data_3fwt_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 3fwt _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 ' -3' ' ' GLY . . . . . 1.245 ' CA ' ' O ' ' A' ' 180' ' ' HOH . . . . . . . . 0 C--O 1.179 -3.333 0 N-CA-C 110.849 -0.9 . . . . 35.159999999999997 110.849 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' -2' ' ' SER . . . . . . . . . . . . . 5.6 m -107.6 132.48 53.24 Favored 'General case' 0 C--N 1.313 -0.989 0 N-CA-C 113.007 0.743 . . . . 34.68 113.007 -177.296 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' -1' ' ' HIS . . . . . . . . . . . . . 89.4 m-70 -138.61 165.81 25.96 Favored 'General case' 0 C--O 1.175 -2.862 0 N-CA-C 114.638 1.347 . . . . 41.530000000000001 114.638 -174.474 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 0' ' ' MET . . . . . . . . . . . . . 26.5 mtt 50.97 51.69 10.94 Favored Pre-proline 0 C--N 1.302 -1.496 0 N-CA-C 114.938 1.459 . . . . 40.310000000000002 114.938 175.729 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_endo -68.58 137.12 38.24 Favored 'Trans proline' 0 C--O 1.259 1.554 0 O-C-N 122.165 0.56 . . . . 22.170000000000002 111.621 -171.803 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 60.3 t80 -124.54 133.07 53.42 Favored 'General case' 0 N--CA 1.505 2.287 0 N-CA-C 106.809 -1.552 . . . . 17.690000000000001 106.809 176.72 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 6.2 mp -123.05 127.21 48.46 Favored 'General case' 0 C--O 1.271 2.208 0 N-CA-C 108.671 -0.862 . . . . 14.26 108.671 172.693 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' GLN . . . . . 0.882 ' CD ' ' O ' ' A' ' 142' ' ' HOH . 66.8 tt0 -104.53 122.76 46.24 Favored 'General case' 0 N--CA 1.473 0.68 0 O-C-N 125.878 1.987 . . . . 16.539999999999999 113.723 164.264 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 25.6 m -108.72 121.73 45.65 Favored 'General case' 0 N--CA 1.429 -1.496 0 N-CA-C 103.726 -2.694 . . . . 13.02 103.726 -177.14 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 14.5 mt -113.48 117.9 56.71 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.296 0 C-N-CA 126.097 1.759 . . . . 13.59 106.76 175.777 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 17.1 m -131.92 144.04 38.42 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.231 0 O-C-N 124.803 1.314 . . . . 11.34 111.889 -178.12 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 20.6 p -82.18 -15.18 54.14 Favored 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 113.956 1.095 . . . . 12.67 113.956 177.894 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 4.2 m -82.01 168.03 1.91 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.728 0 N-CA-C 113.6 0.963 . . . . 13.41 113.6 172.117 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 27.6 t -90.26 141.15 29.0 Favored 'General case' 0 N--CA 1.436 -1.143 0 N-CA-C 107.933 -1.136 . . . . 20.370000000000001 107.933 177.489 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 98.7 mt -116.31 152.57 33.59 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 103.457 -2.794 . . . . 19.239999999999998 103.457 -178.918 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 29.5 p30 -112.89 -178.42 3.38 Favored 'General case' 0 CA--C 1.497 -1.075 0 C-N-CA 117.962 -1.495 . . . . 17.68 108.658 171.946 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 58.1 m-20 -58.03 -38.08 75.57 Favored 'General case' 0 CA--C 1.566 1.581 0 N-CA-C 118.432 2.753 . . . . 20.870000000000001 118.432 177.617 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 43.4 mt-30 -63.0 -45.71 91.08 Favored 'General case' 0 C--O 1.274 2.378 0 CA-C-O 123.696 1.712 . . . . 23.949999999999999 110.932 179.224 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' LYS . . . . . 0.548 ' CE ' ' O ' ' A' ' 151' ' ' HOH . 19.3 mttp -68.83 -39.77 79.8 Favored 'General case' 0 N--CA 1.424 -1.773 0 CA-C-N 113.697 -1.592 . . . . 31.420000000000002 111.396 -178.902 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 67.4 mtm-85 -65.9 -41.62 91.25 Favored 'General case' 0 CA--C 1.508 -0.643 0 C-N-CA 115.062 -2.655 . . . . 15.73 112.26 172.74 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.89 -38.65 82.85 Favored 'General case' 0 CA--C 1.568 1.664 0 C-N-CA 118.031 -1.468 . . . . 13.359999999999999 112.088 177.858 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 87.9 m-20 -67.77 -42.92 80.94 Favored 'General case' 0 C--O 1.243 0.724 0 O-C-N 120.97 -1.081 . . . . 21.66 112.265 178.269 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 78.9 mt -59.61 -49.89 76.01 Favored 'General case' 0 N--CA 1.449 -0.523 0 N-CA-C 113.487 0.921 . . . . 14.69 113.487 172.814 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' SER . . . . . 0.74 ' OG ' ' CG2' ' A' ' 40' ' ' THR . 37.9 m -53.95 -44.65 70.87 Favored 'General case' 0 CA--C 1.567 1.62 0 CA-C-O 121.886 0.851 . . . . 16.27 111.758 177.014 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -56.59 -49.11 75.87 Favored 'General case' 0 N--CA 1.515 2.816 0 CA-C-N 115.397 -0.819 . . . . 16.800000000000001 112.063 174.891 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.01 -50.67 67.6 Favored 'General case' 0 CA--C 1.497 -1.083 0 N-CA-C 115.124 1.527 . . . . 19.359999999999999 115.124 179.775 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 21.3 m-30 -50.22 -39.67 45.16 Favored 'General case' 0 C--O 1.203 -1.361 0 N-CA-C 113.6 0.963 . . . . 20.57 113.6 171.793 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -65.07 -45.9 90.4 Favored Glycine 0 C--O 1.193 -2.413 0 N-CA-C 108.337 -1.905 . . . . 23.02 108.337 -175.032 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 4.2 mtm -60.71 -52.59 64.48 Favored 'General case' 0 N--CA 1.443 -0.795 0 CA-C-N 117.457 0.628 . . . . 39.640000000000001 111.846 176.656 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 64.7 mt -53.55 -44.36 56.47 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.328 0 CA-C-N 116.355 -0.384 . . . . 21.010000000000002 111.908 178.768 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 61.2 m -65.32 -47.45 76.5 Favored 'General case' 0 CA--C 1.539 0.527 0 O-C-N 123.645 0.591 . . . . 25.219999999999999 112.359 177.124 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' ARG . . . . . 0.764 ' NH2' ' O ' ' A' ' 176' ' ' HOH . 29.5 mtt180 -59.9 -48.62 80.93 Favored 'General case' 0 N--CA 1.441 -0.921 0 C-N-CA 118.393 -1.323 . . . . 45.630000000000003 113.851 178.29 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 65.3 mt-10 -72.51 -39.64 67.44 Favored 'General case' 0 C--O 1.254 1.317 0 N-CA-C 114.742 1.386 . . . . 35.340000000000003 114.742 -178.559 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 30.8 mm-40 -98.5 -22.63 15.91 Favored 'General case' 0 C--O 1.204 -1.294 0 C-N-CA 118.513 -1.275 . . . . 32.560000000000002 114.387 -173.033 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 11.8 tp -100.6 -26.85 13.68 Favored 'General case' 0 CA--C 1.505 -0.778 0 C-N-CA 117.874 -1.531 . . . . 42.719999999999999 109.734 -166.237 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 159.09 -91.01 0.11 Allowed Glycine 0 CA--C 1.5 -0.867 0 C-N-CA 119.876 -1.155 . . . . 50.149999999999999 113.791 175.999 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 16.3 mttp -94.01 131.61 31.33 Favored Pre-proline 0 CA--C 1.557 1.212 0 N-CA-C 119.486 3.143 . . . . 56.920000000000002 119.486 -160.243 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -52.88 -63.79 0.22 Allowed 'Trans proline' 0 CA--C 1.536 0.611 0 N-CA-C 110.593 -0.58 . . . . 54.490000000000002 110.593 -177.87 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' GLU . . . . . 0.744 ' OE2' ' O ' ' A' ' 35' ' ' GLU . 1.1 tp10 -64.15 4.27 0.35 Allowed 'General case' 0 CA--C 1.559 1.317 0 N-CA-C 113.451 0.908 . . . . 59.850000000000001 113.451 -173.967 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 62.2 m-20 -51.89 152.51 2.98 Favored 'General case' 0 C--O 1.25 1.117 0 N-CA-C 114.605 1.335 . . . . 54.490000000000002 114.605 -177.491 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' PHE . . . . . 0.598 ' CE2' ' OE2' ' A' ' 35' ' ' GLU 0.53 34.7 m-85 -116.44 148.73 40.43 Favored 'General case' 0 C--O 1.203 -1.366 0 C-N-CA 117.754 -1.579 . . . . 51.859999999999999 114.978 169.614 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 73.1 t -135.08 130.16 51.45 Favored 'Isoleucine or valine' 0 CA--C 1.492 -1.272 0 N-CA-C 108.764 -0.828 . . . . 24.829999999999998 108.764 -162.842 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 56.1 ttm -103.09 136.77 42.28 Favored 'General case' 0 C--O 1.211 -0.947 0 C-N-CA 118.458 -1.297 . . . . 14.24 109.295 -179.693 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' THR . . . . . 0.74 ' CG2' ' OG ' ' A' ' 20' ' ' SER 0.33 0.8 OUTLIER -136.7 112.78 9.72 Favored 'General case' 0 N--CA 1.433 -1.293 0 O-C-N 121.342 -0.849 . . . . 18.109999999999999 108.709 -168.533 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -107.77 140.39 40.91 Favored 'General case' 0 C--O 1.182 -2.49 0 CA-C-O 117.621 -1.18 . . . . 11.279999999999999 109.702 -178.091 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 85.9 m-85 -123.77 109.59 13.85 Favored 'General case' 0 C--O 1.267 1.99 0 C-N-CA 124.169 0.987 . . . . 18.52 109.914 -176.175 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 19.4 m -101.84 97.11 7.53 Favored 'General case' 0 C--O 1.219 -0.545 0 O-C-N 124.867 1.354 . . . . 14.279999999999999 108.853 171.136 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 18.3 p-10 -93.57 177.46 6.01 Favored 'General case' 0 N--CA 1.487 1.387 0 CA-C-O 119.11 -0.471 . . . . 18.539999999999999 111.374 -178.559 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 26.1 mtmm 53.84 30.96 12.26 Favored 'General case' 0 N--CA 1.447 -0.587 0 N-CA-C 113.119 0.785 . . . . 37.43 113.119 179.713 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 68.7 m -104.03 113.93 64.89 Favored Pre-proline 0 N--CA 1.491 1.62 0 N-CA-C 104.114 -2.55 . . . . 11.49 104.114 -176.9 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 84.2 Cg_exo -59.28 139.76 91.49 Favored 'Trans proline' 0 C--O 1.201 -1.335 0 C-N-CA 114.724 -3.051 . . . . 11.859999999999999 113.986 -179.045 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 78.3 mt -133.3 133.09 58.17 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.18 0 N-CA-C 106.904 -1.517 . . . . 11.970000000000001 106.904 179.686 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 12.2 t -107.38 143.68 35.35 Favored 'General case' 0 C--N 1.318 -0.779 0 C-N-CA 117.218 -1.793 . . . . 15.470000000000001 111.462 173.809 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 31.0 t80 -163.09 134.01 4.75 Favored 'General case' 0 C--O 1.171 -3.043 0 C-N-CA 117.809 -1.556 . . . . 21.27 108.881 -179.107 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 67.1 mt-30 49.89 39.97 19.66 Favored 'General case' 0 C--O 1.218 -0.561 0 O-C-N 124.864 1.352 . . . . 34.869999999999997 112.131 -173.88 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 70.71 14.33 72.56 Favored Glycine 0 N--CA 1.489 2.216 0 N-CA-C 116.611 1.404 . . . . 20.800000000000001 116.611 179.603 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 47.6 t -129.94 142.47 50.64 Favored 'General case' 0 N--CA 1.417 -2.106 0 N-CA-C 108.176 -1.046 . . . . 17.129999999999999 108.176 -177.747 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 24.0 p -99.56 22.38 10.91 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 115.963 1.838 . . . . 19.010000000000002 115.963 163.365 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -60.98 161.55 15.47 Favored Pre-proline 0 C--N 1.354 0.768 0 C-N-CA 118.72 -1.192 . . . . 12.789999999999999 108.248 169.713 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_exo -49.08 128.84 20.4 Favored 'Trans proline' 0 C--O 1.252 1.18 0 C-N-CA 124.347 3.365 . . . . 13.07 110.042 -173.951 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -143.22 167.8 21.26 Favored 'General case' 0 CA--C 1.559 1.29 0 N-CA-C 107.254 -1.387 . . . . 12.529999999999999 107.254 175.761 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -138.49 153.24 48.78 Favored 'General case' 0 CA--C 1.507 -0.707 0 C-N-CA 119.794 -0.763 . . . . 15.109999999999999 111.027 -177.3 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 5.4 t80 -135.82 131.74 35.78 Favored 'General case' 0 C--O 1.265 1.878 0 N-CA-C 105.441 -2.059 . . . . 21.379999999999999 105.441 170.483 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 98.4 t -121.8 129.75 75.19 Favored 'Isoleucine or valine' 0 C--O 1.266 1.954 0 CA-C-O 118.198 -0.906 . . . . 13.42 111.04 176.611 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' ARG . . . . . 0.729 ' NE ' ' OE1' ' A' ' 63' ' ' GLU . 27.6 ttp-105 -108.69 121.57 45.31 Favored 'General case' 0 C--N 1.353 0.746 0 N-CA-C 106.222 -1.769 . . . . 26.960000000000001 106.222 -179.864 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 31.8 t -108.73 130.24 61.89 Favored 'Isoleucine or valine' 0 C--N 1.342 0.259 0 N-CA-C 105.186 -2.153 . . . . 13.91 105.186 -177.868 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' GLU . . . . . 0.729 ' OE1' ' NE ' ' A' ' 61' ' ' ARG . 63.0 mt-10 -129.99 152.01 49.92 Favored 'General case' 0 C--N 1.323 -0.556 0 O-C-N 123.874 0.734 . . . . 27.050000000000001 109.735 -177.857 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 72.8 p -167.79 160.2 12.31 Favored 'General case' 0 C--O 1.213 -0.818 0 C-N-CA 116.503 -2.079 . . . . 23.48 107.448 178.296 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 92.5 t90 -70.88 139.09 50.7 Favored 'General case' 0 C--O 1.245 0.86 0 CA-C-O 121.029 0.442 . . . . 37.450000000000003 111.722 174.089 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 100.91 -134.9 11.87 Favored Glycine 0 C--O 1.261 1.844 0 CA-C-N 115.555 -0.748 . . . . 31.870000000000001 112.563 171.858 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' GLU . . . . . 0.681 ' CB ' ' O ' ' A' ' 173' ' ' HOH . 11.8 pt-20 -150.53 154.21 37.19 Favored 'General case' 0 CA--C 1.502 -0.893 0 C-N-CA 120.464 -0.495 . . . . 44.07 109.676 167.513 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 95.6 m-85 -76.63 134.5 39.3 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 124.803 1.241 . . . . 32.460000000000001 113.353 -172.321 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -62.81 135.14 95.8 Favored Pre-proline 0 CA--C 1.545 0.764 0 N-CA-C 105.657 -1.979 . . . . 33.369999999999997 105.657 161.777 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' PRO . . . . . 0.486 ' CD ' ' O ' ' A' ' 162' ' ' HOH . 0.9 OUTLIER -70.16 -15.44 35.58 Favored 'Trans proline' 0 C--N 1.356 0.948 0 N-CA-C 113.744 0.632 . . . . 34.579999999999998 113.744 -162.766 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 6.7 p -77.0 -26.51 53.95 Favored 'General case' 0 CA--C 1.546 0.797 0 N-CA-C 112.45 0.537 . . . . 32.340000000000003 112.45 176.051 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 89.1 mttt -71.16 -45.95 14.29 Favored Pre-proline 0 N--CA 1.483 1.197 0 N-CA-C 116.217 1.932 . . . . 30.800000000000001 116.217 -167.863 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 80.2 Cg_exo -56.65 -38.82 94.79 Favored 'Trans proline' 0 N--CA 1.453 -0.895 0 CA-C-O 118.566 -0.681 . . . . 23.91 111.819 174.601 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' LYS . . . . . 0.564 ' CE ' ' O ' ' A' ' 193' ' ' HOH . 0.0 OUTLIER -58.13 -36.73 73.38 Favored 'General case' 0 C--O 1.194 -1.842 0 O-C-N 123.565 0.541 . . . . 32.229999999999997 110.34 178.586 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 39.3 mmt -79.07 -27.67 43.05 Favored 'General case' 0 C--O 1.258 1.545 0 CA-C-O 121.877 0.846 . . . . 28.77 112.01 -178.29 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 95.9 mtp -80.41 -42.37 22.87 Favored 'General case' 0 C--O 1.201 -1.47 0 CA-C-N 115.174 -0.921 . . . . 25.75 110.834 -171.841 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 21.5 m -52.53 -49.73 84.23 Favored Pre-proline 0 C--N 1.317 -0.807 0 N-CA-C 114.239 1.2 . . . . 18.140000000000001 114.239 -172.554 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo -64.51 -30.43 61.57 Favored 'Trans proline' 0 N--CA 1.445 -1.334 0 C-N-CA 115.909 -2.261 . . . . 19.600000000000001 111.708 -176.869 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 79.0 mtp180 -71.29 -42.64 68.44 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-O 118.952 -0.547 . . . . 24.870000000000001 112.267 176.526 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 65.1 mt -61.71 -49.28 84.95 Favored 'Isoleucine or valine' 0 C--O 1.261 1.688 0 O-C-N 124.58 1.175 . . . . 16.350000000000001 109.599 178.995 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -61.31 -44.44 97.2 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-O 118.092 -0.956 . . . . 16.890000000000001 110.334 179.985 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -58.63 -44.79 90.14 Favored 'General case' 0 C--N 1.358 0.966 0 CA-C-N 119.513 1.051 . . . . 14.48 112.064 177.202 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -60.69 -40.47 92.3 Favored 'General case' 0 C--O 1.243 0.731 0 O-C-N 121.5 -0.75 . . . . 14.699999999999999 111.668 178.247 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 27.4 mm -66.22 -42.55 91.22 Favored 'Isoleucine or valine' 0 N--CA 1.517 2.893 0 CA-C-O 123.198 1.475 . . . . 28.399999999999999 110.633 177.516 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 92.0 m -60.45 -45.18 94.62 Favored 'General case' 0 C--O 1.27 2.142 0 C-N-CA 115.926 -2.31 . . . . 16.300000000000001 113.403 177.904 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 13.8 tttt -62.2 -45.24 94.25 Favored 'General case' 0 C--N 1.319 -0.721 0 O-C-N 119.875 -1.766 . . . . 32.490000000000002 113.108 177.788 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 67.6 mm-40 -83.94 -27.45 28.52 Favored 'General case' 0 CA--C 1.507 -0.677 0 C-N-CA 115.792 -2.363 . . . . 20.620000000000001 109.519 -172.076 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 27.3 m -118.49 -7.18 10.67 Favored 'General case' 0 N--CA 1.502 2.155 0 N-CA-C 117.035 2.235 . . . . 25.41 117.035 -170.226 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 74.43 8.86 81.1 Favored Glycine 0 CA--C 1.54 1.601 0 C-N-CA 120.986 -0.626 . . . . 17.91 112.503 179.071 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 96.6 mt -82.59 124.74 77.3 Favored Pre-proline 0 C--O 1.177 -2.721 0 N-CA-C 107.75 -1.204 . . . . 16.969999999999999 107.75 -179.544 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_endo -72.02 150.09 53.92 Favored 'Trans proline' 0 N--CA 1.488 1.176 0 N-CA-C 108.155 -1.517 . . . . 19.190000000000001 108.155 -176.121 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -56.76 -30.12 63.28 Favored 'General case' 0 N--CA 1.441 -0.9 0 C-N-CA 120.083 -0.647 . . . . 17.600000000000001 112.687 -177.825 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 20.5 pm0 -67.9 -6.08 20.08 Favored 'General case' 0 C--O 1.25 1.089 0 N-CA-C 114.151 1.167 . . . . 39.609999999999999 114.151 -179.001 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 64.3 mtp85 -119.45 32.92 5.85 Favored 'General case' 0 N--CA 1.5 2.061 0 C-N-CA 118.61 -1.236 . . . . 16.260000000000002 110.056 173.752 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 96.9 mt -121.75 122.49 67.05 Favored 'Isoleucine or valine' 0 C--O 1.256 1.429 0 N-CA-C 108.074 -1.084 . . . . 15.460000000000001 108.074 178.826 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 1.9 m-30 -107.2 134.3 50.5 Favored 'General case' 0 C--O 1.261 1.67 0 N-CA-C 108.397 -0.964 . . . . 22.32 108.397 174.631 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 18.1 t -124.84 124.51 68.03 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.479 0 N-CA-C 108.341 -0.985 . . . . 16.039999999999999 108.341 172.995 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 26.1 m-85 -119.48 140.82 49.84 Favored 'General case' 0 C--O 1.219 -0.545 0 O-C-N 123.235 0.334 . . . . 22.449999999999999 111.089 176.951 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 5.0 m-85 -116.57 130.26 56.64 Favored 'General case' 0 C--O 1.283 2.824 0 CA-C-O 122.544 1.164 . . . . 17.09 109.466 -177.86 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 93.6 m-85 -127.12 161.4 28.56 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-O 122.424 1.107 . . . . 21.289999999999999 109.752 175.453 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 84.1 p -148.97 166.2 29.33 Favored 'General case' 0 C--N 1.309 -1.19 0 C-N-CA 118.262 -1.375 . . . . 23.789999999999999 110.087 173.107 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 2.2 t -146.74 161.22 41.07 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 107.532 -1.284 . . . . 22.010000000000002 107.532 -177.148 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 17.7 mtpp -92.74 -11.22 34.46 Favored 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 109.155 -0.683 . . . . 41.119999999999997 109.155 171.46 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 40.0 m80 -116.86 110.37 18.26 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 115.874 -0.603 . . . . 26.510000000000002 112.619 -177.782 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' CYS . . . . . . . . . . . . . 30.8 p -164.4 150.88 11.02 Favored 'General case' 0 C--O 1.255 1.368 0 N-CA-C 104.993 -2.225 . . . . 32.310000000000002 104.993 179.686 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -143.68 149.69 21.67 Favored Glycine 0 C--N 1.341 0.856 0 C-N-CA 123.737 0.684 . . . . 25.579999999999998 112.815 -160.775 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' TRP . . . . . 1.156 ' CE3' ' O ' ' A' ' 136' ' ' HOH . 18.1 t90 -157.65 144.02 17.76 Favored 'General case' 0 CA--C 1.484 -1.581 0 N-CA-C 104.12 -2.548 . . . . 32.740000000000002 104.12 -170.523 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 16.2 t-20 53.41 32.67 14.33 Favored 'General case' 0 N--CA 1.416 -2.129 0 CA-C-N 113.226 -1.806 . . . . 36.060000000000002 107.03 -179.039 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 76.82 21.63 73.92 Favored Glycine 0 CA--C 1.543 1.84 0 O-C-N 124.972 1.42 . . . . 29.52 115.642 169.09 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -151.24 130.88 13.08 Favored 'General case' 0 C--O 1.247 0.932 0 N-CA-C 106.289 -1.745 . . . . 32.189999999999998 106.289 -170.103 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.2 m120 -72.87 150.9 42.25 Favored 'General case' 0 N--CA 1.472 0.651 0 O-C-N 124.176 0.922 . . . . 30.41 113.043 -179.25 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 65.3 t80 . . . . . 0 C--O 1.247 0.957 0 N-CA-C 106.095 -1.817 . . . . 40.369999999999997 106.095 -173.325 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 136' ' ' HOH . . . . . 1.156 ' O ' ' CE3' ' A' ' 107' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 137' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 138' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 139' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 140' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 141' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 142' ' ' HOH . . . . . 0.882 ' O ' ' CD ' ' A' ' 4' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 143' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 144' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 145' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 146' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 147' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 148' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 149' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 150' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 151' ' ' HOH . . . . . 0.548 ' O ' ' CE ' ' A' ' 15' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 152' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 153' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 154' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 155' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 156' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 157' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 158' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 159' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 160' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 161' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 162' ' ' HOH . . . . . 0.486 ' O ' ' CD ' ' A' ' 70' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 163' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 164' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 165' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 166' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 167' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 168' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 169' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 170' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 171' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 172' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 173' ' ' HOH . . . . . 0.681 ' O ' ' CB ' ' A' ' 67' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 174' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 175' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 176' ' ' HOH . . . . . 0.764 ' O ' ' NH2' ' A' ' 28' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 177' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 178' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 179' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 180' ' ' HOH . . . . . 1.245 ' O ' ' CA ' ' A' ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 181' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 182' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 183' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 184' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 185' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 186' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 187' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 188' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 189' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 190' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 191' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 192' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 193' ' ' HOH . . . . . 0.564 ' O ' ' CE ' ' A' ' 74' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 194' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 195' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 196' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 197' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 198' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 199' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 200' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' -3' ' ' GLY . . . . . 1.257 ' HA2' ' O ' ' A' ' 180' ' ' HOH . . . . . . . . 0 C--O 1.179 -3.333 0 N-CA-C 110.849 -0.9 . . . . 35.159999999999997 110.849 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' -2' ' ' SER . . . . . . . . . . . . . 5.6 m -107.6 132.48 53.24 Favored 'General case' 0 C--N 1.313 -0.989 0 N-CA-C 113.007 0.743 . . . . 34.68 113.007 -177.296 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' -1' ' ' HIS . . . . . . . . . . . . . 89.4 m-70 -138.61 165.81 25.96 Favored 'General case' 0 C--O 1.175 -2.862 0 N-CA-C 114.638 1.347 . . . . 41.530000000000001 114.638 -174.474 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 0' ' ' MET . . . . . 0.466 ' CE ' ' HB3' ' A' ' 107' ' ' TRP . 26.5 mtt 50.97 51.69 10.94 Favored Pre-proline 0 C--N 1.302 -1.496 0 N-CA-C 114.938 1.459 . . . . 40.310000000000002 114.938 175.729 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_endo -68.58 137.12 38.24 Favored 'Trans proline' 0 C--O 1.259 1.554 0 O-C-N 122.165 0.56 . . . . 22.170000000000002 111.621 -171.803 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 60.3 t80 -124.54 133.07 53.42 Favored 'General case' 0 N--CA 1.505 2.287 0 N-CA-C 106.809 -1.552 . . . . 17.690000000000001 106.809 176.72 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 6.2 mp -123.05 127.21 48.46 Favored 'General case' 0 C--O 1.271 2.208 0 N-CA-C 108.671 -0.862 . . . . 14.26 108.671 172.693 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' GLN . . . . . 0.882 ' CD ' ' O ' ' A' ' 142' ' ' HOH . 66.8 tt0 -104.53 122.76 46.24 Favored 'General case' 0 N--CA 1.473 0.68 0 O-C-N 125.878 1.987 . . . . 16.539999999999999 113.723 164.264 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 25.6 m -108.72 121.73 45.65 Favored 'General case' 0 N--CA 1.429 -1.496 0 N-CA-C 103.726 -2.694 . . . . 13.02 103.726 -177.14 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 14.5 mt -113.48 117.9 56.71 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.296 0 C-N-CA 126.097 1.759 . . . . 13.59 106.76 175.777 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 17.1 m -131.92 144.04 38.42 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.231 0 O-C-N 124.803 1.314 . . . . 11.34 111.889 -178.12 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 20.6 p -82.18 -15.18 54.14 Favored 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 113.956 1.095 . . . . 12.67 113.956 177.894 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 4.2 m -82.01 168.03 1.91 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.728 0 N-CA-C 113.6 0.963 . . . . 13.41 113.6 172.117 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 27.6 t -90.26 141.15 29.0 Favored 'General case' 0 N--CA 1.436 -1.143 0 N-CA-C 107.933 -1.136 . . . . 20.370000000000001 107.933 177.489 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 98.7 mt -116.31 152.57 33.59 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 103.457 -2.794 . . . . 19.239999999999998 103.457 -178.918 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 29.5 p30 -112.89 -178.42 3.38 Favored 'General case' 0 CA--C 1.497 -1.075 0 C-N-CA 117.962 -1.495 . . . . 17.68 108.658 171.946 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 58.1 m-20 -58.03 -38.08 75.57 Favored 'General case' 0 CA--C 1.566 1.581 0 N-CA-C 118.432 2.753 . . . . 20.870000000000001 118.432 177.617 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' GLN . . . . . 0.495 ' HG3' ' O ' ' A' ' 137' ' ' HOH . 43.4 mt-30 -63.0 -45.71 91.08 Favored 'General case' 0 C--O 1.274 2.378 0 CA-C-O 123.696 1.712 . . . . 23.949999999999999 110.932 179.224 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 15' ' ' LYS . . . . . 0.725 ' HE3' ' O ' ' A' ' 151' ' ' HOH . 19.3 mttp -68.83 -39.77 79.8 Favored 'General case' 0 N--CA 1.424 -1.773 0 CA-C-N 113.697 -1.592 . . . . 31.420000000000002 111.396 -178.902 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 67.4 mtm-85 -65.9 -41.62 91.25 Favored 'General case' 0 CA--C 1.508 -0.643 0 C-N-CA 115.062 -2.655 . . . . 15.73 112.26 172.74 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.89 -38.65 82.85 Favored 'General case' 0 CA--C 1.568 1.664 0 C-N-CA 118.031 -1.468 . . . . 13.359999999999999 112.088 177.858 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 87.9 m-20 -67.77 -42.92 80.94 Favored 'General case' 0 C--O 1.243 0.724 0 O-C-N 120.97 -1.081 . . . . 21.66 112.265 178.269 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 78.9 mt -59.61 -49.89 76.01 Favored 'General case' 0 N--CA 1.449 -0.523 0 N-CA-C 113.487 0.921 . . . . 14.69 113.487 172.814 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' SER . . . . . 0.771 ' OG ' HG21 ' A' ' 40' ' ' THR . 37.9 m -53.95 -44.65 70.87 Favored 'General case' 0 CA--C 1.567 1.62 0 CA-C-O 121.886 0.851 . . . . 16.27 111.758 177.014 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -56.59 -49.11 75.87 Favored 'General case' 0 N--CA 1.515 2.816 0 CA-C-N 115.397 -0.819 . . . . 16.800000000000001 112.063 174.891 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.01 -50.67 67.6 Favored 'General case' 0 CA--C 1.497 -1.083 0 N-CA-C 115.124 1.527 . . . . 19.359999999999999 115.124 179.775 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 21.3 m-30 -50.22 -39.67 45.16 Favored 'General case' 0 C--O 1.203 -1.361 0 N-CA-C 113.6 0.963 . . . . 20.57 113.6 171.793 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -65.07 -45.9 90.4 Favored Glycine 0 C--O 1.193 -2.413 0 N-CA-C 108.337 -1.905 . . . . 23.02 108.337 -175.032 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' MET . . . . . 0.64 ' HG2' ' O ' ' A' ' 150' ' ' HOH . 4.2 mtm -60.71 -52.59 64.48 Favored 'General case' 0 N--CA 1.443 -0.795 0 CA-C-N 117.457 0.628 . . . . 39.640000000000001 111.846 176.656 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 64.7 mt -53.55 -44.36 56.47 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.328 0 CA-C-N 116.355 -0.384 . . . . 21.010000000000002 111.908 178.768 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 61.2 m -65.32 -47.45 76.5 Favored 'General case' 0 CA--C 1.539 0.527 0 O-C-N 123.645 0.591 . . . . 25.219999999999999 112.359 177.124 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' ARG . . . . . 0.471 ' NH2' ' O ' ' A' ' 176' ' ' HOH . 29.5 mtt180 -59.9 -48.62 80.93 Favored 'General case' 0 N--CA 1.441 -0.921 0 C-N-CA 118.393 -1.323 . . . . 45.630000000000003 113.851 178.29 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 65.3 mt-10 -72.51 -39.64 67.44 Favored 'General case' 0 C--O 1.254 1.317 0 N-CA-C 114.742 1.386 . . . . 35.340000000000003 114.742 -178.559 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' GLU . . . . . 0.507 ' HB3' ' O ' ' A' ' 168' ' ' HOH . 30.8 mm-40 -98.5 -22.63 15.91 Favored 'General case' 0 C--O 1.204 -1.294 0 C-N-CA 118.513 -1.275 . . . . 32.560000000000002 114.387 -173.033 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 31' ' ' LEU . . . . . 0.412 HD12 ' HA ' ' A' ' 31' ' ' LEU . 11.8 tp -100.6 -26.85 13.68 Favored 'General case' 0 CA--C 1.505 -0.778 0 C-N-CA 117.874 -1.531 . . . . 42.719999999999999 109.734 -166.237 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 159.09 -91.01 0.11 Allowed Glycine 0 CA--C 1.5 -0.867 0 C-N-CA 119.876 -1.155 . . . . 50.149999999999999 113.791 175.999 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 16.3 mttp -94.01 131.61 31.33 Favored Pre-proline 0 CA--C 1.557 1.212 0 N-CA-C 119.486 3.143 . . . . 56.920000000000002 119.486 -160.243 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -52.88 -63.79 0.22 Allowed 'Trans proline' 0 CA--C 1.536 0.611 0 N-CA-C 110.593 -0.58 . . . . 54.490000000000002 110.593 -177.87 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' GLU . . . . . 0.744 ' OE2' ' O ' ' A' ' 35' ' ' GLU . 1.1 tp10 -64.15 4.27 0.35 Allowed 'General case' 0 CA--C 1.559 1.317 0 N-CA-C 113.451 0.908 . . . . 59.850000000000001 113.451 -173.967 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 62.2 m-20 -51.89 152.51 2.98 Favored 'General case' 0 C--O 1.25 1.117 0 N-CA-C 114.605 1.335 . . . . 54.490000000000002 114.605 -177.491 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' PHE . . . . . 0.598 ' CE2' ' OE2' ' A' ' 35' ' ' GLU 0.53 34.7 m-85 -116.44 148.73 40.43 Favored 'General case' 0 C--O 1.203 -1.366 0 C-N-CA 117.754 -1.579 . . . . 51.859999999999999 114.978 169.614 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 73.1 t -135.08 130.16 51.45 Favored 'Isoleucine or valine' 0 CA--C 1.492 -1.272 0 N-CA-C 108.764 -0.828 . . . . 24.829999999999998 108.764 -162.842 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 56.1 ttm -103.09 136.77 42.28 Favored 'General case' 0 C--O 1.211 -0.947 0 C-N-CA 118.458 -1.297 . . . . 14.24 109.295 -179.693 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' THR . . . . . 0.771 HG21 ' OG ' ' A' ' 20' ' ' SER 0.33 0.8 OUTLIER -136.7 112.78 9.72 Favored 'General case' 0 N--CA 1.433 -1.293 0 O-C-N 121.342 -0.849 . . . . 18.109999999999999 108.709 -168.533 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -107.77 140.39 40.91 Favored 'General case' 0 C--O 1.182 -2.49 0 CA-C-O 117.621 -1.18 . . . . 11.279999999999999 109.702 -178.091 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' PHE . . . . . 0.537 ' CE1' HG23 ' A' ' 40' ' ' THR . 85.9 m-85 -123.77 109.59 13.85 Favored 'General case' 0 C--O 1.267 1.99 0 C-N-CA 124.169 0.987 . . . . 18.52 109.914 -176.175 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 19.4 m -101.84 97.11 7.53 Favored 'General case' 0 C--O 1.219 -0.545 0 O-C-N 124.867 1.354 . . . . 14.279999999999999 108.853 171.136 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 18.3 p-10 -93.57 177.46 6.01 Favored 'General case' 0 N--CA 1.487 1.387 0 CA-C-O 119.11 -0.471 . . . . 18.539999999999999 111.374 -178.559 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 26.1 mtmm 53.84 30.96 12.26 Favored 'General case' 0 N--CA 1.447 -0.587 0 N-CA-C 113.119 0.785 . . . . 37.43 113.119 179.713 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 68.7 m -104.03 113.93 64.89 Favored Pre-proline 0 N--CA 1.491 1.62 0 N-CA-C 104.114 -2.55 . . . . 11.49 104.114 -176.9 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 84.2 Cg_exo -59.28 139.76 91.49 Favored 'Trans proline' 0 C--O 1.201 -1.335 0 C-N-CA 114.724 -3.051 . . . . 11.859999999999999 113.986 -179.045 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 78.3 mt -133.3 133.09 58.17 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.18 0 N-CA-C 106.904 -1.517 . . . . 11.970000000000001 106.904 179.686 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 12.2 t -107.38 143.68 35.35 Favored 'General case' 0 C--N 1.318 -0.779 0 C-N-CA 117.218 -1.793 . . . . 15.470000000000001 111.462 173.809 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 31.0 t80 -163.09 134.01 4.75 Favored 'General case' 0 C--O 1.171 -3.043 0 C-N-CA 117.809 -1.556 . . . . 21.27 108.881 -179.107 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 67.1 mt-30 49.89 39.97 19.66 Favored 'General case' 0 C--O 1.218 -0.561 0 O-C-N 124.864 1.352 . . . . 34.869999999999997 112.131 -173.88 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 70.71 14.33 72.56 Favored Glycine 0 N--CA 1.489 2.216 0 N-CA-C 116.611 1.404 . . . . 20.800000000000001 116.611 179.603 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 47.6 t -129.94 142.47 50.64 Favored 'General case' 0 N--CA 1.417 -2.106 0 N-CA-C 108.176 -1.046 . . . . 17.129999999999999 108.176 -177.747 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 24.0 p -99.56 22.38 10.91 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 115.963 1.838 . . . . 19.010000000000002 115.963 163.365 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -60.98 161.55 15.47 Favored Pre-proline 0 C--N 1.354 0.768 0 C-N-CA 118.72 -1.192 . . . . 12.789999999999999 108.248 169.713 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_exo -49.08 128.84 20.4 Favored 'Trans proline' 0 C--O 1.252 1.18 0 C-N-CA 124.347 3.365 . . . . 13.07 110.042 -173.951 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -143.22 167.8 21.26 Favored 'General case' 0 CA--C 1.559 1.29 0 N-CA-C 107.254 -1.387 . . . . 12.529999999999999 107.254 175.761 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -138.49 153.24 48.78 Favored 'General case' 0 CA--C 1.507 -0.707 0 C-N-CA 119.794 -0.763 . . . . 15.109999999999999 111.027 -177.3 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 5.4 t80 -135.82 131.74 35.78 Favored 'General case' 0 C--O 1.265 1.878 0 N-CA-C 105.441 -2.059 . . . . 21.379999999999999 105.441 170.483 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 98.4 t -121.8 129.75 75.19 Favored 'Isoleucine or valine' 0 C--O 1.266 1.954 0 CA-C-O 118.198 -0.906 . . . . 13.42 111.04 176.611 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' ARG . . . . . 0.72 ' NE ' ' OE1' ' A' ' 63' ' ' GLU . 27.6 ttp-105 -108.69 121.57 45.31 Favored 'General case' 0 C--N 1.353 0.746 0 N-CA-C 106.222 -1.769 . . . . 26.960000000000001 106.222 -179.864 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 31.8 t -108.73 130.24 61.89 Favored 'Isoleucine or valine' 0 C--N 1.342 0.259 0 N-CA-C 105.186 -2.153 . . . . 13.91 105.186 -177.868 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' GLU . . . . . 0.72 ' OE1' ' NE ' ' A' ' 61' ' ' ARG . 63.0 mt-10 -129.99 152.01 49.92 Favored 'General case' 0 C--N 1.323 -0.556 0 O-C-N 123.874 0.734 . . . . 27.050000000000001 109.735 -177.857 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 72.8 p -167.79 160.2 12.31 Favored 'General case' 0 C--O 1.213 -0.818 0 C-N-CA 116.503 -2.079 . . . . 23.48 107.448 178.296 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' TRP . . . . . 0.495 ' HB2' ' SG ' ' A' ' 105' ' ' CYS . 92.5 t90 -70.88 139.09 50.7 Favored 'General case' 0 C--O 1.245 0.86 0 CA-C-O 121.029 0.442 . . . . 37.450000000000003 111.722 174.089 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 100.91 -134.9 11.87 Favored Glycine 0 C--O 1.261 1.844 0 CA-C-N 115.555 -0.748 . . . . 31.870000000000001 112.563 171.858 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' GLU . . . . . 1.078 ' HB2' ' O ' ' A' ' 173' ' ' HOH . 11.8 pt-20 -150.53 154.21 37.19 Favored 'General case' 0 CA--C 1.502 -0.893 0 C-N-CA 120.464 -0.495 . . . . 44.07 109.676 167.513 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 95.6 m-85 -76.63 134.5 39.3 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 124.803 1.241 . . . . 32.460000000000001 113.353 -172.321 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -62.81 135.14 95.8 Favored Pre-proline 0 CA--C 1.545 0.764 0 N-CA-C 105.657 -1.979 . . . . 33.369999999999997 105.657 161.777 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' PRO . . . . . 0.908 ' HD2' ' O ' ' A' ' 162' ' ' HOH . 0.9 OUTLIER -70.16 -15.44 35.58 Favored 'Trans proline' 0 C--N 1.356 0.948 0 N-CA-C 113.744 0.632 . . . . 34.579999999999998 113.744 -162.766 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 6.7 p -77.0 -26.51 53.95 Favored 'General case' 0 CA--C 1.546 0.797 0 N-CA-C 112.45 0.537 . . . . 32.340000000000003 112.45 176.051 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 89.1 mttt -71.16 -45.95 14.29 Favored Pre-proline 0 N--CA 1.483 1.197 0 N-CA-C 116.217 1.932 . . . . 30.800000000000001 116.217 -167.863 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 80.2 Cg_exo -56.65 -38.82 94.79 Favored 'Trans proline' 0 N--CA 1.453 -0.895 0 CA-C-O 118.566 -0.681 . . . . 23.91 111.819 174.601 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' LYS . . . . . 0.983 ' HE2' ' O ' ' A' ' 193' ' ' HOH . 0.0 OUTLIER -58.13 -36.73 73.38 Favored 'General case' 0 C--O 1.194 -1.842 0 O-C-N 123.565 0.541 . . . . 32.229999999999997 110.34 178.586 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 39.3 mmt -79.07 -27.67 43.05 Favored 'General case' 0 C--O 1.258 1.545 0 CA-C-O 121.877 0.846 . . . . 28.77 112.01 -178.29 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 95.9 mtp -80.41 -42.37 22.87 Favored 'General case' 0 C--O 1.201 -1.47 0 CA-C-N 115.174 -0.921 . . . . 25.75 110.834 -171.841 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 21.5 m -52.53 -49.73 84.23 Favored Pre-proline 0 C--N 1.317 -0.807 0 N-CA-C 114.239 1.2 . . . . 18.140000000000001 114.239 -172.554 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo -64.51 -30.43 61.57 Favored 'Trans proline' 0 N--CA 1.445 -1.334 0 C-N-CA 115.909 -2.261 . . . . 19.600000000000001 111.708 -176.869 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 79.0 mtp180 -71.29 -42.64 68.44 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-O 118.952 -0.547 . . . . 24.870000000000001 112.267 176.526 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 65.1 mt -61.71 -49.28 84.95 Favored 'Isoleucine or valine' 0 C--O 1.261 1.688 0 O-C-N 124.58 1.175 . . . . 16.350000000000001 109.599 178.995 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -61.31 -44.44 97.2 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-O 118.092 -0.956 . . . . 16.890000000000001 110.334 179.985 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -58.63 -44.79 90.14 Favored 'General case' 0 C--N 1.358 0.966 0 CA-C-N 119.513 1.051 . . . . 14.48 112.064 177.202 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -60.69 -40.47 92.3 Favored 'General case' 0 C--O 1.243 0.731 0 O-C-N 121.5 -0.75 . . . . 14.699999999999999 111.668 178.247 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 27.4 mm -66.22 -42.55 91.22 Favored 'Isoleucine or valine' 0 N--CA 1.517 2.893 0 CA-C-O 123.198 1.475 . . . . 28.399999999999999 110.633 177.516 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 92.0 m -60.45 -45.18 94.62 Favored 'General case' 0 C--O 1.27 2.142 0 C-N-CA 115.926 -2.31 . . . . 16.300000000000001 113.403 177.904 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 13.8 tttt -62.2 -45.24 94.25 Favored 'General case' 0 C--N 1.319 -0.721 0 O-C-N 119.875 -1.766 . . . . 32.490000000000002 113.108 177.788 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 67.6 mm-40 -83.94 -27.45 28.52 Favored 'General case' 0 CA--C 1.507 -0.677 0 C-N-CA 115.792 -2.363 . . . . 20.620000000000001 109.519 -172.076 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 27.3 m -118.49 -7.18 10.67 Favored 'General case' 0 N--CA 1.502 2.155 0 N-CA-C 117.035 2.235 . . . . 25.41 117.035 -170.226 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 74.43 8.86 81.1 Favored Glycine 0 CA--C 1.54 1.601 0 C-N-CA 120.986 -0.626 . . . . 17.91 112.503 179.071 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 96.6 mt -82.59 124.74 77.3 Favored Pre-proline 0 C--O 1.177 -2.721 0 N-CA-C 107.75 -1.204 . . . . 16.969999999999999 107.75 -179.544 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_endo -72.02 150.09 53.92 Favored 'Trans proline' 0 N--CA 1.488 1.176 0 N-CA-C 108.155 -1.517 . . . . 19.190000000000001 108.155 -176.121 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' ALA . . . . . 0.45 ' HA ' HD12 ' A' ' 95' ' ' ILE . . . -56.76 -30.12 63.28 Favored 'General case' 0 N--CA 1.441 -0.9 0 C-N-CA 120.083 -0.647 . . . . 17.600000000000001 112.687 -177.825 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 20.5 pm0 -67.9 -6.08 20.08 Favored 'General case' 0 C--O 1.25 1.089 0 N-CA-C 114.151 1.167 . . . . 39.609999999999999 114.151 -179.001 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 64.3 mtp85 -119.45 32.92 5.85 Favored 'General case' 0 N--CA 1.5 2.061 0 C-N-CA 118.61 -1.236 . . . . 16.260000000000002 110.056 173.752 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' ILE . . . . . 0.45 HD12 ' HA ' ' A' ' 92' ' ' ALA . 96.9 mt -121.75 122.49 67.05 Favored 'Isoleucine or valine' 0 C--O 1.256 1.429 0 N-CA-C 108.074 -1.084 . . . . 15.460000000000001 108.074 178.826 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 1.9 m-30 -107.2 134.3 50.5 Favored 'General case' 0 C--O 1.261 1.67 0 N-CA-C 108.397 -0.964 . . . . 22.32 108.397 174.631 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 18.1 t -124.84 124.51 68.03 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.479 0 N-CA-C 108.341 -0.985 . . . . 16.039999999999999 108.341 172.995 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 26.1 m-85 -119.48 140.82 49.84 Favored 'General case' 0 C--O 1.219 -0.545 0 O-C-N 123.235 0.334 . . . . 22.449999999999999 111.089 176.951 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 5.0 m-85 -116.57 130.26 56.64 Favored 'General case' 0 C--O 1.283 2.824 0 CA-C-O 122.544 1.164 . . . . 17.09 109.466 -177.86 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 93.6 m-85 -127.12 161.4 28.56 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-O 122.424 1.107 . . . . 21.289999999999999 109.752 175.453 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 84.1 p -148.97 166.2 29.33 Favored 'General case' 0 C--N 1.309 -1.19 0 C-N-CA 118.262 -1.375 . . . . 23.789999999999999 110.087 173.107 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 2.2 t -146.74 161.22 41.07 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 107.532 -1.284 . . . . 22.010000000000002 107.532 -177.148 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' LYS . . . . . 0.422 ' HE3' ' HB3' ' A' ' 103' ' ' LYS . 17.7 mtpp -92.74 -11.22 34.46 Favored 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 109.155 -0.683 . . . . 41.119999999999997 109.155 171.46 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 93.6 m-70 -116.86 110.37 18.26 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 115.874 -0.603 . . . . 26.510000000000002 112.619 -177.782 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' CYS . . . . . 0.495 ' SG ' ' HB2' ' A' ' 65' ' ' TRP . 30.8 p -164.4 150.88 11.02 Favored 'General case' 0 C--O 1.255 1.368 0 N-CA-C 104.993 -2.225 . . . . 32.310000000000002 104.993 179.686 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 106' ' ' GLY . . . . . 0.488 ' HA2' ' HA ' ' A' ' 111' ' ' ASN . . . -143.68 149.69 21.67 Favored Glycine 0 C--N 1.341 0.856 0 C-N-CA 123.737 0.684 . . . . 25.579999999999998 112.815 -160.775 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 107' ' ' TRP . . . . . 1.156 ' CE3' ' O ' ' A' ' 136' ' ' HOH . 18.1 t90 -157.65 144.02 17.76 Favored 'General case' 0 CA--C 1.484 -1.581 0 N-CA-C 104.12 -2.548 . . . . 32.740000000000002 104.12 -170.523 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 16.2 t-20 53.41 32.67 14.33 Favored 'General case' 0 N--CA 1.416 -2.129 0 CA-C-N 113.226 -1.806 . . . . 36.060000000000002 107.03 -179.039 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 76.82 21.63 73.92 Favored Glycine 0 CA--C 1.543 1.84 0 O-C-N 124.972 1.42 . . . . 29.52 115.642 169.09 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -151.24 130.88 13.08 Favored 'General case' 0 C--O 1.247 0.932 0 N-CA-C 106.289 -1.745 . . . . 32.189999999999998 106.289 -170.103 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 111' ' ' ASN . . . . . 0.488 ' HA ' ' HA2' ' A' ' 106' ' ' GLY . 11.7 m-20 -72.87 150.9 42.25 Favored 'General case' 0 N--CA 1.472 0.651 0 O-C-N 124.176 0.922 . . . . 30.41 113.043 -179.25 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 65.3 t80 . . . . . 0 C--O 1.247 0.957 0 N-CA-C 106.095 -1.817 . . . . 40.369999999999997 106.095 -173.325 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 128' ' ' HOH . . . . . 0.48 ' O ' ' HB ' ' A' ' 40' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 135' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 136' ' ' HOH . . . . . 1.156 ' O ' ' CE3' ' A' ' 107' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 137' ' ' HOH . . . . . 0.495 ' O ' ' HG3' ' A' ' 14' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 138' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 139' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 140' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 141' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 142' ' ' HOH . . . . . 0.882 ' O ' ' CD ' ' A' ' 4' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 143' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 144' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 145' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 146' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 147' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 148' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 149' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 150' ' ' HOH . . . . . 0.64 ' O ' ' HG2' ' A' ' 25' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 151' ' ' HOH . . . . . 0.725 ' O ' ' HE3' ' A' ' 15' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 152' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 153' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 154' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 155' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 156' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 157' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 158' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 159' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 160' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 161' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 162' ' ' HOH . . . . . 0.908 ' O ' ' HD2' ' A' ' 70' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 163' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 164' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 165' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 166' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 167' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 168' ' ' HOH . . . . . 0.507 ' O ' ' HB3' ' A' ' 30' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 169' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 170' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 171' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 172' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 173' ' ' HOH . . . . . 1.078 ' O ' ' HB2' ' A' ' 67' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 174' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 175' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 176' ' ' HOH . . . . . 0.471 ' O ' ' NH2' ' A' ' 28' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 177' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 178' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 179' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 180' ' ' HOH . . . . . 1.257 ' O ' ' HA2' ' A' ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 181' ' ' HOH . . . . . 0.588 ' O ' ' HA ' ' A' ' 70' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 182' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 183' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 184' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 185' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 186' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 187' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 188' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 189' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 190' ' ' HOH . . . . . 0.581 ' O ' ' HE3' ' A' ' 25' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 191' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 192' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 193' ' ' HOH . . . . . 0.983 ' O ' ' HE2' ' A' ' 74' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 194' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 195' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 196' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 197' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 198' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 199' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 200' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' -3' ' ' GLY . . . . . 1.257 ' HA2' ' O ' ' A' ' 180' ' ' HOH . . . . . . . . 0 C--O 1.179 -3.333 0 N-CA-C 110.849 -0.9 . . . . 35.159999999999997 110.849 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' -2' ' ' SER . . . . . . . . . . . . . 5.6 m -107.6 132.48 53.24 Favored 'General case' 0 C--N 1.313 -0.989 0 N-CA-C 113.007 0.743 . . . . 34.68 113.007 -177.296 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' -1' ' ' HIS . . . . . . . . . . . . . 89.4 m-70 -138.61 165.81 25.96 Favored 'General case' 0 C--O 1.175 -2.862 0 N-CA-C 114.638 1.347 . . . . 41.530000000000001 114.638 -174.474 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 0' ' ' MET . . . . . 0.466 ' CE ' ' HB3' ' A' ' 107' ' ' TRP . 26.5 mtt 50.97 51.69 10.94 Favored Pre-proline 0 C--N 1.302 -1.496 0 N-CA-C 114.938 1.459 . . . . 40.310000000000002 114.938 175.729 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_endo -68.58 137.12 38.24 Favored 'Trans proline' 0 C--O 1.259 1.554 0 O-C-N 122.165 0.56 . . . . 22.170000000000002 111.621 -171.803 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 60.3 t80 -124.54 133.07 53.42 Favored 'General case' 0 N--CA 1.505 2.287 0 N-CA-C 106.809 -1.552 . . . . 17.690000000000001 106.809 176.72 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 6.2 mp -123.05 127.21 48.46 Favored 'General case' 0 C--O 1.271 2.208 0 N-CA-C 108.671 -0.862 . . . . 14.26 108.671 172.693 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.882 ' CD ' ' O ' ' A' ' 142' ' ' HOH . 66.8 tt0 -104.53 122.76 46.24 Favored 'General case' 0 N--CA 1.473 0.68 0 O-C-N 125.878 1.987 . . . . 16.539999999999999 113.723 164.264 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 25.6 m -108.72 121.73 45.65 Favored 'General case' 0 N--CA 1.429 -1.496 0 N-CA-C 103.726 -2.694 . . . . 13.02 103.726 -177.14 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 14.5 mt -113.48 117.9 56.71 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.296 0 C-N-CA 126.097 1.759 . . . . 13.59 106.76 175.777 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 17.1 m -131.92 144.04 38.42 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.231 0 O-C-N 124.803 1.314 . . . . 11.34 111.889 -178.12 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 20.6 p -82.18 -15.18 54.14 Favored 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 113.956 1.095 . . . . 12.67 113.956 177.894 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 4.2 m -82.01 168.03 1.91 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.728 0 N-CA-C 113.6 0.963 . . . . 13.41 113.6 172.117 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 27.6 t -90.26 141.15 29.0 Favored 'General case' 0 N--CA 1.436 -1.143 0 N-CA-C 107.933 -1.136 . . . . 20.370000000000001 107.933 177.489 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 98.7 mt -116.31 152.57 33.59 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 103.457 -2.794 . . . . 19.239999999999998 103.457 -178.918 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 29.5 p30 -112.89 -178.42 3.38 Favored 'General case' 0 CA--C 1.497 -1.075 0 C-N-CA 117.962 -1.495 . . . . 17.68 108.658 171.946 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 58.1 m-20 -58.03 -38.08 75.57 Favored 'General case' 0 CA--C 1.566 1.581 0 N-CA-C 118.432 2.753 . . . . 20.870000000000001 118.432 177.617 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' GLN . . . . . 0.495 ' HG3' ' O ' ' A' ' 137' ' ' HOH . 43.4 mt-30 -63.0 -45.71 91.08 Favored 'General case' 0 C--O 1.274 2.378 0 CA-C-O 123.696 1.712 . . . . 23.949999999999999 110.932 179.224 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.725 ' HE3' ' O ' ' A' ' 151' ' ' HOH . 19.3 mttp -68.83 -39.77 79.8 Favored 'General case' 0 N--CA 1.424 -1.773 0 CA-C-N 113.697 -1.592 . . . . 31.420000000000002 111.396 -178.902 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 67.4 mtm-85 -65.9 -41.62 91.25 Favored 'General case' 0 CA--C 1.508 -0.643 0 C-N-CA 115.062 -2.655 . . . . 15.73 112.26 172.74 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.89 -38.65 82.85 Favored 'General case' 0 CA--C 1.568 1.664 0 C-N-CA 118.031 -1.468 . . . . 13.359999999999999 112.088 177.858 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 87.9 m-20 -67.77 -42.92 80.94 Favored 'General case' 0 C--O 1.243 0.724 0 O-C-N 120.97 -1.081 . . . . 21.66 112.265 178.269 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 78.9 mt -59.61 -49.89 76.01 Favored 'General case' 0 N--CA 1.449 -0.523 0 N-CA-C 113.487 0.921 . . . . 14.69 113.487 172.814 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' SER . . . . . 0.771 ' OG ' HG21 ' A' ' 40' ' ' THR . 37.9 m -53.95 -44.65 70.87 Favored 'General case' 0 CA--C 1.567 1.62 0 CA-C-O 121.886 0.851 . . . . 16.27 111.758 177.014 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -56.59 -49.11 75.87 Favored 'General case' 0 N--CA 1.515 2.816 0 CA-C-N 115.397 -0.819 . . . . 16.800000000000001 112.063 174.891 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.01 -50.67 67.6 Favored 'General case' 0 CA--C 1.497 -1.083 0 N-CA-C 115.124 1.527 . . . . 19.359999999999999 115.124 179.775 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 21.3 m-30 -50.22 -39.67 45.16 Favored 'General case' 0 C--O 1.203 -1.361 0 N-CA-C 113.6 0.963 . . . . 20.57 113.6 171.793 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -65.07 -45.9 90.4 Favored Glycine 0 C--O 1.193 -2.413 0 N-CA-C 108.337 -1.905 . . . . 23.02 108.337 -175.032 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' MET . . . . . 0.64 ' HG2' ' O ' ' A' ' 150' ' ' HOH . 4.2 mtm -60.71 -52.59 64.48 Favored 'General case' 0 N--CA 1.443 -0.795 0 CA-C-N 117.457 0.628 . . . . 39.640000000000001 111.846 176.656 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 64.7 mt -53.55 -44.36 56.47 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.328 0 CA-C-N 116.355 -0.384 . . . . 21.010000000000002 111.908 178.768 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 61.2 m -65.32 -47.45 76.5 Favored 'General case' 0 CA--C 1.539 0.527 0 O-C-N 123.645 0.591 . . . . 25.219999999999999 112.359 177.124 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.471 ' NH2' ' O ' ' A' ' 176' ' ' HOH . 29.5 mtt180 -59.9 -48.62 80.93 Favored 'General case' 0 N--CA 1.441 -0.921 0 C-N-CA 118.393 -1.323 . . . . 45.630000000000003 113.851 178.29 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 65.3 mt-10 -72.51 -39.64 67.44 Favored 'General case' 0 C--O 1.254 1.317 0 N-CA-C 114.742 1.386 . . . . 35.340000000000003 114.742 -178.559 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.507 ' HB3' ' O ' ' A' ' 168' ' ' HOH . 30.8 mm-40 -98.5 -22.63 15.91 Favored 'General case' 0 C--O 1.204 -1.294 0 C-N-CA 118.513 -1.275 . . . . 32.560000000000002 114.387 -173.033 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.412 HD12 ' HA ' ' A' ' 31' ' ' LEU . 11.8 tp -100.6 -26.85 13.68 Favored 'General case' 0 CA--C 1.505 -0.778 0 C-N-CA 117.874 -1.531 . . . . 42.719999999999999 109.734 -166.237 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 159.09 -91.01 0.11 Allowed Glycine 0 CA--C 1.5 -0.867 0 C-N-CA 119.876 -1.155 . . . . 50.149999999999999 113.791 175.999 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 16.3 mttp -94.01 131.61 31.33 Favored Pre-proline 0 CA--C 1.557 1.212 0 N-CA-C 119.486 3.143 . . . . 56.920000000000002 119.486 -160.243 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -52.88 -63.79 0.22 Allowed 'Trans proline' 0 CA--C 1.536 0.611 0 N-CA-C 110.593 -0.58 . . . . 54.490000000000002 110.593 -177.87 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.744 ' OE2' ' O ' ' A' ' 35' ' ' GLU . 1.1 tp10 -64.15 4.27 0.35 Allowed 'General case' 0 CA--C 1.559 1.317 0 N-CA-C 113.451 0.908 . . . . 59.850000000000001 113.451 -173.967 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 62.2 m-20 -51.89 152.51 2.98 Favored 'General case' 0 C--O 1.25 1.117 0 N-CA-C 114.605 1.335 . . . . 54.490000000000002 114.605 -177.491 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.598 ' CE2' ' OE2' ' A' ' 35' ' ' GLU 0.53 34.7 m-85 -116.44 148.73 40.43 Favored 'General case' 0 C--O 1.203 -1.366 0 C-N-CA 117.754 -1.579 . . . . 51.859999999999999 114.978 169.614 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 73.1 t -135.08 130.16 51.45 Favored 'Isoleucine or valine' 0 CA--C 1.492 -1.272 0 N-CA-C 108.764 -0.828 . . . . 24.829999999999998 108.764 -162.842 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 56.1 ttm -103.09 136.77 42.28 Favored 'General case' 0 C--O 1.211 -0.947 0 C-N-CA 118.458 -1.297 . . . . 14.24 109.295 -179.693 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' THR . . . . . 0.771 HG21 ' OG ' ' A' ' 20' ' ' SER 0.33 0.8 OUTLIER -136.7 112.78 9.72 Favored 'General case' 0 N--CA 1.433 -1.293 0 O-C-N 121.342 -0.849 . . . . 18.109999999999999 108.709 -168.533 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -107.77 140.39 40.91 Favored 'General case' 0 C--O 1.182 -2.49 0 CA-C-O 117.621 -1.18 . . . . 11.279999999999999 109.702 -178.091 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' PHE . . . . . 0.537 ' CE1' HG23 ' A' ' 40' ' ' THR . 85.9 m-85 -123.77 109.59 13.85 Favored 'General case' 0 C--O 1.267 1.99 0 C-N-CA 124.169 0.987 . . . . 18.52 109.914 -176.175 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 19.4 m -101.84 97.11 7.53 Favored 'General case' 0 C--O 1.219 -0.545 0 O-C-N 124.867 1.354 . . . . 14.279999999999999 108.853 171.136 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 18.3 p-10 -93.57 177.46 6.01 Favored 'General case' 0 N--CA 1.487 1.387 0 CA-C-O 119.11 -0.471 . . . . 18.539999999999999 111.374 -178.559 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 26.1 mtmm 53.84 30.96 12.26 Favored 'General case' 0 N--CA 1.447 -0.587 0 N-CA-C 113.119 0.785 . . . . 37.43 113.119 179.713 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 68.7 m -104.03 113.93 64.89 Favored Pre-proline 0 N--CA 1.491 1.62 0 N-CA-C 104.114 -2.55 . . . . 11.49 104.114 -176.9 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 84.2 Cg_exo -59.28 139.76 91.49 Favored 'Trans proline' 0 C--O 1.201 -1.335 0 C-N-CA 114.724 -3.051 . . . . 11.859999999999999 113.986 -179.045 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 78.3 mt -133.3 133.09 58.17 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.18 0 N-CA-C 106.904 -1.517 . . . . 11.970000000000001 106.904 179.686 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 12.2 t -107.38 143.68 35.35 Favored 'General case' 0 C--N 1.318 -0.779 0 C-N-CA 117.218 -1.793 . . . . 15.470000000000001 111.462 173.809 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 31.0 t80 -163.09 134.01 4.75 Favored 'General case' 0 C--O 1.171 -3.043 0 C-N-CA 117.809 -1.556 . . . . 21.27 108.881 -179.107 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 67.1 mt-30 49.89 39.97 19.66 Favored 'General case' 0 C--O 1.218 -0.561 0 O-C-N 124.864 1.352 . . . . 34.869999999999997 112.131 -173.88 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 70.71 14.33 72.56 Favored Glycine 0 N--CA 1.489 2.216 0 N-CA-C 116.611 1.404 . . . . 20.800000000000001 116.611 179.603 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 47.6 t -129.94 142.47 50.64 Favored 'General case' 0 N--CA 1.417 -2.106 0 N-CA-C 108.176 -1.046 . . . . 17.129999999999999 108.176 -177.747 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 24.0 p -99.56 22.38 10.91 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 115.963 1.838 . . . . 19.010000000000002 115.963 163.365 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -60.98 161.55 15.47 Favored Pre-proline 0 C--N 1.354 0.768 0 C-N-CA 118.72 -1.192 . . . . 12.789999999999999 108.248 169.713 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_exo -49.08 128.84 20.4 Favored 'Trans proline' 0 C--O 1.252 1.18 0 C-N-CA 124.347 3.365 . . . . 13.07 110.042 -173.951 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -143.22 167.8 21.26 Favored 'General case' 0 CA--C 1.559 1.29 0 N-CA-C 107.254 -1.387 . . . . 12.529999999999999 107.254 175.761 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -138.49 153.24 48.78 Favored 'General case' 0 CA--C 1.507 -0.707 0 C-N-CA 119.794 -0.763 . . . . 15.109999999999999 111.027 -177.3 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 5.4 t80 -135.82 131.74 35.78 Favored 'General case' 0 C--O 1.265 1.878 0 N-CA-C 105.441 -2.059 . . . . 21.379999999999999 105.441 170.483 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 98.4 t -121.8 129.75 75.19 Favored 'Isoleucine or valine' 0 C--O 1.266 1.954 0 CA-C-O 118.198 -0.906 . . . . 13.42 111.04 176.611 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.72 ' NE ' ' OE1' ' A' ' 63' ' ' GLU . 27.6 ttp-105 -108.69 121.57 45.31 Favored 'General case' 0 C--N 1.353 0.746 0 N-CA-C 106.222 -1.769 . . . . 26.960000000000001 106.222 -179.864 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 31.8 t -108.73 130.24 61.89 Favored 'Isoleucine or valine' 0 C--N 1.342 0.259 0 N-CA-C 105.186 -2.153 . . . . 13.91 105.186 -177.868 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.72 ' OE1' ' NE ' ' A' ' 61' ' ' ARG . 63.0 mt-10 -129.99 152.01 49.92 Favored 'General case' 0 C--N 1.323 -0.556 0 O-C-N 123.874 0.734 . . . . 27.050000000000001 109.735 -177.857 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 72.8 p -167.79 160.2 12.31 Favored 'General case' 0 C--O 1.213 -0.818 0 C-N-CA 116.503 -2.079 . . . . 23.48 107.448 178.296 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' TRP . . . . . 0.495 ' HB2' ' SG ' ' A' ' 105' ' ' CYS . 92.5 t90 -70.88 139.09 50.7 Favored 'General case' 0 C--O 1.245 0.86 0 CA-C-O 121.029 0.442 . . . . 37.450000000000003 111.722 174.089 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 100.91 -134.9 11.87 Favored Glycine 0 C--O 1.261 1.844 0 CA-C-N 115.555 -0.748 . . . . 31.870000000000001 112.563 171.858 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' GLU . . . . . 1.078 ' HB2' ' O ' ' A' ' 173' ' ' HOH . 11.8 pt-20 -150.53 154.21 37.19 Favored 'General case' 0 CA--C 1.502 -0.893 0 C-N-CA 120.464 -0.495 . . . . 44.07 109.676 167.513 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 95.6 m-85 -76.63 134.5 39.3 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 124.803 1.241 . . . . 32.460000000000001 113.353 -172.321 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -62.81 135.14 95.8 Favored Pre-proline 0 CA--C 1.545 0.764 0 N-CA-C 105.657 -1.979 . . . . 33.369999999999997 105.657 161.777 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' PRO . . . . . 0.908 ' HD2' ' O ' ' A' ' 162' ' ' HOH . 0.9 OUTLIER -70.16 -15.44 35.58 Favored 'Trans proline' 0 C--N 1.356 0.948 0 N-CA-C 113.744 0.632 . . . . 34.579999999999998 113.744 -162.766 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 6.7 p -77.0 -26.51 53.95 Favored 'General case' 0 CA--C 1.546 0.797 0 N-CA-C 112.45 0.537 . . . . 32.340000000000003 112.45 176.051 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 89.1 mttt -71.16 -45.95 14.29 Favored Pre-proline 0 N--CA 1.483 1.197 0 N-CA-C 116.217 1.932 . . . . 30.800000000000001 116.217 -167.863 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 80.2 Cg_exo -56.65 -38.82 94.79 Favored 'Trans proline' 0 N--CA 1.453 -0.895 0 CA-C-O 118.566 -0.681 . . . . 23.91 111.819 174.601 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.983 ' HE2' ' O ' ' A' ' 193' ' ' HOH . 0.0 OUTLIER -58.13 -36.73 73.38 Favored 'General case' 0 C--O 1.194 -1.842 0 O-C-N 123.565 0.541 . . . . 32.229999999999997 110.34 178.586 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 39.3 mmt -79.07 -27.67 43.05 Favored 'General case' 0 C--O 1.258 1.545 0 CA-C-O 121.877 0.846 . . . . 28.77 112.01 -178.29 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 95.9 mtp -80.41 -42.37 22.87 Favored 'General case' 0 C--O 1.201 -1.47 0 CA-C-N 115.174 -0.921 . . . . 25.75 110.834 -171.841 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 21.5 m -52.53 -49.73 84.23 Favored Pre-proline 0 C--N 1.317 -0.807 0 N-CA-C 114.239 1.2 . . . . 18.140000000000001 114.239 -172.554 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo -64.51 -30.43 61.57 Favored 'Trans proline' 0 N--CA 1.445 -1.334 0 C-N-CA 115.909 -2.261 . . . . 19.600000000000001 111.708 -176.869 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 79.0 mtp180 -71.29 -42.64 68.44 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-O 118.952 -0.547 . . . . 24.870000000000001 112.267 176.526 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 65.1 mt -61.71 -49.28 84.95 Favored 'Isoleucine or valine' 0 C--O 1.261 1.688 0 O-C-N 124.58 1.175 . . . . 16.350000000000001 109.599 178.995 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -61.31 -44.44 97.2 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-O 118.092 -0.956 . . . . 16.890000000000001 110.334 179.985 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -58.63 -44.79 90.14 Favored 'General case' 0 C--N 1.358 0.966 0 CA-C-N 119.513 1.051 . . . . 14.48 112.064 177.202 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -60.69 -40.47 92.3 Favored 'General case' 0 C--O 1.243 0.731 0 O-C-N 121.5 -0.75 . . . . 14.699999999999999 111.668 178.247 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 27.4 mm -66.22 -42.55 91.22 Favored 'Isoleucine or valine' 0 N--CA 1.517 2.893 0 CA-C-O 123.198 1.475 . . . . 28.399999999999999 110.633 177.516 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 92.0 m -60.45 -45.18 94.62 Favored 'General case' 0 C--O 1.27 2.142 0 C-N-CA 115.926 -2.31 . . . . 16.300000000000001 113.403 177.904 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 13.8 tttt -62.2 -45.24 94.25 Favored 'General case' 0 C--N 1.319 -0.721 0 O-C-N 119.875 -1.766 . . . . 32.490000000000002 113.108 177.788 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 67.6 mm-40 -83.94 -27.45 28.52 Favored 'General case' 0 CA--C 1.507 -0.677 0 C-N-CA 115.792 -2.363 . . . . 20.620000000000001 109.519 -172.076 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 27.3 m -118.49 -7.18 10.67 Favored 'General case' 0 N--CA 1.502 2.155 0 N-CA-C 117.035 2.235 . . . . 25.41 117.035 -170.226 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 74.43 8.86 81.1 Favored Glycine 0 CA--C 1.54 1.601 0 C-N-CA 120.986 -0.626 . . . . 17.91 112.503 179.071 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 96.6 mt -82.59 124.74 77.3 Favored Pre-proline 0 C--O 1.177 -2.721 0 N-CA-C 107.75 -1.204 . . . . 16.969999999999999 107.75 -179.544 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_endo -72.02 150.09 53.92 Favored 'Trans proline' 0 N--CA 1.488 1.176 0 N-CA-C 108.155 -1.517 . . . . 19.190000000000001 108.155 -176.121 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' ALA . . . . . 0.45 ' HA ' HD12 ' A' ' 95' ' ' ILE . . . -56.76 -30.12 63.28 Favored 'General case' 0 N--CA 1.441 -0.9 0 C-N-CA 120.083 -0.647 . . . . 17.600000000000001 112.687 -177.825 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 20.5 pm0 -67.9 -6.08 20.08 Favored 'General case' 0 C--O 1.25 1.089 0 N-CA-C 114.151 1.167 . . . . 39.609999999999999 114.151 -179.001 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 64.3 mtp85 -119.45 32.92 5.85 Favored 'General case' 0 N--CA 1.5 2.061 0 C-N-CA 118.61 -1.236 . . . . 16.260000000000002 110.056 173.752 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' ILE . . . . . 0.45 HD12 ' HA ' ' A' ' 92' ' ' ALA . 96.9 mt -121.75 122.49 67.05 Favored 'Isoleucine or valine' 0 C--O 1.256 1.429 0 N-CA-C 108.074 -1.084 . . . . 15.460000000000001 108.074 178.826 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 1.9 m-30 -107.2 134.3 50.5 Favored 'General case' 0 C--O 1.261 1.67 0 N-CA-C 108.397 -0.964 . . . . 22.32 108.397 174.631 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 18.1 t -124.84 124.51 68.03 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.479 0 N-CA-C 108.341 -0.985 . . . . 16.039999999999999 108.341 172.995 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 26.1 m-85 -119.48 140.82 49.84 Favored 'General case' 0 C--O 1.219 -0.545 0 O-C-N 123.235 0.334 . . . . 22.449999999999999 111.089 176.951 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 5.0 m-85 -116.57 130.26 56.64 Favored 'General case' 0 C--O 1.283 2.824 0 CA-C-O 122.544 1.164 . . . . 17.09 109.466 -177.86 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 93.6 m-85 -127.12 161.4 28.56 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-O 122.424 1.107 . . . . 21.289999999999999 109.752 175.453 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 84.1 p -148.97 166.2 29.33 Favored 'General case' 0 C--N 1.309 -1.19 0 C-N-CA 118.262 -1.375 . . . . 23.789999999999999 110.087 173.107 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 2.2 t -146.74 161.22 41.07 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 107.532 -1.284 . . . . 22.010000000000002 107.532 -177.148 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' LYS . . . . . 0.422 ' HE3' ' HB3' ' A' ' 103' ' ' LYS . 17.7 mtpp -92.74 -11.22 34.46 Favored 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 109.155 -0.683 . . . . 41.119999999999997 109.155 171.46 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' HIS . . . . . 0.558 ' HD2' ' O ' ' A' ' 160' ' ' HOH . 40.0 m80 -116.86 110.37 18.26 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 115.874 -0.603 . . . . 26.510000000000002 112.619 -177.782 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' CYS . . . . . 0.495 ' SG ' ' HB2' ' A' ' 65' ' ' TRP . 30.8 p -164.4 150.88 11.02 Favored 'General case' 0 C--O 1.255 1.368 0 N-CA-C 104.993 -2.225 . . . . 32.310000000000002 104.993 179.686 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' GLY . . . . . 0.488 ' HA2' ' HA ' ' A' ' 111' ' ' ASN . . . -143.68 149.69 21.67 Favored Glycine 0 C--N 1.341 0.856 0 C-N-CA 123.737 0.684 . . . . 25.579999999999998 112.815 -160.775 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' TRP . . . . . 1.156 ' CE3' ' O ' ' A' ' 136' ' ' HOH . 18.1 t90 -157.65 144.02 17.76 Favored 'General case' 0 CA--C 1.484 -1.581 0 N-CA-C 104.12 -2.548 . . . . 32.740000000000002 104.12 -170.523 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 16.2 t-20 53.41 32.67 14.33 Favored 'General case' 0 N--CA 1.416 -2.129 0 CA-C-N 113.226 -1.806 . . . . 36.060000000000002 107.03 -179.039 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 76.82 21.63 73.92 Favored Glycine 0 CA--C 1.543 1.84 0 O-C-N 124.972 1.42 . . . . 29.52 115.642 169.09 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -151.24 130.88 13.08 Favored 'General case' 0 C--O 1.247 0.932 0 N-CA-C 106.289 -1.745 . . . . 32.189999999999998 106.289 -170.103 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' ASN . . . . . 0.488 ' HA ' ' HA2' ' A' ' 106' ' ' GLY . 1.2 m120 -72.87 150.9 42.25 Favored 'General case' 0 N--CA 1.472 0.651 0 O-C-N 124.176 0.922 . . . . 30.41 113.043 -179.25 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 65.3 t80 . . . . . 0 C--O 1.247 0.957 0 N-CA-C 106.095 -1.817 . . . . 40.369999999999997 106.095 -173.325 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' HOH . . . . . 0.48 ' O ' ' HB ' ' A' ' 40' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' HOH . . . . . 1.156 ' O ' ' CE3' ' A' ' 107' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 137' ' ' HOH . . . . . 0.495 ' O ' ' HG3' ' A' ' 14' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 138' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 139' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 140' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 141' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 142' ' ' HOH . . . . . 0.882 ' O ' ' CD ' ' A' ' 4' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 143' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 144' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 145' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 146' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 147' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 148' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 149' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 150' ' ' HOH . . . . . 0.64 ' O ' ' HG2' ' A' ' 25' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 151' ' ' HOH . . . . . 0.725 ' O ' ' HE3' ' A' ' 15' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 152' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 153' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 154' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 155' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 156' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 157' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 158' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 159' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 160' ' ' HOH . . . . . 0.558 ' O ' ' HD2' ' A' ' 104' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 161' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 162' ' ' HOH . . . . . 0.908 ' O ' ' HD2' ' A' ' 70' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 163' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 164' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 165' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 166' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 167' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 168' ' ' HOH . . . . . 0.507 ' O ' ' HB3' ' A' ' 30' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 169' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 170' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 171' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 172' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 173' ' ' HOH . . . . . 1.078 ' O ' ' HB2' ' A' ' 67' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 174' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 175' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 176' ' ' HOH . . . . . 0.471 ' O ' ' NH2' ' A' ' 28' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 177' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 178' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 179' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 180' ' ' HOH . . . . . 1.257 ' O ' ' HA2' ' A' ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 181' ' ' HOH . . . . . 0.588 ' O ' ' HA ' ' A' ' 70' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 182' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 183' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 184' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 185' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 186' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 187' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 188' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 189' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 190' ' ' HOH . . . . . 0.581 ' O ' ' HE3' ' A' ' 25' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 191' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 192' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 193' ' ' HOH . . . . . 0.983 ' O ' ' HE2' ' A' ' 74' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 194' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 195' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 196' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 197' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 198' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 199' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 200' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_