data_1o51_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 1o51 _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 ' -1' ' ' HIS . . . . . . . . . . . . . 26.4 m-70 . . . . . 0 N--CA 1.508 2.447 0 N-CA-C 113.364 0.875 . . . . 52.9 113.364 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 0' ' ' HIS . . . . . . . . . . . . . 30.6 t-80 -65.01 136.64 57.02 Favored 'General case' 0 CA--C 1.489 -1.37 0 CA-C-N 114.007 -1.451 . . . . 53.16 111.83 -174.908 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 1' ' ' MSE . . . . . . . . . . . . . 14.3 mmt -144.32 173.94 11.34 Favored 'General case' 0 N--CA 1.436 -1.151 0 O-C-N 124.09 0.869 . . . . 37.89 109.148 172.182 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 67.4 mmtt -112.24 142.02 45.23 Favored 'General case' 0 N--CA 1.433 -1.287 0 CA-C-N 115.433 -0.803 . . . . 38.08 108.909 170.088 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 17.2 tp -97.32 129.84 44.56 Favored 'General case' 0 N--CA 1.433 -1.302 0 N-CA-C 105.519 -2.03 . . . . 38.14 105.519 165.254 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 21.0 tp -113.27 129.71 56.45 Favored 'General case' 0 C--N 1.314 -0.948 0 N-CA-C 106.212 -1.773 . . . . 36.58 106.212 172.532 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' LYS . . . . . 0.43 ' NZ ' ' O3 ' ' A' ' 301' ' ' SO4 . 27.6 tttt -124.56 127.68 47.76 Favored 'General case' 0 N--CA 1.445 -0.723 0 N-CA-C 107.097 -1.446 . . . . 45.58 107.097 -177.635 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 57.2 mt -122.53 126.04 73.49 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.558 0 CA-C-N 115.317 -0.856 . . . . 36.61 109.417 -179.612 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 30.6 m-85 -112.3 130.89 55.79 Favored 'General case' 0 N--CA 1.443 -0.808 0 O-C-N 124.119 0.887 . . . . 46.13 110.268 175.24 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -148.42 173.53 13.0 Favored 'General case' 0 N--CA 1.438 -1.06 0 N-CA-C 108.589 -0.893 . . . . 39.33 108.589 178.298 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -88.41 147.99 20.37 Favored Glycine 0 C--O 1.258 1.623 0 O-C-N 121.138 -0.976 . . . . 34.17 113.611 172.338 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 58.9 tt0 -58.38 -37.63 75.66 Favored 'General case' 0 C--O 1.212 -0.893 0 O-C-N 121.828 -0.807 . . . . 44.13 113.097 174.152 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . . . -75.33 -6.26 48.98 Favored 'General case' 0 CA--C 1.551 0.984 0 N-CA-C 115.464 1.653 . . . . 39.59 115.464 178.992 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 70.5 m-20 -61.96 138.42 58.36 Favored 'General case' 0 C--O 1.221 -0.418 0 CA-C-N 118.467 0.576 . . . . 47.37 110.927 173.834 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 41.3 mmtt -125.07 146.04 49.64 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 122.895 0.478 . . . . 48.05 110.506 -171.707 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 75.4 t60 -127.63 114.46 17.4 Favored 'General case' 0 CA--C 1.509 -0.604 0 N-CA-C 106.088 -1.819 . . . . 50.81 106.088 165.197 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 4.7 m 59.4 51.1 6.93 Favored 'General case' 0 C--N 1.34 0.163 0 O-C-N 125.14 1.525 . . . . 48.64 110.369 -175.946 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 68.54 -14.13 0.75 Allowed Glycine 0 CA--C 1.53 1.0 0 N-CA-C 116.826 1.49 . . . . 47.34 116.826 -176.485 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . . . -104.58 159.15 30.3 Favored Pre-proline 0 N--CA 1.489 1.508 0 C-N-CA 124.327 1.051 . . . . 46.34 110.807 -173.41 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_exo -65.29 127.22 17.79 Favored 'Trans proline' 0 C--O 1.213 -0.764 0 C-N-CA 120.627 0.885 . . . . 42.58 111.513 -169.214 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 27.7 tp -64.32 -39.36 93.75 Favored 'General case' 0 CA--C 1.513 -0.461 0 N-CA-C 112.578 0.584 . . . . 39.4 112.578 -174.323 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 26.8 p90 -63.03 -37.55 87.64 Favored 'General case' 0 C--N 1.321 -0.637 0 C-N-CA 118.589 -1.244 . . . . 37.86 112.02 -178.468 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 60.9 mt-10 -65.68 -40.32 92.22 Favored 'General case' 0 CA--C 1.509 -0.603 0 O-C-N 123.68 0.612 . . . . 49.02 111.345 174.758 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 73.3 t80 -62.46 -41.89 99.08 Favored 'General case' 0 C--O 1.205 -1.25 0 N-CA-C 112.563 0.579 . . . . 38.61 112.563 173.845 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 66.6 mt -60.91 -44.57 96.99 Favored 'General case' 0 C--O 1.214 -0.792 0 N-CA-C 113.495 0.924 . . . . 33.5 113.495 175.088 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 24.3 t -64.02 -34.78 70.75 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.944 0 CA-C-O 121.941 0.877 . . . . 35.3 109.254 -178.828 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . . . -73.74 -40.34 63.6 Favored 'General case' 0 N--CA 1.444 -0.76 0 CA-C-N 115.306 -0.861 . . . . 36.08 110.601 -177.483 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' ARG . . . . . 0.453 ' NH1' ' OE2' ' A' ' 29' ' ' GLU . 26.0 mmm180 -63.48 -44.96 92.9 Favored 'General case' 0 CA--C 1.514 -0.431 0 N-CA-C 108.965 -0.754 . . . . 49.53 108.965 173.229 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -50.33 -45.74 55.06 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 119.198 -1.001 . . . . 33.83 110.242 177.712 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 58.0 t80 -68.73 -42.97 76.88 Favored 'General case' 0 N--CA 1.433 -1.309 0 C-N-CA 120.283 -0.567 . . . . 42.25 109.8 -176.211 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' GLU . . . . . 0.453 ' OE2' ' NH1' ' A' ' 26' ' ' ARG . 74.1 mt-10 -63.86 -34.69 78.51 Favored 'General case' 0 C--O 1.209 -1.037 0 N-CA-C 113.043 0.757 . . . . 43.4 113.043 -178.126 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 80.5 mt -73.12 -5.04 36.46 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 116.839 2.163 . . . . 42.56 116.839 175.798 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 79.43 25.52 58.84 Favored Glycine 0 N--CA 1.446 -0.677 0 CA-C-O 118.431 -1.205 . . . . 35.55 114.613 -178.137 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' MSE . . . . . . . . . . . . . . . -58.74 150.65 23.05 Favored 'General case' 0 CA--C 1.506 -0.72 0 CA-C-N 119.445 1.622 . . . . 35.63 113.063 170.476 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 27.6 mttt -69.19 -27.44 65.51 Favored 'General case' 0 C--O 1.217 -0.623 0 CA-C-N 115.775 -0.648 . . . . 41.25 110.395 -175.527 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 174.23 173.34 40.19 Favored Glycine 0 N--CA 1.423 -2.175 0 C-N-CA 120.761 -0.733 . . . . 34.32 112.858 178.685 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 8.0 p -151.01 146.26 16.26 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.23 0 CA-C-N 113.688 -1.256 . . . . 38.15 111.85 173.234 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 43.7 m -126.98 132.69 50.74 Favored 'General case' 0 N--CA 1.436 -1.153 0 CA-C-N 115.258 -0.883 . . . . 33.29 109.808 171.913 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 20.2 t -116.24 132.14 66.69 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 CA-C-O 121.55 0.69 . . . . 32.0 111.05 -175.795 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 37.0 m-85 -121.85 154.04 37.58 Favored 'General case' 0 C--O 1.239 0.511 0 CA-C-N 115.643 -0.708 . . . . 40.59 110.577 179.396 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 38.3 ttm105 -118.24 124.55 48.16 Favored 'General case' 0 N--CA 1.419 -2.023 0 CA-C-N 115.644 -0.707 . . . . 33.67 110.285 171.511 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -83.88 172.36 49.79 Favored Glycine 0 N--CA 1.466 0.666 0 CA-C-O 122.129 0.849 . . . . 30.93 113.043 177.589 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 12.8 pt -105.63 -7.91 10.05 Favored 'Isoleucine or valine' 0 N--CA 1.411 -2.402 0 N-CA-C 112.588 0.588 . . . . 28.88 112.588 179.683 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' MSE . . . . . . . . . . . . . 5.9 ttt -171.56 150.89 2.85 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 107.603 -1.258 . . . . 56.5 107.603 -174.444 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -178.13 159.85 25.69 Favored Glycine 0 C--O 1.197 -2.173 0 C-N-CA 121.272 -0.489 . . . . 30.74 113.882 177.343 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 31.6 p90 -150.01 158.9 44.63 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-N 117.465 0.633 . . . . 30.96 109.944 163.168 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -131.85 -153.27 7.39 Favored Glycine 0 C--O 1.205 -1.661 0 CA-C-N 116.046 -0.524 . . . . 36.45 112.382 -178.674 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 2.1 m80 . . . . . 0 N--CA 1.502 2.15 0 C-N-CA 127.69 2.396 . . . . 49.83 110.211 166.748 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 1.5 Cg_endo . . . . . 0 CA--C 1.513 -0.57 0 N-CA-C 109.528 -0.989 . . . . 44.54 109.528 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 53.1 t0 -115.82 99.03 7.01 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 106.971 -1.492 . . . . 51.67 106.971 -177.612 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 96.0 mt -93.2 152.61 41.36 Favored Pre-proline 0 N--CA 1.426 -1.653 0 N-CA-C 107.947 -1.131 . . . . 36.56 107.947 -170.65 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 34.4 Cg_exo -62.05 140.6 85.17 Favored 'Trans proline' 0 N--CA 1.451 -1.027 0 C-N-CA 121.042 1.161 . . . . 33.5 109.718 176.823 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 29.7 mm -116.23 133.21 63.47 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.387 0 N-CA-C 107.506 -1.294 . . . . 35.3 107.506 161.217 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 90.0 t -122.75 129.59 75.07 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.529 0 CA-C-O 120.958 0.409 . . . . 40.9 110.238 179.055 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 8.5 mp -108.29 135.93 48.79 Favored 'General case' 0 CA--C 1.49 -1.355 0 N-CA-C 108.603 -0.888 . . . . 43.79 108.603 173.55 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 90.4 mt-10 -119.52 130.19 55.07 Favored 'General case' 0 C--N 1.321 -0.673 0 O-C-N 124.39 1.057 . . . . 47.69 109.011 169.154 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 61.0 mt -124.4 124.32 68.2 Favored 'Isoleucine or valine' 0 C--O 1.251 1.153 0 C-N-CA 126.355 1.862 . . . . 36.79 108.851 173.704 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 65.7 t -108.98 117.37 54.22 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.711 0 CA-C-O 121.68 0.753 . . . . 37.22 110.607 169.029 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -155.56 173.6 16.46 Favored 'General case' 0 CA--C 1.49 -1.348 0 O-C-N 121.955 -0.465 . . . . 41.95 111.043 -172.227 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 42.4 mm-40 -59.16 143.36 49.09 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 108.996 -0.742 . . . . 46.08 108.996 172.252 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -50.0 -41.43 47.06 Favored 'General case' 0 CA--C 1.55 0.956 0 N-CA-C 114.067 1.136 . . . . 53.22 114.067 176.593 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' GLU . . . . . 0.475 ' CD ' ' O ' ' A' ' 324' ' ' HOH . 28.6 mp0 -65.28 -36.43 84.08 Favored 'General case' 0 N--CA 1.444 -0.738 0 N-CA-C 109.139 -0.689 . . . . 36.26 109.139 -178.56 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 2.4 mtt85 -68.53 -43.45 76.71 Favored 'General case' 0 C--O 1.24 0.565 0 C-N-CA 119.491 -0.884 . . . . 43.75 112.884 -179.321 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.3 mp -59.84 -45.08 95.31 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.861 0 N-CA-C 106.924 -1.51 . . . . 40.46 106.924 178.056 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 87.0 m-20 -57.7 -38.11 74.64 Favored 'General case' 0 CA--C 1.506 -0.723 0 N-CA-C 114.554 1.316 . . . . 42.52 114.554 177.877 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 4.8 tp -68.1 -44.24 76.63 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.349 0.595 . . . . 39.83 110.084 -178.595 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 7.2 t80 -58.93 -43.11 91.11 Favored 'General case' 0 C--O 1.218 -0.565 0 CA-C-N 114.87 -1.059 . . . . 46.12 110.825 172.552 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 84.9 mt -55.73 -40.58 72.67 Favored 'General case' 0 CA--C 1.51 -0.596 0 CA-C-N 118.904 0.775 . . . . 40.98 109.552 178.899 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . . . -62.51 -33.48 74.98 Favored 'General case' 0 C--O 1.214 -0.802 0 N-CA-C 113.239 0.829 . . . . 44.94 113.239 -177.261 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -69.12 -51.96 33.1 Favored 'General case' 0 C--O 1.21 -1.019 0 N-CA-C 115.001 1.482 . . . . 59.48 115.001 168.085 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 62.6 mt -49.43 -26.35 2.2 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.367 0 O-C-N 120.844 -1.16 . . . . 57.39 113.72 174.885 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 20.6 t0 -66.0 -42.18 90.11 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-N 117.869 0.304 . . . . 61.7 111.429 -174.508 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . . . -66.28 -8.21 23.5 Favored 'General case' 0 C--O 1.21 -0.988 0 N-CA-C 114.843 1.423 . . . . 52.9 114.843 176.08 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 69.6 mt -99.71 125.98 53.22 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.488 0 N-CA-C 113.944 1.09 . . . . 55.14 113.944 178.121 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . . . -83.44 105.34 14.3 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 115.897 -0.592 . . . . 51.77 110.59 169.814 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 16.9 p90 -141.38 165.13 28.35 Favored 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 104.807 -2.294 . . . . 49.81 104.807 160.119 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . . . -88.09 -100.19 0.08 Allowed 'General case' 0 C--O 1.246 0.918 0 C-N-CA 119.805 -0.758 . . . . 48.83 111.46 178.091 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 50.88 -142.08 17.72 Favored Glycine 0 C--O 1.207 -1.532 0 N-CA-C 115.923 1.129 . . . . 44.79 115.923 175.782 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 6.2 tp -159.51 141.66 13.48 Favored 'General case' 0 C--O 1.177 -2.711 0 CA-C-O 118.179 -0.915 . . . . 39.94 110.151 -173.523 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 21.7 t -128.16 128.43 68.68 Favored 'Isoleucine or valine' 0 C--O 1.241 0.613 0 C-N-CA 124.412 1.085 . . . . 31.83 111.0 172.987 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 8.3 p90 -139.72 159.46 42.12 Favored 'General case' 0 N--CA 1.433 -1.294 0 C-N-CA 118.696 -1.202 . . . . 36.06 112.481 171.406 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 61.6 p -121.55 163.91 18.11 Favored 'General case' 0 N--CA 1.43 -1.468 0 CA-C-O 121.953 0.882 . . . . 32.37 110.366 170.088 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -157.64 151.53 24.24 Favored 'General case' 0 C--O 1.246 0.883 0 CA-C-N 114.154 -1.384 . . . . 31.72 107.582 -178.62 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 67.6 m-20 -83.35 136.21 34.43 Favored 'General case' 0 C--N 1.304 -1.392 0 N-CA-C 108.589 -0.893 . . . . 41.43 108.589 179.012 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 19.0 m -136.76 164.08 31.45 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.116 0 N-CA-C 108.683 -0.858 . . . . 32.34 108.683 172.836 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 1.6 t30 -114.22 113.49 24.71 Favored 'General case' 0 N--CA 1.431 -1.403 0 CA-C-N 114.603 -1.181 . . . . 50.1 109.533 175.246 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 39.4 t -82.25 134.01 27.93 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.797 0 CA-C-N 115.894 -0.594 . . . . 32.87 109.718 178.541 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 94.2 t -102.02 133.95 44.04 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 N-CA-C 109.453 -0.573 . . . . 37.51 109.453 175.48 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 18.2 mmtp . . . . . 0 N--CA 1.506 2.36 0 N-CA-C 117.108 2.262 . . . . 49.78 117.108 -177.089 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 301' ' ' SO4 . . . . . 0.43 ' O3 ' ' NZ ' ' A' ' 5' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 302' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 200' ' ' ADP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 313' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 316' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 317' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 318' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 319' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 320' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 321' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 322' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 323' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 324' ' ' HOH . . . . . 0.475 ' O ' ' CD ' ' A' ' 73' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 325' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 326' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 327' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 328' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 329' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 330' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 331' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 332' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 333' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 334' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 335' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 336' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 337' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 338' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 339' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 340' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 341' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' -1' ' ' HIS . . . . . . . . . . . . . 26.4 m-70 . . . . . 0 N--CA 1.508 2.447 0 N-CA-C 113.364 0.875 . . . . 52.9 113.364 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 0' ' ' HIS . . . . . . . . . . . . . 30.6 t-80 -65.01 136.64 57.02 Favored 'General case' 0 CA--C 1.489 -1.37 0 CA-C-N 114.007 -1.451 . . . . 53.16 111.83 -174.908 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 1' ' ' MSE . . . . . . . . . . . . . 14.3 mmt -144.32 173.94 11.34 Favored 'General case' 0 N--CA 1.436 -1.151 0 O-C-N 124.09 0.869 . . . . 37.89 109.148 172.182 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 67.4 mmtt -112.24 142.02 45.23 Favored 'General case' 0 N--CA 1.433 -1.287 0 CA-C-N 115.433 -0.803 . . . . 38.08 108.909 170.088 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 17.2 tp -97.32 129.84 44.56 Favored 'General case' 0 N--CA 1.433 -1.302 0 N-CA-C 105.519 -2.03 . . . . 38.14 105.519 165.254 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 21.0 tp -113.27 129.71 56.45 Favored 'General case' 0 C--N 1.314 -0.948 0 N-CA-C 106.212 -1.773 . . . . 36.58 106.212 172.532 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 27.6 tttt -124.56 127.68 47.76 Favored 'General case' 0 N--CA 1.445 -0.723 0 N-CA-C 107.097 -1.446 . . . . 45.58 107.097 -177.635 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 57.2 mt -122.53 126.04 73.49 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.558 0 CA-C-N 115.317 -0.856 . . . . 36.61 109.417 -179.612 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 30.6 m-85 -112.3 130.89 55.79 Favored 'General case' 0 N--CA 1.443 -0.808 0 O-C-N 124.119 0.887 . . . . 46.13 110.268 175.24 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -148.42 173.53 13.0 Favored 'General case' 0 N--CA 1.438 -1.06 0 N-CA-C 108.589 -0.893 . . . . 39.33 108.589 178.298 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -88.41 147.99 20.37 Favored Glycine 0 C--O 1.258 1.623 0 O-C-N 121.138 -0.976 . . . . 34.17 113.611 172.338 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 58.9 tt0 -58.38 -37.63 75.66 Favored 'General case' 0 C--O 1.212 -0.893 0 O-C-N 121.828 -0.807 . . . . 44.13 113.097 174.152 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . . . -75.33 -6.26 48.98 Favored 'General case' 0 CA--C 1.551 0.984 0 N-CA-C 115.464 1.653 . . . . 39.59 115.464 178.992 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 70.5 m-20 -61.96 138.42 58.36 Favored 'General case' 0 C--O 1.221 -0.418 0 CA-C-N 118.467 0.576 . . . . 47.37 110.927 173.834 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 41.3 mmtt -125.07 146.04 49.64 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 122.895 0.478 . . . . 48.05 110.506 -171.707 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' HIS . . . . . 0.45 ' HB2' HD13 ' A' ' 19' ' ' LEU . 75.4 t60 -127.63 114.46 17.4 Favored 'General case' 0 CA--C 1.509 -0.604 0 N-CA-C 106.088 -1.819 . . . . 50.81 106.088 165.197 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 4.7 m 59.4 51.1 6.93 Favored 'General case' 0 C--N 1.34 0.163 0 O-C-N 125.14 1.525 . . . . 48.64 110.369 -175.946 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 68.54 -14.13 0.75 Allowed Glycine 0 CA--C 1.53 1.0 0 N-CA-C 116.826 1.49 . . . . 47.34 116.826 -176.485 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . . . -104.58 159.15 30.3 Favored Pre-proline 0 N--CA 1.489 1.508 0 C-N-CA 124.327 1.051 . . . . 46.34 110.807 -173.41 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_exo -65.29 127.22 17.79 Favored 'Trans proline' 0 C--O 1.213 -0.764 0 C-N-CA 120.627 0.885 . . . . 42.58 111.513 -169.214 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' LEU . . . . . 0.45 HD13 ' HB2' ' A' ' 14' ' ' HIS . 27.7 tp -64.32 -39.36 93.75 Favored 'General case' 0 CA--C 1.513 -0.461 0 N-CA-C 112.578 0.584 . . . . 39.4 112.578 -174.323 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 26.8 p90 -63.03 -37.55 87.64 Favored 'General case' 0 C--N 1.321 -0.637 0 C-N-CA 118.589 -1.244 . . . . 37.86 112.02 -178.468 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 60.9 mt-10 -65.68 -40.32 92.22 Favored 'General case' 0 CA--C 1.509 -0.603 0 O-C-N 123.68 0.612 . . . . 49.02 111.345 174.758 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 73.3 t80 -62.46 -41.89 99.08 Favored 'General case' 0 C--O 1.205 -1.25 0 N-CA-C 112.563 0.579 . . . . 38.61 112.563 173.845 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 66.6 mt -60.91 -44.57 96.99 Favored 'General case' 0 C--O 1.214 -0.792 0 N-CA-C 113.495 0.924 . . . . 33.5 113.495 175.088 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 24.3 t -64.02 -34.78 70.75 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.944 0 CA-C-O 121.941 0.877 . . . . 35.3 109.254 -178.828 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . . . -73.74 -40.34 63.6 Favored 'General case' 0 N--CA 1.444 -0.76 0 CA-C-N 115.306 -0.861 . . . . 36.08 110.601 -177.483 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' ARG . . . . . 0.448 ' NH1' ' OE2' ' A' ' 29' ' ' GLU . 26.0 mmm180 -63.48 -44.96 92.9 Favored 'General case' 0 CA--C 1.514 -0.431 0 N-CA-C 108.965 -0.754 . . . . 49.53 108.965 173.229 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -50.33 -45.74 55.06 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 119.198 -1.001 . . . . 33.83 110.242 177.712 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 58.0 t80 -68.73 -42.97 76.88 Favored 'General case' 0 N--CA 1.433 -1.309 0 C-N-CA 120.283 -0.567 . . . . 42.25 109.8 -176.211 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' GLU . . . . . 0.448 ' OE2' ' NH1' ' A' ' 26' ' ' ARG . 74.1 mt-10 -63.86 -34.69 78.51 Favored 'General case' 0 C--O 1.209 -1.037 0 N-CA-C 113.043 0.757 . . . . 43.4 113.043 -178.126 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 30' ' ' LEU . . . . . 0.492 HD12 ' HD1' ' A' ' 78' ' ' PHE . 80.5 mt -73.12 -5.04 36.46 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 116.839 2.163 . . . . 42.56 116.839 175.798 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 79.43 25.52 58.84 Favored Glycine 0 N--CA 1.446 -0.677 0 CA-C-O 118.431 -1.205 . . . . 35.55 114.613 -178.137 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' MSE . . . . . . . . . . . . . . . -58.74 150.65 23.05 Favored 'General case' 0 CA--C 1.506 -0.72 0 CA-C-N 119.445 1.622 . . . . 35.63 113.063 170.476 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 27.6 mttt -69.19 -27.44 65.51 Favored 'General case' 0 C--O 1.217 -0.623 0 CA-C-N 115.775 -0.648 . . . . 41.25 110.395 -175.527 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 174.23 173.34 40.19 Favored Glycine 0 N--CA 1.423 -2.175 0 C-N-CA 120.761 -0.733 . . . . 34.32 112.858 178.685 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 8.0 p -151.01 146.26 16.26 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.23 0 CA-C-N 113.688 -1.256 . . . . 38.15 111.85 173.234 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 43.7 m -126.98 132.69 50.74 Favored 'General case' 0 N--CA 1.436 -1.153 0 CA-C-N 115.258 -0.883 . . . . 33.29 109.808 171.913 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 20.2 t -116.24 132.14 66.69 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 CA-C-O 121.55 0.69 . . . . 32.0 111.05 -175.795 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 37.0 m-85 -121.85 154.04 37.58 Favored 'General case' 0 C--O 1.239 0.511 0 CA-C-N 115.643 -0.708 . . . . 40.59 110.577 179.396 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 38.3 ttm105 -118.24 124.55 48.16 Favored 'General case' 0 N--CA 1.419 -2.023 0 CA-C-N 115.644 -0.707 . . . . 33.67 110.285 171.511 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -83.88 172.36 49.79 Favored Glycine 0 N--CA 1.466 0.666 0 CA-C-O 122.129 0.849 . . . . 30.93 113.043 177.589 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 12.8 pt -105.63 -7.91 10.05 Favored 'Isoleucine or valine' 0 N--CA 1.411 -2.402 0 N-CA-C 112.588 0.588 . . . . 28.88 112.588 179.683 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' MSE . . . . . . . . . . . . . 5.9 ttt -171.56 150.89 2.85 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 107.603 -1.258 . . . . 56.5 107.603 -174.444 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -178.13 159.85 25.69 Favored Glycine 0 C--O 1.197 -2.173 0 C-N-CA 121.272 -0.489 . . . . 30.74 113.882 177.343 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 31.6 p90 -150.01 158.9 44.63 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-N 117.465 0.633 . . . . 30.96 109.944 163.168 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -131.85 -153.27 7.39 Favored Glycine 0 C--O 1.205 -1.661 0 CA-C-N 116.046 -0.524 . . . . 36.45 112.382 -178.674 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 2.1 m80 . . . . . 0 N--CA 1.502 2.15 0 C-N-CA 127.69 2.396 . . . . 49.83 110.211 166.748 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 1.5 Cg_endo . . . . . 0 CA--C 1.513 -0.57 0 N-CA-C 109.528 -0.989 . . . . 44.54 109.528 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 53.1 t0 -115.82 99.03 7.01 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 106.971 -1.492 . . . . 51.67 106.971 -177.612 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 96.0 mt -93.2 152.61 41.36 Favored Pre-proline 0 N--CA 1.426 -1.653 0 N-CA-C 107.947 -1.131 . . . . 36.56 107.947 -170.65 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 34.4 Cg_exo -62.05 140.6 85.17 Favored 'Trans proline' 0 N--CA 1.451 -1.027 0 C-N-CA 121.042 1.161 . . . . 33.5 109.718 176.823 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 29.7 mm -116.23 133.21 63.47 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.387 0 N-CA-C 107.506 -1.294 . . . . 35.3 107.506 161.217 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 90.0 t -122.75 129.59 75.07 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.529 0 CA-C-O 120.958 0.409 . . . . 40.9 110.238 179.055 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 8.5 mp -108.29 135.93 48.79 Favored 'General case' 0 CA--C 1.49 -1.355 0 N-CA-C 108.603 -0.888 . . . . 43.79 108.603 173.55 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 90.4 mt-10 -119.52 130.19 55.07 Favored 'General case' 0 C--N 1.321 -0.673 0 O-C-N 124.39 1.057 . . . . 47.69 109.011 169.154 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 61.0 mt -124.4 124.32 68.2 Favored 'Isoleucine or valine' 0 C--O 1.251 1.153 0 C-N-CA 126.355 1.862 . . . . 36.79 108.851 173.704 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 65.7 t -108.98 117.37 54.22 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.711 0 CA-C-O 121.68 0.753 . . . . 37.22 110.607 169.029 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -155.56 173.6 16.46 Favored 'General case' 0 CA--C 1.49 -1.348 0 O-C-N 121.955 -0.465 . . . . 41.95 111.043 -172.227 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 42.4 mm-40 -59.16 143.36 49.09 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 108.996 -0.742 . . . . 46.08 108.996 172.252 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -50.0 -41.43 47.06 Favored 'General case' 0 CA--C 1.55 0.956 0 N-CA-C 114.067 1.136 . . . . 53.22 114.067 176.593 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' GLU . . . . . 0.475 ' CD ' ' O ' ' A' ' 324' ' ' HOH . 28.6 mp0 -65.28 -36.43 84.08 Favored 'General case' 0 N--CA 1.444 -0.738 0 N-CA-C 109.139 -0.689 . . . . 36.26 109.139 -178.56 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 2.4 mtt85 -68.53 -43.45 76.71 Favored 'General case' 0 C--O 1.24 0.565 0 C-N-CA 119.491 -0.884 . . . . 43.75 112.884 -179.321 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.3 mp -59.84 -45.08 95.31 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.861 0 N-CA-C 106.924 -1.51 . . . . 40.46 106.924 178.056 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 87.0 m-20 -57.7 -38.11 74.64 Favored 'General case' 0 CA--C 1.506 -0.723 0 N-CA-C 114.554 1.316 . . . . 42.52 114.554 177.877 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 4.8 tp -68.1 -44.24 76.63 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.349 0.595 . . . . 39.83 110.084 -178.595 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' PHE . . . . . 0.492 ' HD1' HD12 ' A' ' 30' ' ' LEU . 7.2 t80 -58.93 -43.11 91.11 Favored 'General case' 0 C--O 1.218 -0.565 0 CA-C-N 114.87 -1.059 . . . . 46.12 110.825 172.552 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 84.9 mt -55.73 -40.58 72.67 Favored 'General case' 0 CA--C 1.51 -0.596 0 CA-C-N 118.904 0.775 . . . . 40.98 109.552 178.899 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . . . -62.51 -33.48 74.98 Favored 'General case' 0 C--O 1.214 -0.802 0 N-CA-C 113.239 0.829 . . . . 44.94 113.239 -177.261 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -69.12 -51.96 33.1 Favored 'General case' 0 C--O 1.21 -1.019 0 N-CA-C 115.001 1.482 . . . . 59.48 115.001 168.085 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 62.6 mt -49.43 -26.35 2.2 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.367 0 O-C-N 120.844 -1.16 . . . . 57.39 113.72 174.885 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 20.6 t0 -66.0 -42.18 90.11 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-N 117.869 0.304 . . . . 61.7 111.429 -174.508 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . . . -66.28 -8.21 23.5 Favored 'General case' 0 C--O 1.21 -0.988 0 N-CA-C 114.843 1.423 . . . . 52.9 114.843 176.08 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 69.6 mt -99.71 125.98 53.22 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.488 0 N-CA-C 113.944 1.09 . . . . 55.14 113.944 178.121 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . . . -83.44 105.34 14.3 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 115.897 -0.592 . . . . 51.77 110.59 169.814 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 16.9 p90 -141.38 165.13 28.35 Favored 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 104.807 -2.294 . . . . 49.81 104.807 160.119 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . . . -88.09 -100.19 0.08 Allowed 'General case' 0 C--O 1.246 0.918 0 C-N-CA 119.805 -0.758 . . . . 48.83 111.46 178.091 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 50.88 -142.08 17.72 Favored Glycine 0 C--O 1.207 -1.532 0 N-CA-C 115.923 1.129 . . . . 44.79 115.923 175.782 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 6.2 tp -159.51 141.66 13.48 Favored 'General case' 0 C--O 1.177 -2.711 0 CA-C-O 118.179 -0.915 . . . . 39.94 110.151 -173.523 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 21.7 t -128.16 128.43 68.68 Favored 'Isoleucine or valine' 0 C--O 1.241 0.613 0 C-N-CA 124.412 1.085 . . . . 31.83 111.0 172.987 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 8.3 p90 -139.72 159.46 42.12 Favored 'General case' 0 N--CA 1.433 -1.294 0 C-N-CA 118.696 -1.202 . . . . 36.06 112.481 171.406 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 61.6 p -121.55 163.91 18.11 Favored 'General case' 0 N--CA 1.43 -1.468 0 CA-C-O 121.953 0.882 . . . . 32.37 110.366 170.088 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -157.64 151.53 24.24 Favored 'General case' 0 C--O 1.246 0.883 0 CA-C-N 114.154 -1.384 . . . . 31.72 107.582 -178.62 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 67.6 m-20 -83.35 136.21 34.43 Favored 'General case' 0 C--N 1.304 -1.392 0 N-CA-C 108.589 -0.893 . . . . 41.43 108.589 179.012 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 19.0 m -136.76 164.08 31.45 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.116 0 N-CA-C 108.683 -0.858 . . . . 32.34 108.683 172.836 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 1.6 t30 -114.22 113.49 24.71 Favored 'General case' 0 N--CA 1.431 -1.403 0 CA-C-N 114.603 -1.181 . . . . 50.1 109.533 175.246 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 39.4 t -82.25 134.01 27.93 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.797 0 CA-C-N 115.894 -0.594 . . . . 32.87 109.718 178.541 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 94.2 t -102.02 133.95 44.04 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 N-CA-C 109.453 -0.573 . . . . 37.51 109.453 175.48 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 18.2 mmtp . . . . . 0 N--CA 1.506 2.36 0 N-CA-C 117.108 2.262 . . . . 49.78 117.108 -177.089 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 301' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 302' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 200' ' ' ADP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 313' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 316' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 317' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 318' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 319' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 320' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 321' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 322' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 323' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 324' ' ' HOH . . . . . 0.475 ' O ' ' CD ' ' A' ' 73' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 325' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 326' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 327' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 328' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 329' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 330' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 331' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 332' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 333' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 334' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 335' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 336' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 337' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 338' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 339' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 340' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 341' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' -1' ' ' HIS . . . . . . . . . . . . . 26.4 m-70 . . . . . 0 N--CA 1.508 2.447 0 N-CA-C 113.364 0.875 . . . . 52.9 113.364 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 0' ' ' HIS . . . . . . . . . . . . . 30.6 t-80 -65.01 136.64 57.02 Favored 'General case' 0 CA--C 1.489 -1.37 0 CA-C-N 114.007 -1.451 . . . . 53.16 111.83 -174.908 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' MSE . . . . . . . . . . . . . 14.3 mmt -144.32 173.94 11.34 Favored 'General case' 0 N--CA 1.436 -1.151 0 O-C-N 124.09 0.869 . . . . 37.89 109.148 172.182 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 67.4 mmtt -112.24 142.02 45.23 Favored 'General case' 0 N--CA 1.433 -1.287 0 CA-C-N 115.433 -0.803 . . . . 38.08 108.909 170.088 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 17.2 tp -97.32 129.84 44.56 Favored 'General case' 0 N--CA 1.433 -1.302 0 N-CA-C 105.519 -2.03 . . . . 38.14 105.519 165.254 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 21.0 tp -113.27 129.71 56.45 Favored 'General case' 0 C--N 1.314 -0.948 0 N-CA-C 106.212 -1.773 . . . . 36.58 106.212 172.532 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 27.6 tttt -124.56 127.68 47.76 Favored 'General case' 0 N--CA 1.445 -0.723 0 N-CA-C 107.097 -1.446 . . . . 45.58 107.097 -177.635 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 57.2 mt -122.53 126.04 73.49 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.558 0 CA-C-N 115.317 -0.856 . . . . 36.61 109.417 -179.612 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 30.6 m-85 -112.3 130.89 55.79 Favored 'General case' 0 N--CA 1.443 -0.808 0 O-C-N 124.119 0.887 . . . . 46.13 110.268 175.24 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -148.42 173.53 13.0 Favored 'General case' 0 N--CA 1.438 -1.06 0 N-CA-C 108.589 -0.893 . . . . 39.33 108.589 178.298 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -88.41 147.99 20.37 Favored Glycine 0 C--O 1.258 1.623 0 O-C-N 121.138 -0.976 . . . . 34.17 113.611 172.338 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 58.9 tt0 -58.38 -37.63 75.66 Favored 'General case' 0 C--O 1.212 -0.893 0 O-C-N 121.828 -0.807 . . . . 44.13 113.097 174.152 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . . . -75.33 -6.26 48.98 Favored 'General case' 0 CA--C 1.551 0.984 0 N-CA-C 115.464 1.653 . . . . 39.59 115.464 178.992 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 70.5 m-20 -61.96 138.42 58.36 Favored 'General case' 0 C--O 1.221 -0.418 0 CA-C-N 118.467 0.576 . . . . 47.37 110.927 173.834 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 41.3 mmtt -125.07 146.04 49.64 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 122.895 0.478 . . . . 48.05 110.506 -171.707 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' HIS . . . . . 0.45 ' HB2' HD13 ' A' ' 19' ' ' LEU . 75.4 t60 -127.63 114.46 17.4 Favored 'General case' 0 CA--C 1.509 -0.604 0 N-CA-C 106.088 -1.819 . . . . 50.81 106.088 165.197 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 4.7 m 59.4 51.1 6.93 Favored 'General case' 0 C--N 1.34 0.163 0 O-C-N 125.14 1.525 . . . . 48.64 110.369 -175.946 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 68.54 -14.13 0.75 Allowed Glycine 0 CA--C 1.53 1.0 0 N-CA-C 116.826 1.49 . . . . 47.34 116.826 -176.485 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . . . -104.58 159.15 30.3 Favored Pre-proline 0 N--CA 1.489 1.508 0 C-N-CA 124.327 1.051 . . . . 46.34 110.807 -173.41 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_exo -65.29 127.22 17.79 Favored 'Trans proline' 0 C--O 1.213 -0.764 0 C-N-CA 120.627 0.885 . . . . 42.58 111.513 -169.214 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.45 HD13 ' HB2' ' A' ' 14' ' ' HIS . 27.7 tp -64.32 -39.36 93.75 Favored 'General case' 0 CA--C 1.513 -0.461 0 N-CA-C 112.578 0.584 . . . . 39.4 112.578 -174.323 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 26.8 p90 -63.03 -37.55 87.64 Favored 'General case' 0 C--N 1.321 -0.637 0 C-N-CA 118.589 -1.244 . . . . 37.86 112.02 -178.468 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 60.9 mt-10 -65.68 -40.32 92.22 Favored 'General case' 0 CA--C 1.509 -0.603 0 O-C-N 123.68 0.612 . . . . 49.02 111.345 174.758 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 73.3 t80 -62.46 -41.89 99.08 Favored 'General case' 0 C--O 1.205 -1.25 0 N-CA-C 112.563 0.579 . . . . 38.61 112.563 173.845 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 66.6 mt -60.91 -44.57 96.99 Favored 'General case' 0 C--O 1.214 -0.792 0 N-CA-C 113.495 0.924 . . . . 33.5 113.495 175.088 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 24.3 t -64.02 -34.78 70.75 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.944 0 CA-C-O 121.941 0.877 . . . . 35.3 109.254 -178.828 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . . . -73.74 -40.34 63.6 Favored 'General case' 0 N--CA 1.444 -0.76 0 CA-C-N 115.306 -0.861 . . . . 36.08 110.601 -177.483 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.448 ' NH1' ' OE2' ' A' ' 29' ' ' GLU . 26.0 mmm180 -63.48 -44.96 92.9 Favored 'General case' 0 CA--C 1.514 -0.431 0 N-CA-C 108.965 -0.754 . . . . 49.53 108.965 173.229 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -50.33 -45.74 55.06 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 119.198 -1.001 . . . . 33.83 110.242 177.712 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 58.0 t80 -68.73 -42.97 76.88 Favored 'General case' 0 N--CA 1.433 -1.309 0 C-N-CA 120.283 -0.567 . . . . 42.25 109.8 -176.211 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.448 ' OE2' ' NH1' ' A' ' 26' ' ' ARG . 74.1 mt-10 -63.86 -34.69 78.51 Favored 'General case' 0 C--O 1.209 -1.037 0 N-CA-C 113.043 0.757 . . . . 43.4 113.043 -178.126 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.492 HD12 ' HD1' ' A' ' 78' ' ' PHE . 80.5 mt -73.12 -5.04 36.46 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 116.839 2.163 . . . . 42.56 116.839 175.798 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 79.43 25.52 58.84 Favored Glycine 0 N--CA 1.446 -0.677 0 CA-C-O 118.431 -1.205 . . . . 35.55 114.613 -178.137 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' MSE . . . . . . . . . . . . . . . -58.74 150.65 23.05 Favored 'General case' 0 CA--C 1.506 -0.72 0 CA-C-N 119.445 1.622 . . . . 35.63 113.063 170.476 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 27.6 mttt -69.19 -27.44 65.51 Favored 'General case' 0 C--O 1.217 -0.623 0 CA-C-N 115.775 -0.648 . . . . 41.25 110.395 -175.527 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 174.23 173.34 40.19 Favored Glycine 0 N--CA 1.423 -2.175 0 C-N-CA 120.761 -0.733 . . . . 34.32 112.858 178.685 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 8.0 p -151.01 146.26 16.26 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.23 0 CA-C-N 113.688 -1.256 . . . . 38.15 111.85 173.234 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 43.7 m -126.98 132.69 50.74 Favored 'General case' 0 N--CA 1.436 -1.153 0 CA-C-N 115.258 -0.883 . . . . 33.29 109.808 171.913 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 20.2 t -116.24 132.14 66.69 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 CA-C-O 121.55 0.69 . . . . 32.0 111.05 -175.795 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 37.0 m-85 -121.85 154.04 37.58 Favored 'General case' 0 C--O 1.239 0.511 0 CA-C-N 115.643 -0.708 . . . . 40.59 110.577 179.396 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 38.3 ttm105 -118.24 124.55 48.16 Favored 'General case' 0 N--CA 1.419 -2.023 0 CA-C-N 115.644 -0.707 . . . . 33.67 110.285 171.511 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -83.88 172.36 49.79 Favored Glycine 0 N--CA 1.466 0.666 0 CA-C-O 122.129 0.849 . . . . 30.93 113.043 177.589 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 12.8 pt -105.63 -7.91 10.05 Favored 'Isoleucine or valine' 0 N--CA 1.411 -2.402 0 N-CA-C 112.588 0.588 . . . . 28.88 112.588 179.683 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' MSE . . . . . . . . . . . . . 5.9 ttt -171.56 150.89 2.85 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 107.603 -1.258 . . . . 56.5 107.603 -174.444 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -178.13 159.85 25.69 Favored Glycine 0 C--O 1.197 -2.173 0 C-N-CA 121.272 -0.489 . . . . 30.74 113.882 177.343 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 31.6 p90 -150.01 158.9 44.63 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-N 117.465 0.633 . . . . 30.96 109.944 163.168 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -131.85 -153.27 7.39 Favored Glycine 0 C--O 1.205 -1.661 0 CA-C-N 116.046 -0.524 . . . . 36.45 112.382 -178.674 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 2.1 m80 . . . . . 0 N--CA 1.502 2.15 0 C-N-CA 127.69 2.396 . . . . 49.83 110.211 166.748 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 1.5 Cg_endo . . . . . 0 CA--C 1.513 -0.57 0 N-CA-C 109.528 -0.989 . . . . 44.54 109.528 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 53.1 t0 -115.82 99.03 7.01 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 106.971 -1.492 . . . . 51.67 106.971 -177.612 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 96.0 mt -93.2 152.61 41.36 Favored Pre-proline 0 N--CA 1.426 -1.653 0 N-CA-C 107.947 -1.131 . . . . 36.56 107.947 -170.65 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 34.4 Cg_exo -62.05 140.6 85.17 Favored 'Trans proline' 0 N--CA 1.451 -1.027 0 C-N-CA 121.042 1.161 . . . . 33.5 109.718 176.823 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 29.7 mm -116.23 133.21 63.47 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.387 0 N-CA-C 107.506 -1.294 . . . . 35.3 107.506 161.217 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 90.0 t -122.75 129.59 75.07 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.529 0 CA-C-O 120.958 0.409 . . . . 40.9 110.238 179.055 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 8.5 mp -108.29 135.93 48.79 Favored 'General case' 0 CA--C 1.49 -1.355 0 N-CA-C 108.603 -0.888 . . . . 43.79 108.603 173.55 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 90.4 mt-10 -119.52 130.19 55.07 Favored 'General case' 0 C--N 1.321 -0.673 0 O-C-N 124.39 1.057 . . . . 47.69 109.011 169.154 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 61.0 mt -124.4 124.32 68.2 Favored 'Isoleucine or valine' 0 C--O 1.251 1.153 0 C-N-CA 126.355 1.862 . . . . 36.79 108.851 173.704 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 65.7 t -108.98 117.37 54.22 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.711 0 CA-C-O 121.68 0.753 . . . . 37.22 110.607 169.029 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -155.56 173.6 16.46 Favored 'General case' 0 CA--C 1.49 -1.348 0 O-C-N 121.955 -0.465 . . . . 41.95 111.043 -172.227 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 42.4 mm-40 -59.16 143.36 49.09 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 108.996 -0.742 . . . . 46.08 108.996 172.252 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -50.0 -41.43 47.06 Favored 'General case' 0 CA--C 1.55 0.956 0 N-CA-C 114.067 1.136 . . . . 53.22 114.067 176.593 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.475 ' CD ' ' O ' ' A' ' 324' ' ' HOH . 28.6 mp0 -65.28 -36.43 84.08 Favored 'General case' 0 N--CA 1.444 -0.738 0 N-CA-C 109.139 -0.689 . . . . 36.26 109.139 -178.56 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 2.4 mtt85 -68.53 -43.45 76.71 Favored 'General case' 0 C--O 1.24 0.565 0 C-N-CA 119.491 -0.884 . . . . 43.75 112.884 -179.321 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.3 mp -59.84 -45.08 95.31 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.861 0 N-CA-C 106.924 -1.51 . . . . 40.46 106.924 178.056 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 87.0 m-20 -57.7 -38.11 74.64 Favored 'General case' 0 CA--C 1.506 -0.723 0 N-CA-C 114.554 1.316 . . . . 42.52 114.554 177.877 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 4.8 tp -68.1 -44.24 76.63 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.349 0.595 . . . . 39.83 110.084 -178.595 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' PHE . . . . . 0.492 ' HD1' HD12 ' A' ' 30' ' ' LEU . 7.2 t80 -58.93 -43.11 91.11 Favored 'General case' 0 C--O 1.218 -0.565 0 CA-C-N 114.87 -1.059 . . . . 46.12 110.825 172.552 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 84.9 mt -55.73 -40.58 72.67 Favored 'General case' 0 CA--C 1.51 -0.596 0 CA-C-N 118.904 0.775 . . . . 40.98 109.552 178.899 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . . . -62.51 -33.48 74.98 Favored 'General case' 0 C--O 1.214 -0.802 0 N-CA-C 113.239 0.829 . . . . 44.94 113.239 -177.261 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -69.12 -51.96 33.1 Favored 'General case' 0 C--O 1.21 -1.019 0 N-CA-C 115.001 1.482 . . . . 59.48 115.001 168.085 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 62.6 mt -49.43 -26.35 2.2 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.367 0 O-C-N 120.844 -1.16 . . . . 57.39 113.72 174.885 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 20.6 t0 -66.0 -42.18 90.11 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-N 117.869 0.304 . . . . 61.7 111.429 -174.508 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . . . -66.28 -8.21 23.5 Favored 'General case' 0 C--O 1.21 -0.988 0 N-CA-C 114.843 1.423 . . . . 52.9 114.843 176.08 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 69.6 mt -99.71 125.98 53.22 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.488 0 N-CA-C 113.944 1.09 . . . . 55.14 113.944 178.121 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . . . -83.44 105.34 14.3 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 115.897 -0.592 . . . . 51.77 110.59 169.814 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 16.9 p90 -141.38 165.13 28.35 Favored 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 104.807 -2.294 . . . . 49.81 104.807 160.119 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . . . -88.09 -100.19 0.08 Allowed 'General case' 0 C--O 1.246 0.918 0 C-N-CA 119.805 -0.758 . . . . 48.83 111.46 178.091 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 50.88 -142.08 17.72 Favored Glycine 0 C--O 1.207 -1.532 0 N-CA-C 115.923 1.129 . . . . 44.79 115.923 175.782 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 6.2 tp -159.51 141.66 13.48 Favored 'General case' 0 C--O 1.177 -2.711 0 CA-C-O 118.179 -0.915 . . . . 39.94 110.151 -173.523 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 21.7 t -128.16 128.43 68.68 Favored 'Isoleucine or valine' 0 C--O 1.241 0.613 0 C-N-CA 124.412 1.085 . . . . 31.83 111.0 172.987 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 8.3 p90 -139.72 159.46 42.12 Favored 'General case' 0 N--CA 1.433 -1.294 0 C-N-CA 118.696 -1.202 . . . . 36.06 112.481 171.406 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 61.6 p -121.55 163.91 18.11 Favored 'General case' 0 N--CA 1.43 -1.468 0 CA-C-O 121.953 0.882 . . . . 32.37 110.366 170.088 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -157.64 151.53 24.24 Favored 'General case' 0 C--O 1.246 0.883 0 CA-C-N 114.154 -1.384 . . . . 31.72 107.582 -178.62 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 67.6 m-20 -83.35 136.21 34.43 Favored 'General case' 0 C--N 1.304 -1.392 0 N-CA-C 108.589 -0.893 . . . . 41.43 108.589 179.012 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 19.0 m -136.76 164.08 31.45 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.116 0 N-CA-C 108.683 -0.858 . . . . 32.34 108.683 172.836 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 1.6 t30 -114.22 113.49 24.71 Favored 'General case' 0 N--CA 1.431 -1.403 0 CA-C-N 114.603 -1.181 . . . . 50.1 109.533 175.246 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 39.4 t -82.25 134.01 27.93 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.797 0 CA-C-N 115.894 -0.594 . . . . 32.87 109.718 178.541 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 94.2 t -102.02 133.95 44.04 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 N-CA-C 109.453 -0.573 . . . . 37.51 109.453 175.48 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 18.2 mmtp . . . . . 0 N--CA 1.506 2.36 0 N-CA-C 117.108 2.262 . . . . 49.78 117.108 -177.089 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 301' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 302' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 200' ' ' ADP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 313' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 316' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 317' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 318' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 319' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 320' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 321' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 322' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 323' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 324' ' ' HOH . . . . . 0.475 ' O ' ' CD ' ' A' ' 73' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 325' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 326' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 327' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 328' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 329' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 330' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 331' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 332' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 333' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 334' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 335' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 336' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 337' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 338' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 339' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 340' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 341' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_