data_5u6z_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 5u6z _Structure_validation_residue.Date_analyzed 2017-01-06 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 ' 2' ' ' ASN . . . . . . . . . . . . . . . . . . . . 0 C--O 1.215 -0.756 0 N-CA-C 113.876 1.065 . . . . 75.640000000000001 113.876 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -67.07 -42.34 84.88 Favored 'General case' 0 C--O 1.212 -0.911 0 N-CA-C 117.992 2.589 . . . . 63.869999999999997 117.992 -173.559 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' GLN . . . . . 0.445 ' O ' ' CD2' ' A' ' 7' ' ' PHE . 0.0 OUTLIER -64.99 -50.35 66.68 Favored 'General case' 0 CA--C 1.487 -1.452 0 C-N-CA 120.372 -0.531 . . . . 66.969999999999999 111.912 -173.419 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.24 -33.11 74.8 Favored 'General case' 0 C--O 1.201 -1.472 0 N-CA-C 106.906 -1.516 . . . . 67.409999999999997 106.906 -177.296 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -63.66 -38.02 89.54 Favored 'General case' 0 N--CA 1.428 -1.527 0 CA-C-N 115.537 -0.756 . . . . 63.509999999999998 112.46 176.63 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' PHE . . . . . 0.445 ' CD2' ' O ' ' A' ' 4' ' ' GLN . 0.4 OUTLIER -66.34 -34.75 78.68 Favored 'General case' 0 C--O 1.188 -2.162 0 C-N-CA 119.612 -0.835 . . . . 47.789999999999999 113.207 -168.933 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 51.5 p-90 -85.16 -25.67 27.3 Favored 'General case' 0 C--N 1.304 -1.404 0 C-N-CA 118.618 -1.233 . . . . 46.759999999999998 113.598 -179.71 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 11.0 mtmt -51.39 -38.16 51.95 Favored 'General case' 0 C--O 1.24 0.57 0 C-N-CA 119.588 -0.845 . . . . 61.43 111.036 170.156 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.1 p -60.61 -39.62 88.83 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 116.436 -2.105 . . . . 49.299999999999997 113.27 179.475 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 32.1 mt -69.0 -11.47 60.81 Favored 'General case' 0 C--O 1.236 0.366 0 N-CA-C 114.097 1.147 . . . . 54.100000000000001 114.097 -176.287 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 56.7 mt -89.85 -4.32 57.64 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 119.587 -0.845 . . . . 49.530000000000001 112.222 179.654 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 18.0 mmtt -84.43 108.02 17.01 Favored 'General case' 0 C--O 1.241 0.651 0 C-N-CA 124.419 1.087 . . . . 70.620000000000005 111.667 -175.704 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -70.81 171.58 44.69 Favored Glycine 0 C--N 1.334 0.462 0 O-C-N 124.06 0.85 . . . . 54.829999999999998 112.929 178.887 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_exo -49.33 151.22 6.92 Favored 'Trans proline' 0 N--CA 1.473 0.284 0 C-N-CA 124.839 3.693 . . . . 56.399999999999999 110.454 177.261 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 79.8 Cg_exo -59.25 156.55 34.51 Favored 'Trans proline' 0 C--N 1.344 0.338 0 O-C-N 123.19 1.1 . . . . 54.399999999999999 111.855 179.218 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 22.7 Cg_exo -64.56 162.84 29.43 Favored 'Trans proline' 0 C--O 1.236 0.386 0 N-CA-C 109.182 -1.122 . . . . 54.210000000000001 109.182 -178.119 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_exo -56.13 144.44 80.41 Favored 'Trans proline' 0 C--O 1.241 0.652 0 C-N-CA 121.558 1.505 . . . . 48.32 110.816 165.93 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -59.92 154.63 49.1 Favored 'Trans proline' 0 C--O 1.246 0.9 0 O-C-N 122.859 0.926 . . . . 42.43 111.208 168.196 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 78.0 m-20 -91.98 145.02 24.87 Favored 'General case' 0 C--O 1.243 0.741 0 O-C-N 124.574 1.171 . . . . 41.659999999999997 111.301 172.772 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 26.0 p -74.95 153.84 38.39 Favored 'General case' 0 CA--C 1.528 0.112 0 CA-C-N 116.224 -0.444 . . . . 38.210000000000001 110.881 175.118 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 43.7 mmtm -77.1 -22.71 52.32 Favored 'General case' 0 C--O 1.249 1.038 0 N-CA-C 113.624 0.972 . . . . 57.859999999999999 113.624 -178.34 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -80.66 -27.56 50.51 Favored Glycine 0 C--O 1.227 -0.314 0 C-N-CA 119.969 -1.11 . . . . 39.460000000000001 112.337 -173.305 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 31.7 m80 -131.39 -12.07 3.54 Favored 'General case' 0 CA--C 1.514 -0.415 0 C-N-CA 119.398 -0.921 . . . . 36.840000000000003 112.936 -174.39 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 68.5 m 54.86 59.43 4.08 Favored 'General case' 0 N--CA 1.446 -0.626 0 O-C-N 124.326 1.016 . . . . 42.799999999999997 111.287 -174.792 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -142.57 154.22 62.93 Favored Pre-proline 0 CA--C 1.513 -0.446 0 N-CA-C 105.472 -2.047 . . . . 38.68 105.472 -173.176 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 92.8 Cg_exo -60.77 134.02 51.46 Favored 'Trans proline' 0 CA--C 1.51 -0.688 0 O-C-N 122.954 0.976 . . . . 38.759999999999998 110.002 -173.423 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 71.5 m -74.48 179.51 4.61 Favored 'General case' 0 C--O 1.22 -0.474 0 N-CA-C 108.161 -1.051 . . . . 46.020000000000003 108.161 174.427 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 5.5 m -126.97 155.09 37.74 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.129 0 N-CA-C 108.969 -0.752 . . . . 39.789999999999999 108.969 177.463 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 37.0 tp -104.99 114.62 28.93 Favored 'General case' 0 CA--C 1.504 -0.789 0 CA-C-N 115.29 -0.868 . . . . 43.299999999999997 110.006 -168.773 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' ARG . . . . . 0.484 ' NH1' ' O2 ' ' A' ' 102' ' ' SO4 . 7.5 mmm180 -110.57 162.29 14.86 Favored 'General case' 0 C--O 1.249 1.054 0 CA-C-O 121.867 0.841 . . . . 62.57 109.068 -178.525 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' THR . . . . . 0.428 ' OG1' ' NE2' ' A' ' 43' ' ' GLN . 64.4 m -127.9 133.81 49.32 Favored 'General case' 0 N--CA 1.435 -1.209 0 CA-C-N 114.15 -1.386 . . . . 46.439999999999998 107.665 -171.342 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 12.9 m -79.44 130.59 35.85 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.854 0 CA-C-O 122.199 1.0 . . . . 45.799999999999997 109.459 -177.254 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 35.3 mttm -113.78 -10.6 13.0 Favored 'General case' 0 N--CA 1.43 -1.463 0 CA-C-N 115.185 -0.916 . . . . 71.260000000000005 109.628 -177.798 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.8 114.36 1.86 Allowed 'General case' 0 N--CA 1.45 -0.466 0 N-CA-C 108.005 -1.109 . . . . 55.810000000000002 108.005 168.674 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -69.71 143.01 53.23 Favored 'General case' 0 C--O 1.237 0.399 0 N-CA-C 106.95 -1.5 . . . . 58.950000000000003 106.95 177.034 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 144.37 -153.49 25.13 Favored Glycine 0 C--O 1.25 1.098 0 N-CA-C 109.342 -1.503 . . . . 54.090000000000003 109.342 -172.376 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 22.5 Cg_exo -75.43 -19.39 17.01 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 121.882 1.722 . . . . 51.840000000000003 110.465 -170.923 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 53.7 m-20 -99.85 -14.31 18.83 Favored 'General case' 0 C--O 1.209 -1.032 0 N-CA-C 114.175 1.176 . . . . 43.439999999999998 114.175 -178.087 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 9.7 t -42.53 130.5 3.96 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 113.62 0.97 . . . . 56.560000000000002 113.62 -177.794 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 81.73 -15.34 26.14 Favored Glycine 0 N--CA 1.449 -0.453 0 N-CA-C 116.894 1.518 . . . . 42.859999999999999 116.894 -176.333 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 78.9 mtp180 -66.15 155.89 35.62 Favored 'General case' 0 N--CA 1.481 1.113 0 CA-C-N 119.082 1.441 . . . . 41.549999999999997 109.1 177.836 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' GLN . . . . . 0.428 ' NE2' ' OG1' ' A' ' 32' ' ' THR . 78.9 mt-30 -122.91 158.77 29.64 Favored 'General case' 0 CA--C 1.55 0.949 0 N-CA-C 115.694 1.739 . . . . 42.450000000000003 115.694 176.776 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 44.2 p90 -151.96 166.28 32.0 Favored 'General case' 0 CA--C 1.502 -0.895 0 C-N-CA 118.932 -1.107 . . . . 41.640000000000001 110.809 179.075 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 63.3 m-85 -107.3 144.43 34.15 Favored 'General case' 0 C--O 1.255 1.363 0 O-C-N 124.398 1.061 . . . . 48.590000000000003 111.573 176.149 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 10.0 m -146.4 162.7 9.72 Favored 'Isoleucine or valine' 0 C--O 1.241 0.655 0 CA-C-N 114.563 -1.199 . . . . 38.159999999999997 109.172 177.363 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 11.3 t -60.98 144.8 52.57 Favored 'General case' 0 C--O 1.215 -0.734 0 N-CA-C 109.141 -0.688 . . . . 36.799999999999997 109.141 179.662 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -91.64 -5.3 54.08 Favored 'General case' 0 N--CA 1.474 0.75 0 N-CA-C 113.762 1.023 . . . . 36.159999999999997 113.762 -174.596 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 23.3 mmt85 -68.29 149.97 97.89 Favored Pre-proline 0 C--N 1.324 -0.502 0 C-N-CA 118.674 -1.21 . . . . 38.780000000000001 110.647 -177.313 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_exo -63.85 159.28 42.59 Favored 'Trans proline' 0 CA--C 1.502 -1.076 0 C-N-CA 117.436 -1.243 . . . . 41.899999999999999 109.049 176.8 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -68.68 156.72 37.68 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-O 121.696 0.76 . . . . 60.729999999999997 111.011 175.356 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -174.32 -178.67 44.4 Favored Glycine 0 CA--C 1.5 -0.881 0 C-N-CA 119.555 -1.307 . . . . 40.990000000000002 112.193 -174.533 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' HIS . . . . . 0.459 ' N ' ' O ' ' A' ' 205' ' ' HOH . 31.5 t-80 -67.89 141.28 56.44 Favored 'General case' 0 C--N 1.322 -0.626 0 C-N-CA 119.437 -0.905 . . . . 38.619999999999997 112.231 -174.22 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.1 p -48.46 -27.39 2.64 Favored 'General case' 0 CA--C 1.554 1.129 0 N-CA-C 114.338 1.236 . . . . 46.979999999999997 114.338 179.007 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 68.0 p -79.04 -8.58 59.06 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 123.704 0.802 . . . . 41.939999999999998 113.03 173.279 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' ASN . . . . . 0.455 ' N ' ' O ' ' A' ' 53' ' ' HIS . 34.9 t-20 -91.95 106.63 18.15 Favored Pre-proline 0 CA--C 1.544 0.72 0 N-CA-C 114.494 1.294 . . . . 37.799999999999997 114.494 -174.291 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_endo -60.68 -26.84 83.76 Favored 'Trans proline' 0 C--O 1.218 -0.512 0 C-N-CA 117.177 -1.415 . . . . 38.780000000000001 110.522 -178.265 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 80.5 mm-40 -77.18 -19.11 57.21 Favored 'General case' 0 CA--C 1.532 0.285 0 O-C-N 123.727 0.642 . . . . 47.659999999999997 111.256 -176.51 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -66.49 162.1 21.43 Favored 'General case' 0 C--O 1.22 -0.478 0 O-C-N 122.054 -0.404 . . . . 36.689999999999998 111.271 179.496 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' ARG . . . . . 0.587 ' NH1' ' O ' ' A' ' 204' ' ' HOH . 33.1 ttm180 -49.21 142.66 6.92 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 123.652 0.781 . . . . 48.490000000000002 111.314 178.966 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 28.3 p -103.47 -177.94 3.51 Favored 'General case' 0 CA--C 1.5 -0.953 0 N-CA-C 106.508 -1.664 . . . . 40.200000000000003 106.508 177.678 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 73.1 m-20 -92.55 15.28 14.55 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 118.364 2.727 . . . . 58.869999999999997 118.364 -168.722 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 45.4 t80 -53.3 136.58 36.67 Favored 'General case' 0 C--O 1.246 0.916 0 CA-C-O 121.991 0.901 . . . . 43.630000000000003 112.502 179.549 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 81.4 t80 -149.6 130.26 14.05 Favored 'General case' 0 N--CA 1.443 -0.811 0 N-CA-C 107.393 -1.336 . . . . 38.700000000000003 107.393 174.081 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -151.15 121.7 7.42 Favored 'General case' 0 C--O 1.219 -0.552 0 C-N-CA 119.722 -0.791 . . . . 37.369999999999997 111.344 177.558 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 64.7 m95 -71.05 133.46 46.32 Favored 'General case' 0 CA--C 1.5 -0.971 0 N-CA-C 106.577 -1.638 . . . . 39.689999999999998 106.577 -179.505 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 24.4 tp -71.95 122.46 20.86 Favored 'General case' 0 N--CA 1.444 -0.749 0 N-CA-C 108.501 -0.926 . . . . 45.189999999999998 108.501 171.022 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 9.5 p . . . . . 0 C--N 1.326 -0.445 0 C-N-CA 120.438 -0.505 . . . . 66.629999999999995 111.26 171.842 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' SO4 . . . . . 0.484 ' O2 ' ' NH1' ' A' ' 31' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' HOH . . . . . 0.451 ' O ' ' O4 ' ' A' ' 102' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 204' ' ' HOH . . . . . 0.587 ' O ' ' NH1' ' A' ' 60' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 205' ' ' HOH . . . . . 0.459 ' O ' ' N ' ' A' ' 53' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . . . . . . . . 0 C--O 1.215 -0.756 0 N-CA-C 113.876 1.065 . . . . 75.640000000000001 113.876 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -67.07 -42.34 84.88 Favored 'General case' 0 C--O 1.212 -0.911 0 N-CA-C 117.992 2.589 . . . . 63.869999999999997 117.992 -173.559 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' GLN . . . . . 0.524 ' O ' ' HD2' ' A' ' 7' ' ' PHE . 0.0 OUTLIER -64.99 -50.35 66.68 Favored 'General case' 0 CA--C 1.487 -1.452 0 C-N-CA 120.372 -0.531 . . . . 66.969999999999999 111.912 -173.419 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.24 -33.11 74.8 Favored 'General case' 0 C--O 1.201 -1.472 0 N-CA-C 106.906 -1.516 . . . . 67.409999999999997 106.906 -177.296 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -63.66 -38.02 89.54 Favored 'General case' 0 N--CA 1.428 -1.527 0 CA-C-N 115.537 -0.756 . . . . 63.509999999999998 112.46 176.63 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' PHE . . . . . 0.524 ' HD2' ' O ' ' A' ' 4' ' ' GLN . 0.4 OUTLIER -66.34 -34.75 78.68 Favored 'General case' 0 C--O 1.188 -2.162 0 C-N-CA 119.612 -0.835 . . . . 47.789999999999999 113.207 -168.933 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 51.5 p-90 -85.16 -25.67 27.3 Favored 'General case' 0 C--N 1.304 -1.404 0 C-N-CA 118.618 -1.233 . . . . 46.759999999999998 113.598 -179.71 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 11.0 mtmt -51.39 -38.16 51.95 Favored 'General case' 0 C--O 1.24 0.57 0 C-N-CA 119.588 -0.845 . . . . 61.43 111.036 170.156 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.1 p -60.61 -39.62 88.83 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 116.436 -2.105 . . . . 49.299999999999997 113.27 179.475 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 32.1 mt -69.0 -11.47 60.81 Favored 'General case' 0 C--O 1.236 0.366 0 N-CA-C 114.097 1.147 . . . . 54.100000000000001 114.097 -176.287 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 56.7 mt -89.85 -4.32 57.64 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 119.587 -0.845 . . . . 49.530000000000001 112.222 179.654 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 18.0 mmtt -84.43 108.02 17.01 Favored 'General case' 0 C--O 1.241 0.651 0 C-N-CA 124.419 1.087 . . . . 70.620000000000005 111.667 -175.704 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -70.81 171.58 44.69 Favored Glycine 0 C--N 1.334 0.462 0 O-C-N 124.06 0.85 . . . . 54.829999999999998 112.929 178.887 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_exo -49.33 151.22 6.92 Favored 'Trans proline' 0 N--CA 1.473 0.284 0 C-N-CA 124.839 3.693 . . . . 56.399999999999999 110.454 177.261 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 79.8 Cg_exo -59.25 156.55 34.51 Favored 'Trans proline' 0 C--N 1.344 0.338 0 O-C-N 123.19 1.1 . . . . 54.399999999999999 111.855 179.218 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 22.7 Cg_exo -64.56 162.84 29.43 Favored 'Trans proline' 0 C--O 1.236 0.386 0 N-CA-C 109.182 -1.122 . . . . 54.210000000000001 109.182 -178.119 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_exo -56.13 144.44 80.41 Favored 'Trans proline' 0 C--O 1.241 0.652 0 C-N-CA 121.558 1.505 . . . . 48.32 110.816 165.93 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -59.92 154.63 49.1 Favored 'Trans proline' 0 C--O 1.246 0.9 0 O-C-N 122.859 0.926 . . . . 42.43 111.208 168.196 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 78.0 m-20 -91.98 145.02 24.87 Favored 'General case' 0 C--O 1.243 0.741 0 O-C-N 124.574 1.171 . . . . 41.659999999999997 111.301 172.772 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 26.0 p -74.95 153.84 38.39 Favored 'General case' 0 CA--C 1.528 0.112 0 CA-C-N 116.224 -0.444 . . . . 38.210000000000001 110.881 175.118 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 43.7 mmtm -77.1 -22.71 52.32 Favored 'General case' 0 C--O 1.249 1.038 0 N-CA-C 113.624 0.972 . . . . 57.859999999999999 113.624 -178.34 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -80.66 -27.56 50.51 Favored Glycine 0 C--O 1.227 -0.314 0 C-N-CA 119.969 -1.11 . . . . 39.460000000000001 112.337 -173.305 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 31.7 m80 -131.39 -12.07 3.54 Favored 'General case' 0 CA--C 1.514 -0.415 0 C-N-CA 119.398 -0.921 . . . . 36.840000000000003 112.936 -174.39 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 68.5 m 54.86 59.43 4.08 Favored 'General case' 0 N--CA 1.446 -0.626 0 O-C-N 124.326 1.016 . . . . 42.799999999999997 111.287 -174.792 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -142.57 154.22 62.93 Favored Pre-proline 0 CA--C 1.513 -0.446 0 N-CA-C 105.472 -2.047 . . . . 38.68 105.472 -173.176 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 92.8 Cg_exo -60.77 134.02 51.46 Favored 'Trans proline' 0 CA--C 1.51 -0.688 0 O-C-N 122.954 0.976 . . . . 38.759999999999998 110.002 -173.423 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 71.5 m -74.48 179.51 4.61 Favored 'General case' 0 C--O 1.22 -0.474 0 N-CA-C 108.161 -1.051 . . . . 46.020000000000003 108.161 174.427 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 5.5 m -126.97 155.09 37.74 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.129 0 N-CA-C 108.969 -0.752 . . . . 39.789999999999999 108.969 177.463 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 37.0 tp -104.99 114.62 28.93 Favored 'General case' 0 CA--C 1.504 -0.789 0 CA-C-N 115.29 -0.868 . . . . 43.299999999999997 110.006 -168.773 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' ARG . . . . . 0.48 ' NH1' ' O2 ' ' A' ' 102' ' ' SO4 . 7.5 mmm180 -110.57 162.29 14.86 Favored 'General case' 0 C--O 1.249 1.054 0 CA-C-O 121.867 0.841 . . . . 62.57 109.068 -178.525 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 64.4 m -127.9 133.81 49.32 Favored 'General case' 0 N--CA 1.435 -1.209 0 CA-C-N 114.15 -1.386 . . . . 46.439999999999998 107.665 -171.342 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' VAL . . . . . 0.48 HG21 ' O ' ' A' ' 39' ' ' ASN . 12.9 m -79.44 130.59 35.85 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.854 0 CA-C-O 122.199 1.0 . . . . 45.799999999999997 109.459 -177.254 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 35.3 mttm -113.78 -10.6 13.0 Favored 'General case' 0 N--CA 1.43 -1.463 0 CA-C-N 115.185 -0.916 . . . . 71.260000000000005 109.628 -177.798 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.8 114.36 1.86 Allowed 'General case' 0 N--CA 1.45 -0.466 0 N-CA-C 108.005 -1.109 . . . . 55.810000000000002 108.005 168.674 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -69.71 143.01 53.23 Favored 'General case' 0 C--O 1.237 0.399 0 N-CA-C 106.95 -1.5 . . . . 58.950000000000003 106.95 177.034 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 144.37 -153.49 25.13 Favored Glycine 0 C--O 1.25 1.098 0 N-CA-C 109.342 -1.503 . . . . 54.090000000000003 109.342 -172.376 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 22.5 Cg_exo -75.43 -19.39 17.01 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 121.882 1.722 . . . . 51.840000000000003 110.465 -170.923 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' ASN . . . . . 0.48 ' O ' HG21 ' A' ' 33' ' ' VAL . 53.7 m-20 -99.85 -14.31 18.83 Favored 'General case' 0 C--O 1.209 -1.032 0 N-CA-C 114.175 1.176 . . . . 43.439999999999998 114.175 -178.087 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 9.7 t -42.53 130.5 3.96 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 113.62 0.97 . . . . 56.560000000000002 113.62 -177.794 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 81.73 -15.34 26.14 Favored Glycine 0 N--CA 1.449 -0.453 0 N-CA-C 116.894 1.518 . . . . 42.859999999999999 116.894 -176.333 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' ARG . . . . . 0.436 ' O ' HG22 ' A' ' 33' ' ' VAL . 78.9 mtp180 -66.15 155.89 35.62 Favored 'General case' 0 N--CA 1.481 1.113 0 CA-C-N 119.082 1.441 . . . . 41.549999999999997 109.1 177.836 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 78.9 mt-30 -122.91 158.77 29.64 Favored 'General case' 0 CA--C 1.55 0.949 0 N-CA-C 115.694 1.739 . . . . 42.450000000000003 115.694 176.776 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 44.2 p90 -151.96 166.28 32.0 Favored 'General case' 0 CA--C 1.502 -0.895 0 C-N-CA 118.932 -1.107 . . . . 41.640000000000001 110.809 179.075 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 63.3 m-85 -107.3 144.43 34.15 Favored 'General case' 0 C--O 1.255 1.363 0 O-C-N 124.398 1.061 . . . . 48.590000000000003 111.573 176.149 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 10.0 m -146.4 162.7 9.72 Favored 'Isoleucine or valine' 0 C--O 1.241 0.655 0 CA-C-N 114.563 -1.199 . . . . 38.159999999999997 109.172 177.363 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 11.3 t -60.98 144.8 52.57 Favored 'General case' 0 C--O 1.215 -0.734 0 N-CA-C 109.141 -0.688 . . . . 36.799999999999997 109.141 179.662 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -91.64 -5.3 54.08 Favored 'General case' 0 N--CA 1.474 0.75 0 N-CA-C 113.762 1.023 . . . . 36.159999999999997 113.762 -174.596 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' ARG . . . . . 0.496 ' HB2' ' HA ' ' A' ' 60' ' ' ARG . 23.3 mmt85 -68.29 149.97 97.89 Favored Pre-proline 0 C--N 1.324 -0.502 0 C-N-CA 118.674 -1.21 . . . . 38.780000000000001 110.647 -177.313 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_exo -63.85 159.28 42.59 Favored 'Trans proline' 0 CA--C 1.502 -1.076 0 C-N-CA 117.436 -1.243 . . . . 41.899999999999999 109.049 176.8 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -68.68 156.72 37.68 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-O 121.696 0.76 . . . . 60.729999999999997 111.011 175.356 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -174.32 -178.67 44.4 Favored Glycine 0 CA--C 1.5 -0.881 0 C-N-CA 119.555 -1.307 . . . . 40.990000000000002 112.193 -174.533 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 31.5 t-80 -67.89 141.28 56.44 Favored 'General case' 0 C--N 1.322 -0.626 0 C-N-CA 119.437 -0.905 . . . . 38.619999999999997 112.231 -174.22 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.1 p -48.46 -27.39 2.64 Favored 'General case' 0 CA--C 1.554 1.129 0 N-CA-C 114.338 1.236 . . . . 46.979999999999997 114.338 179.007 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 68.0 p -79.04 -8.58 59.06 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 123.704 0.802 . . . . 41.939999999999998 113.03 173.279 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 34.9 t-20 -91.95 106.63 18.15 Favored Pre-proline 0 CA--C 1.544 0.72 0 N-CA-C 114.494 1.294 . . . . 37.799999999999997 114.494 -174.291 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_endo -60.68 -26.84 83.76 Favored 'Trans proline' 0 C--O 1.218 -0.512 0 C-N-CA 117.177 -1.415 . . . . 38.780000000000001 110.522 -178.265 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 80.5 mm-40 -77.18 -19.11 57.21 Favored 'General case' 0 CA--C 1.532 0.285 0 O-C-N 123.727 0.642 . . . . 47.659999999999997 111.256 -176.51 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -66.49 162.1 21.43 Favored 'General case' 0 C--O 1.22 -0.478 0 O-C-N 122.054 -0.404 . . . . 36.689999999999998 111.271 179.496 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' ARG . . . . . 0.601 ' HD2' ' O ' ' A' ' 204' ' ' HOH . 33.1 ttm180 -49.21 142.66 6.92 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 123.652 0.781 . . . . 48.490000000000002 111.314 178.966 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 28.3 p -103.47 -177.94 3.51 Favored 'General case' 0 CA--C 1.5 -0.953 0 N-CA-C 106.508 -1.664 . . . . 40.200000000000003 106.508 177.678 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 73.1 m-20 -92.55 15.28 14.55 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 118.364 2.727 . . . . 58.869999999999997 118.364 -168.722 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 45.4 t80 -53.3 136.58 36.67 Favored 'General case' 0 C--O 1.246 0.916 0 CA-C-O 121.991 0.901 . . . . 43.630000000000003 112.502 179.549 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 81.4 t80 -149.6 130.26 14.05 Favored 'General case' 0 N--CA 1.443 -0.811 0 N-CA-C 107.393 -1.336 . . . . 38.700000000000003 107.393 174.081 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -151.15 121.7 7.42 Favored 'General case' 0 C--O 1.219 -0.552 0 C-N-CA 119.722 -0.791 . . . . 37.369999999999997 111.344 177.558 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 64.7 m95 -71.05 133.46 46.32 Favored 'General case' 0 CA--C 1.5 -0.971 0 N-CA-C 106.577 -1.638 . . . . 39.689999999999998 106.577 -179.505 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 24.4 tp -71.95 122.46 20.86 Favored 'General case' 0 N--CA 1.444 -0.749 0 N-CA-C 108.501 -0.926 . . . . 45.189999999999998 108.501 171.022 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 9.5 p . . . . . 0 C--N 1.326 -0.445 0 C-N-CA 120.438 -0.505 . . . . 66.629999999999995 111.26 171.842 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 102' ' ' SO4 . . . . . 0.48 ' O2 ' ' NH1' ' A' ' 31' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 201' ' ' HOH . . . . . 0.451 ' O ' ' O4 ' ' A' ' 102' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 204' ' ' HOH . . . . . 0.601 ' O ' ' HD2' ' A' ' 60' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . . . . . . . . 0 C--O 1.215 -0.756 0 N-CA-C 113.876 1.065 . . . . 75.640000000000001 113.876 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -67.07 -42.34 84.88 Favored 'General case' 0 C--O 1.212 -0.911 0 N-CA-C 117.992 2.589 . . . . 63.869999999999997 117.992 -173.559 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.524 ' O ' ' HD2' ' A' ' 7' ' ' PHE . 0.0 OUTLIER -64.99 -50.35 66.68 Favored 'General case' 0 CA--C 1.487 -1.452 0 C-N-CA 120.372 -0.531 . . . . 66.969999999999999 111.912 -173.419 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.24 -33.11 74.8 Favored 'General case' 0 C--O 1.201 -1.472 0 N-CA-C 106.906 -1.516 . . . . 67.409999999999997 106.906 -177.296 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -63.66 -38.02 89.54 Favored 'General case' 0 N--CA 1.428 -1.527 0 CA-C-N 115.537 -0.756 . . . . 63.509999999999998 112.46 176.63 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.524 ' HD2' ' O ' ' A' ' 4' ' ' GLN . 0.4 OUTLIER -66.34 -34.75 78.68 Favored 'General case' 0 C--O 1.188 -2.162 0 C-N-CA 119.612 -0.835 . . . . 47.789999999999999 113.207 -168.933 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 51.5 p-90 -85.16 -25.67 27.3 Favored 'General case' 0 C--N 1.304 -1.404 0 C-N-CA 118.618 -1.233 . . . . 46.759999999999998 113.598 -179.71 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 11.0 mtmt -51.39 -38.16 51.95 Favored 'General case' 0 C--O 1.24 0.57 0 C-N-CA 119.588 -0.845 . . . . 61.43 111.036 170.156 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.1 p -60.61 -39.62 88.83 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 116.436 -2.105 . . . . 49.299999999999997 113.27 179.475 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 32.1 mt -69.0 -11.47 60.81 Favored 'General case' 0 C--O 1.236 0.366 0 N-CA-C 114.097 1.147 . . . . 54.100000000000001 114.097 -176.287 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 56.7 mt -89.85 -4.32 57.64 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 119.587 -0.845 . . . . 49.530000000000001 112.222 179.654 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 18.0 mmtt -84.43 108.02 17.01 Favored 'General case' 0 C--O 1.241 0.651 0 C-N-CA 124.419 1.087 . . . . 70.620000000000005 111.667 -175.704 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -70.81 171.58 44.69 Favored Glycine 0 C--N 1.334 0.462 0 O-C-N 124.06 0.85 . . . . 54.829999999999998 112.929 178.887 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_exo -49.33 151.22 6.92 Favored 'Trans proline' 0 N--CA 1.473 0.284 0 C-N-CA 124.839 3.693 . . . . 56.399999999999999 110.454 177.261 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 79.8 Cg_exo -59.25 156.55 34.51 Favored 'Trans proline' 0 C--N 1.344 0.338 0 O-C-N 123.19 1.1 . . . . 54.399999999999999 111.855 179.218 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 22.7 Cg_exo -64.56 162.84 29.43 Favored 'Trans proline' 0 C--O 1.236 0.386 0 N-CA-C 109.182 -1.122 . . . . 54.210000000000001 109.182 -178.119 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_exo -56.13 144.44 80.41 Favored 'Trans proline' 0 C--O 1.241 0.652 0 C-N-CA 121.558 1.505 . . . . 48.32 110.816 165.93 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -59.92 154.63 49.1 Favored 'Trans proline' 0 C--O 1.246 0.9 0 O-C-N 122.859 0.926 . . . . 42.43 111.208 168.196 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 78.0 m-20 -91.98 145.02 24.87 Favored 'General case' 0 C--O 1.243 0.741 0 O-C-N 124.574 1.171 . . . . 41.659999999999997 111.301 172.772 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 26.0 p -74.95 153.84 38.39 Favored 'General case' 0 CA--C 1.528 0.112 0 CA-C-N 116.224 -0.444 . . . . 38.210000000000001 110.881 175.118 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 43.7 mmtm -77.1 -22.71 52.32 Favored 'General case' 0 C--O 1.249 1.038 0 N-CA-C 113.624 0.972 . . . . 57.859999999999999 113.624 -178.34 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -80.66 -27.56 50.51 Favored Glycine 0 C--O 1.227 -0.314 0 C-N-CA 119.969 -1.11 . . . . 39.460000000000001 112.337 -173.305 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 31.7 m80 -131.39 -12.07 3.54 Favored 'General case' 0 CA--C 1.514 -0.415 0 C-N-CA 119.398 -0.921 . . . . 36.840000000000003 112.936 -174.39 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 68.5 m 54.86 59.43 4.08 Favored 'General case' 0 N--CA 1.446 -0.626 0 O-C-N 124.326 1.016 . . . . 42.799999999999997 111.287 -174.792 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -142.57 154.22 62.93 Favored Pre-proline 0 CA--C 1.513 -0.446 0 N-CA-C 105.472 -2.047 . . . . 38.68 105.472 -173.176 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 92.8 Cg_exo -60.77 134.02 51.46 Favored 'Trans proline' 0 CA--C 1.51 -0.688 0 O-C-N 122.954 0.976 . . . . 38.759999999999998 110.002 -173.423 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 71.5 m -74.48 179.51 4.61 Favored 'General case' 0 C--O 1.22 -0.474 0 N-CA-C 108.161 -1.051 . . . . 46.020000000000003 108.161 174.427 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 5.5 m -126.97 155.09 37.74 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.129 0 N-CA-C 108.969 -0.752 . . . . 39.789999999999999 108.969 177.463 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 37.0 tp -104.99 114.62 28.93 Favored 'General case' 0 CA--C 1.504 -0.789 0 CA-C-N 115.29 -0.868 . . . . 43.299999999999997 110.006 -168.773 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.48 ' NH1' ' O2 ' ' A' ' 102' ' ' SO4 . 7.5 mmm180 -110.57 162.29 14.86 Favored 'General case' 0 C--O 1.249 1.054 0 CA-C-O 121.867 0.841 . . . . 62.57 109.068 -178.525 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 64.4 m -127.9 133.81 49.32 Favored 'General case' 0 N--CA 1.435 -1.209 0 CA-C-N 114.15 -1.386 . . . . 46.439999999999998 107.665 -171.342 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.48 HG21 ' O ' ' A' ' 39' ' ' ASN . 12.9 m -79.44 130.59 35.85 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.854 0 CA-C-O 122.199 1.0 . . . . 45.799999999999997 109.459 -177.254 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 35.3 mttm -113.78 -10.6 13.0 Favored 'General case' 0 N--CA 1.43 -1.463 0 CA-C-N 115.185 -0.916 . . . . 71.260000000000005 109.628 -177.798 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.8 114.36 1.86 Allowed 'General case' 0 N--CA 1.45 -0.466 0 N-CA-C 108.005 -1.109 . . . . 55.810000000000002 108.005 168.674 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -69.71 143.01 53.23 Favored 'General case' 0 C--O 1.237 0.399 0 N-CA-C 106.95 -1.5 . . . . 58.950000000000003 106.95 177.034 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 144.37 -153.49 25.13 Favored Glycine 0 C--O 1.25 1.098 0 N-CA-C 109.342 -1.503 . . . . 54.090000000000003 109.342 -172.376 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 22.5 Cg_exo -75.43 -19.39 17.01 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 121.882 1.722 . . . . 51.840000000000003 110.465 -170.923 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' ASN . . . . . 0.48 ' O ' HG21 ' A' ' 33' ' ' VAL . 53.7 m-20 -99.85 -14.31 18.83 Favored 'General case' 0 C--O 1.209 -1.032 0 N-CA-C 114.175 1.176 . . . . 43.439999999999998 114.175 -178.087 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 9.7 t -42.53 130.5 3.96 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 113.62 0.97 . . . . 56.560000000000002 113.62 -177.794 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 81.73 -15.34 26.14 Favored Glycine 0 N--CA 1.449 -0.453 0 N-CA-C 116.894 1.518 . . . . 42.859999999999999 116.894 -176.333 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.436 ' O ' HG22 ' A' ' 33' ' ' VAL . 78.9 mtp180 -66.15 155.89 35.62 Favored 'General case' 0 N--CA 1.481 1.113 0 CA-C-N 119.082 1.441 . . . . 41.549999999999997 109.1 177.836 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 78.9 mt-30 -122.91 158.77 29.64 Favored 'General case' 0 CA--C 1.55 0.949 0 N-CA-C 115.694 1.739 . . . . 42.450000000000003 115.694 176.776 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 44.2 p90 -151.96 166.28 32.0 Favored 'General case' 0 CA--C 1.502 -0.895 0 C-N-CA 118.932 -1.107 . . . . 41.640000000000001 110.809 179.075 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 63.3 m-85 -107.3 144.43 34.15 Favored 'General case' 0 C--O 1.255 1.363 0 O-C-N 124.398 1.061 . . . . 48.590000000000003 111.573 176.149 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 10.0 m -146.4 162.7 9.72 Favored 'Isoleucine or valine' 0 C--O 1.241 0.655 0 CA-C-N 114.563 -1.199 . . . . 38.159999999999997 109.172 177.363 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 11.3 t -60.98 144.8 52.57 Favored 'General case' 0 C--O 1.215 -0.734 0 N-CA-C 109.141 -0.688 . . . . 36.799999999999997 109.141 179.662 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -91.64 -5.3 54.08 Favored 'General case' 0 N--CA 1.474 0.75 0 N-CA-C 113.762 1.023 . . . . 36.159999999999997 113.762 -174.596 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.496 ' HB2' ' HA ' ' A' ' 60' ' ' ARG . 23.3 mmt85 -68.29 149.97 97.89 Favored Pre-proline 0 C--N 1.324 -0.502 0 C-N-CA 118.674 -1.21 . . . . 38.780000000000001 110.647 -177.313 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_exo -63.85 159.28 42.59 Favored 'Trans proline' 0 CA--C 1.502 -1.076 0 C-N-CA 117.436 -1.243 . . . . 41.899999999999999 109.049 176.8 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -68.68 156.72 37.68 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-O 121.696 0.76 . . . . 60.729999999999997 111.011 175.356 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -174.32 -178.67 44.4 Favored Glycine 0 CA--C 1.5 -0.881 0 C-N-CA 119.555 -1.307 . . . . 40.990000000000002 112.193 -174.533 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 31.5 t-80 -67.89 141.28 56.44 Favored 'General case' 0 C--N 1.322 -0.626 0 C-N-CA 119.437 -0.905 . . . . 38.619999999999997 112.231 -174.22 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.1 p -48.46 -27.39 2.64 Favored 'General case' 0 CA--C 1.554 1.129 0 N-CA-C 114.338 1.236 . . . . 46.979999999999997 114.338 179.007 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 68.0 p -79.04 -8.58 59.06 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 123.704 0.802 . . . . 41.939999999999998 113.03 173.279 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 34.9 t-20 -91.95 106.63 18.15 Favored Pre-proline 0 CA--C 1.544 0.72 0 N-CA-C 114.494 1.294 . . . . 37.799999999999997 114.494 -174.291 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_endo -60.68 -26.84 83.76 Favored 'Trans proline' 0 C--O 1.218 -0.512 0 C-N-CA 117.177 -1.415 . . . . 38.780000000000001 110.522 -178.265 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 80.5 mm-40 -77.18 -19.11 57.21 Favored 'General case' 0 CA--C 1.532 0.285 0 O-C-N 123.727 0.642 . . . . 47.659999999999997 111.256 -176.51 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -66.49 162.1 21.43 Favored 'General case' 0 C--O 1.22 -0.478 0 O-C-N 122.054 -0.404 . . . . 36.689999999999998 111.271 179.496 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.601 ' HD2' ' O ' ' A' ' 204' ' ' HOH . 33.1 ttm180 -49.21 142.66 6.92 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 123.652 0.781 . . . . 48.490000000000002 111.314 178.966 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 28.3 p -103.47 -177.94 3.51 Favored 'General case' 0 CA--C 1.5 -0.953 0 N-CA-C 106.508 -1.664 . . . . 40.200000000000003 106.508 177.678 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 73.1 m-20 -92.55 15.28 14.55 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 118.364 2.727 . . . . 58.869999999999997 118.364 -168.722 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 45.4 t80 -53.3 136.58 36.67 Favored 'General case' 0 C--O 1.246 0.916 0 CA-C-O 121.991 0.901 . . . . 43.630000000000003 112.502 179.549 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 81.4 t80 -149.6 130.26 14.05 Favored 'General case' 0 N--CA 1.443 -0.811 0 N-CA-C 107.393 -1.336 . . . . 38.700000000000003 107.393 174.081 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -151.15 121.7 7.42 Favored 'General case' 0 C--O 1.219 -0.552 0 C-N-CA 119.722 -0.791 . . . . 37.369999999999997 111.344 177.558 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 64.7 m95 -71.05 133.46 46.32 Favored 'General case' 0 CA--C 1.5 -0.971 0 N-CA-C 106.577 -1.638 . . . . 39.689999999999998 106.577 -179.505 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 24.4 tp -71.95 122.46 20.86 Favored 'General case' 0 N--CA 1.444 -0.749 0 N-CA-C 108.501 -0.926 . . . . 45.189999999999998 108.501 171.022 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 9.5 p . . . . . 0 C--N 1.326 -0.445 0 C-N-CA 120.438 -0.505 . . . . 66.629999999999995 111.26 171.842 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' SO4 . . . . . 0.48 ' O2 ' ' NH1' ' A' ' 31' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' HOH . . . . . 0.451 ' O ' ' O4 ' ' A' ' 102' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 204' ' ' HOH . . . . . 0.601 ' O ' ' HD2' ' A' ' 60' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_