238 0.462 0 C-N-CA 118.187 -1.405 . . . . 92.94 111.959 -175.723 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A 1626 ' ' THR . . . . . . . . . . . . . 40.1 p -72.9 -32.97 65.71 Favored 'General case' 0 C--O 1.238 0.468 0 C-N-CA 116.987 -1.885 . . . . 110.62 111.059 179.845 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1627 ' ' GLU . . . . . . . . . . . . . 18.0 mt-10 -54.2 -40.99 68.11 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-O 120.925 0.393 . . . . 151.32 111.434 173.309 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1628 ' ' TYR . . . . . . . . . . . . . 10.7 m-30 -101.86 20.47 16.34 Favored 'General case' 0 N--CA 1.447 -0.593 0 C-N-CA 123.092 0.557 . . . . 123.08 112.283 179.775 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1629 ' ' ASP . . . . . 0.487 ' OD2' ' NH2' ' A' 1586 ' ' ARG . 20.2 t70 -56.01 -56.79 16.53 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 120.022 -0.671 . . . . 107.21 111.216 -171.23 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A 1630 ' ' GLU . . . . . . . . . . . . . 7.3 mt-10 -59.93 -41.68 92.33 Favored 'General case' 0 C--O 1.238 0.468 0 C-N-CA 119.981 -0.688 . . . . 147.54 111.044 -176.086 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1631 ' ' HIS . . . . . . . . . . . . . 50.5 t-80 -60.37 -49.71 76.51 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-O 120.882 0.373 . . . . 110.15 111.875 175.96 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1632 ' ' LEU . . . . . 0.455 ' O ' ' HG3' ' A' 1636 ' ' GLU . 70.3 mt -66.11 -35.9 81.72 Favored 'General case' 0 C--N 1.333 -0.141 0 C-N-CA 119.176 -1.009 . . . . 86.95 112.222 -179.907 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A 1633 ' ' THR . . . . . . . . . . . . . 9.0 m -57.22 -41.43 79.46 Favored 'General case' 0 C--O 1.242 0.66 0 C-N-CA 118.972 -1.091 . . . . 92.16 110.711 179.05 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1634 ' ' GLN . . . . . . . . . . . . . 63.1 tp60 -59.35 -60.11 4.38 Favored 'General case' 0 C--O 1.24 0.601 0 CA-C-O 121.029 0.442 . . . . 114.96 110.652 178.73 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1635 ' ' LEU . . . . . . . . . . . . . 41.2 mt -44.27 -47.1 9.39 Favored 'General case' 0 C--O 1.238 0.479 0 N-CA-C 113.29 0.848 . . . . 91.07 113.29 172.442 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1636 ' ' GLU . . . . . 0.455 ' HG3' ' O ' ' A' 1632 ' ' LEU . 70.2 mt-10 -61.88 -42.37 98.98 Favored 'General case' 0 C--O 1.24 0.59 0 O-C-N 122.174 -0.328 . . . . 107.43 111.399 -177.564 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A 1637 ' ' LYS . . . . . . . . . . . . . 20.2 tttt -62.56 -52.79 62.02 Favored 'General case' 0 C--O 1.24 0.564 0 CA-C-O 120.748 0.308 . . . . 116.86 111.121 178.887 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1638 ' ' ASP . . . . . . . . . . . . . 89.7 m-20 -59.68 -33.33 71.44 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 120.085 -0.646 . . . . 111.09 110.576 -175.297 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1639 ' ' ILE . . . . . . . . . . . . . 89.2 mt -69.12 -41.5 81.48 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 C-N-CA 118.793 -1.163 . . . . 101.87 111.225 179.509 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1640 ' ' CYS . . . . . 1.462 ' CB ' ' SG ' ' A' 1640 ' ' CYS . 0.0 OUTLIER -69.34 -37.67 77.78 Favored 'General case' 0 C--O 1.24 0.576 0 O-C-N 121.584 -0.698 . . . . 124.31 111.302 -179.031 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A 1641 ' ' THR . . . . . . . . . . . . . 38.8 p -66.51 -44.87 81.37 Favored 'General case' 0 C--O 1.238 0.485 0 C-N-CA 118.953 -1.099 . . . . 117.56 110.813 178.641 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1642 ' ' ALA . . . . . . . . . . . . . . . -54.26 -56.08 21.87 Favored 'General case' 0 C--O 1.237 0.439 0 CA-C-O 121.128 0.489 . . . . 120.29 111.213 174.099 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1643 ' ' LYS . . . . . . . . . . . . . 10.3 tttt -51.03 -61.21 2.37 Favored 'General case' 0 C--O 1.238 0.466 0 CA-C-O 120.85 0.357 . . . . 150.62 111.059 176.319 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1644 ' ' GLU . . . . . . . . . . . . . . . -61.47 -26.56 67.98 Favored 'General case' 0 C--O 1.234 0.238 0 C-N-CA 120.498 -0.481 . . . . 158.97 112.296 -174.823 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1645 ' ' ALA . . . . . . . . . . . . . . . -94.93 -12.09 27.44 Favored 'General case' 0 C--O 1.236 0.39 0 N-CA-C 113.249 0.833 . . . . 151.57 113.249 176.436 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1646 ' ' ALA . . . . . . . . . . . . . . . -63.97 -18.05 63.89 Favored 'General case' 0 C--O 1.235 0.333 0 C-N-CA 120.147 -0.621 . . . . 171.21 111.59 172.549 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1647 ' ' LEU . . . . . . . . . . . . . 4.7 mp -92.45 50.05 1.57 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.573 0.701 . . . . 165.67 111.174 -175.436 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1648 ' ' GLU . . . . . 0.712 ' C ' ' OE1' ' A' 1648 ' ' GLU . 0.7 OUTLIER . . . . . 0 CA--C 1.54 0.578 0 CA-C-O 121.679 0.752 . . . . 198.95 112.998 -177.93 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A 4000 ' ' NQV . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_