data_3r65_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 3r65 _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 ' 18' ' ' VAL . . . . . . . . . . . . . 44.7 t . . . . . 0 N--CA 1.504 2.271 0 N-CA-C 110.322 -0.251 . . . . 38.520000000000003 110.322 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -59.83 137.54 77.21 Favored 'Trans proline' 0 C--N 1.352 0.76 0 C-N-CA 121.901 1.734 . . . . 35.520000000000003 112.34 -179.176 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -57.59 -37.08 72.6 Favored 'General case' 0 N--CA 1.465 0.322 0 N-CA-C 113.263 0.838 . . . . 32.329999999999998 113.263 -174.559 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 91.2 m -65.5 -35.73 81.75 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 120.731 -0.387 . . . . 29.449999999999999 110.765 178.186 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 63.3 ttt180 -66.71 -40.85 88.6 Favored 'General case' 0 N--CA 1.456 -0.168 0 C-N-CA 119.968 -0.693 . . . . 38.990000000000002 110.341 176.358 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 29.0 mm -60.45 -43.45 94.14 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 CA-C-N 116.383 -0.371 . . . . 29.25 111.216 174.456 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 57.3 tp -52.12 -51.6 56.8 Favored 'General case' 0 N--CA 1.468 0.434 0 N-CA-C 112.004 0.372 . . . . 26.239999999999998 112.004 172.196 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 56.8 mt -60.44 -38.83 85.38 Favored 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 112.694 0.628 . . . . 24.390000000000001 112.694 179.589 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 51.5 mt -64.29 -46.01 85.48 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.533 -0.303 . . . . 25.969999999999999 111.341 -179.774 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 2.8 p -66.65 -34.02 67.29 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.714 0 C-N-CA 120.111 -0.636 . . . . 22.949999999999999 111.804 177.722 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 91.6 mt -64.5 -41.84 96.19 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 120.562 -0.455 . . . . 25.34 110.818 175.709 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -59.9 -42.73 94.47 Favored 'General case' 0 C--O 1.217 -0.617 0 N-CA-C 111.903 0.334 . . . . 22.239999999999998 111.903 174.886 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 35.4 t -60.44 -43.86 95.01 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.497 0 CA-C-O 121.092 0.472 . . . . 23.98 111.011 175.92 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 34.9 mt -62.03 -46.58 96.16 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.504 0 CA-C-N 115.905 -0.589 . . . . 25.399999999999999 111.739 -179.92 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 78.7 mt -58.51 -49.08 83.54 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.898 0 CA-C-O 120.47 0.176 . . . . 25.34 111.316 174.82 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 81.0 t80 -54.89 -51.9 64.56 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 122.955 0.502 . . . . 30.739999999999998 112.092 177.455 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -61.55 -45.4 96.42 Favored Glycine 0 N--CA 1.468 0.783 0 O-C-N 123.152 0.283 . . . . 22.02 113.261 179.077 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 89.6 m -66.44 -51.53 55.91 Favored 'General case' 0 C--O 1.237 0.414 0 N-CA-C 112.28 0.474 . . . . 22.379999999999999 112.28 -176.241 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -62.4 -44.25 96.9 Favored 'General case' 0 N--CA 1.473 0.706 0 O-C-N 123.391 0.432 . . . . 23.649999999999999 111.184 179.787 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -58.23 -52.45 52.51 Favored Glycine 0 CA--C 1.524 0.616 0 CA-C-N 116.551 -0.295 . . . . 23.649999999999999 113.365 178.641 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 20.3 t80 -62.62 -41.17 98.86 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 117.062 0.431 . . . . 24.370000000000001 110.633 -179.743 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 69.8 t60 -60.07 -47.85 84.17 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 116.604 -0.271 . . . . 29.210000000000001 111.587 179.738 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 51.4 m-85 -79.18 -36.06 40.89 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 114.312 1.227 . . . . 32.189999999999998 114.312 -176.784 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 63.3 mt -80.25 -45.93 22.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 C-N-CA 120.85 -0.34 . . . . 27.760000000000002 111.615 -179.176 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 78.4 mm-40 -99.26 -15.47 18.86 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 114.607 1.336 . . . . 26.989999999999998 114.607 -175.099 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 82.61 16.82 69.84 Favored Glycine 0 C--O 1.225 -0.454 0 N-CA-C 116.14 1.216 . . . . 26.82 116.14 171.938 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 64.5 mm-40 -84.65 159.14 20.63 Favored 'General case' 0 CA--C 1.516 -0.327 0 CA-C-N 117.628 0.714 . . . . 27.649999999999999 109.457 178.209 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 59.6 p -57.2 157.63 6.02 Favored 'General case' 0 C--O 1.241 0.637 0 O-C-N 123.425 0.453 . . . . 26.140000000000001 111.82 178.886 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 98.5 m95 -55.37 -43.59 75.27 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 116.225 -0.443 . . . . 26.719999999999999 110.308 176.868 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 21.2 m -62.34 -51.03 69.25 Favored 'General case' 0 N--CA 1.467 0.393 0 N-CA-C 111.769 0.285 . . . . 26.57 111.769 -179.63 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 25.0 t -59.48 -39.75 80.05 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.447 0 CA-C-N 116.318 -0.401 . . . . 23.640000000000001 110.68 178.382 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 70.7 m -66.75 -39.83 88.05 Favored 'General case' 0 C--O 1.224 -0.279 0 C-N-CA 122.702 0.401 . . . . 22.41 111.895 -178.58 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 55.3 tp -64.41 -48.92 73.57 Favored 'General case' 0 C--O 1.238 0.456 0 O-C-N 123.342 0.401 . . . . 23.960000000000001 110.211 176.28 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 24.2 t80 -53.78 -51.86 62.07 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 115.817 -0.628 . . . . 19.800000000000001 111.825 174.709 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' TRP . . . . . . . . . . . . . 81.0 t90 -56.94 -41.04 77.54 Favored 'General case' 0 N--CA 1.47 0.527 0 N-CA-C 112.386 0.513 . . . . 18.440000000000001 112.386 176.965 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 54.0 m -58.98 -47.57 84.67 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 111.928 0.344 . . . . 17.84 111.928 178.281 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 10.7 m-85 -62.61 -48.4 79.57 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-O 121.007 0.432 . . . . 21.41 111.93 176.849 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 31.0 t -57.6 -35.37 50.07 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.66 0 CA-C-N 115.544 -0.753 . . . . 16.789999999999999 110.83 178.667 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 99.5 m -77.77 -53.14 7.87 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 113.616 0.969 . . . . 16.899999999999999 113.616 179.435 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 19.5 pt -70.38 -21.37 23.23 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.763 0 N-CA-C 113.588 0.958 . . . . 18.370000000000001 113.588 -177.044 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -80.82 -8.97 59.85 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-O 121.214 0.53 . . . . 17.149999999999999 110.046 174.252 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 3.9 p 70.02 17.54 7.36 Favored 'General case' 0 C--O 1.251 1.16 0 C-N-CA 126.236 1.814 . . . . 17.48 112.095 -177.996 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 86.6 t -65.58 -50.17 73.45 Favored 'Isoleucine or valine' 0 C--O 1.262 1.731 0 O-C-N 121.847 -0.533 . . . . 16.760000000000002 110.828 175.528 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 50.42 58.08 9.51 Favored Glycine 0 C--O 1.26 1.743 0 N-CA-C 116.104 1.202 . . . . 16.690000000000001 116.104 173.958 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 61.3 m-85 -51.78 -40.1 59.77 Favored 'General case' 0 C--O 1.243 0.76 0 CA-C-N 118.482 1.141 . . . . 18.539999999999999 112.771 178.953 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 89.68 1.44 77.33 Favored Glycine 0 N--CA 1.467 0.762 0 C-N-CA 120.429 -0.891 . . . . 18.309999999999999 111.851 -178.73 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 23.1 p-10 -61.48 -32.61 72.63 Favored 'General case' 0 C--O 1.24 0.579 0 N-CA-C 110.047 -0.353 . . . . 21.010000000000002 110.047 170.335 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 93.5 m-85 -127.05 139.77 52.77 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 124.182 0.993 . . . . 22.219999999999999 111.193 169.967 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 63.3 p -161.47 159.53 23.42 Favored Pre-proline 0 CA--C 1.539 0.526 0 CA-C-N 115.756 -0.656 . . . . 21.68 109.39 -179.411 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -72.06 140.59 34.83 Favored 'Trans proline' 0 C--N 1.352 0.712 0 C-N-CA 117.613 -1.125 . . . . 22.93 112.673 178.642 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 97.5 m-70 -116.37 5.76 13.58 Favored 'General case' 0 C--O 1.237 0.4 0 N-CA-C 112.45 0.537 . . . . 30.09 112.45 178.751 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 17.1 p -116.95 154.36 49.65 Favored Pre-proline 0 C--O 1.236 0.365 0 CA-C-N 116.426 -0.352 . . . . 27.449999999999999 111.196 175.744 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_exo -57.96 -37.49 95.84 Favored 'Trans proline' 0 C--N 1.349 0.577 0 O-C-N 122.24 0.6 . . . . 27.550000000000001 113.546 174.998 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 45.4 tp -66.01 -41.74 90.59 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 120.741 -0.383 . . . . 28.760000000000002 110.079 177.406 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -61.74 -39.52 97.55 Favored Glycine 0 N--CA 1.466 0.675 0 O-C-N 123.69 0.619 . . . . 24.829999999999998 111.565 179.046 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 66.5 mtt -65.14 -47.24 77.8 Favored 'General case' 0 C--O 1.237 0.404 0 N-CA-C 111.685 0.254 . . . . 25.100000000000001 111.685 178.208 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 53.7 t80 -58.03 -47.13 84.01 Favored 'General case' 0 C--O 1.242 0.681 0 CA-C-O 120.851 0.358 . . . . 35.479999999999997 111.312 174.696 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 20.9 t80 -59.18 -44.02 92.18 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.841 -0.618 . . . . 27.039999999999999 111.247 179.277 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 95.4 m -60.13 -42.99 95.97 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.1 -0.5 . . . . 21.219999999999999 112.269 178.404 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 72.9 m -59.5 -40.55 87.42 Favored 'General case' 0 N--CA 1.47 0.547 0 N-CA-C 111.98 0.363 . . . . 23.239999999999998 111.98 175.6 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 18.0 p -65.56 -42.34 91.96 Favored 'General case' 0 N--CA 1.463 0.192 0 C-N-CA 119.939 -0.705 . . . . 25.670000000000002 111.184 177.428 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 66.5 tp -62.06 -39.43 92.36 Favored 'General case' 0 N--CA 1.467 0.413 0 O-C-N 123.391 0.432 . . . . 21.420000000000002 111.401 177.831 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 25.5 mt -59.5 -50.97 77.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.669 -0.696 . . . . 23.050000000000001 109.174 178.073 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 40.1 t -65.94 -41.93 90.87 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.721 0 N-CA-C 112.641 0.608 . . . . 25.52 112.641 -177.573 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 96.8 mt -82.3 -25.56 33.86 Favored 'General case' 0 N--CA 1.465 0.292 0 N-CA-C 112.763 0.653 . . . . 29.300000000000001 112.763 -176.287 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -102.72 -34.1 4.2 Favored Glycine 0 N--CA 1.463 0.449 0 N-CA-C 117.101 1.6 . . . . 24.390000000000001 117.101 -167.937 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 41.8 mt -64.66 -44.78 96.64 Favored 'Isoleucine or valine' 0 C--O 1.242 0.694 0 N-CA-C 113.039 0.755 . . . . 26.239999999999998 113.039 -172.865 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -64.66 -46.92 88.56 Favored Glycine 0 C--O 1.24 0.505 0 N-CA-C 111.354 -0.698 . . . . 23.899999999999999 111.354 177.111 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 22.2 m -57.35 -47.76 80.77 Favored 'General case' 0 C--O 1.235 0.294 0 C-N-CA 123.226 0.61 . . . . 25.359999999999999 111.444 179.364 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 46.3 t80 -63.14 -42.01 99.39 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 112.237 0.458 . . . . 26.129999999999999 112.237 177.685 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -58.35 -44.17 88.65 Favored 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 112.143 0.423 . . . . 26.73 112.143 178.536 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 99.7 t -67.16 -42.03 87.62 Favored 'Isoleucine or valine' 0 C--O 1.237 0.427 0 CA-C-N 116.796 -0.184 . . . . 29.289999999999999 110.632 178.76 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -59.34 -44.33 92.64 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 113.975 1.102 . . . . 32.090000000000003 113.975 177.571 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 34.3 m -65.8 -39.26 84.27 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 C-N-CA 120.236 -0.586 . . . . 37.140000000000001 111.422 178.772 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 74.4 mt-30 -57.32 -47.45 81.5 Favored 'General case' 0 N--CA 1.467 0.387 0 O-C-N 123.371 0.419 . . . . 49.549999999999997 111.739 176.933 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 5.5 mmm180 -67.06 -35.99 81.06 Favored 'General case' 0 N--CA 1.465 0.3 0 N-CA-C 112.212 0.449 . . . . 52.039999999999999 112.212 178.689 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 43.4 tp -63.98 -37.6 88.02 Favored 'General case' 0 C--O 1.233 0.218 0 C-N-CA 121.439 -0.104 . . . . 49.560000000000002 111.252 177.431 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 12.5 mt -49.82 -51.28 41.03 Favored 'General case' 0 N--CA 1.468 0.441 0 O-C-N 123.689 0.618 . . . . 53.969999999999999 111.213 174.168 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 67.8 mt-10 -61.29 -40.12 92.96 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 112.76 0.652 . . . . 59.200000000000003 112.76 -177.786 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 62.5 m-85 -78.54 -16.95 56.89 Favored 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 113.652 0.982 . . . . 61.75 113.652 -179.179 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 98.0 mt -93.9 -28.56 15.76 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-O 120.72 0.295 . . . . 61.07 110.787 173.703 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 59.7 mt . . . . . 0 C--O 1.233 0.192 0 CA-C-N 115.959 -0.564 . . . . 62.32 109.85 179.911 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 1' ' ' ' K' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' ' K' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' ' K' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' ' K' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 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 build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 44.7 t . . . . . 0 N--CA 1.504 2.271 0 N-CA-C 110.322 -0.251 . . . . 38.52 110.322 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -59.83 137.54 77.21 Favored 'Trans proline' 0 C--N 1.352 0.76 0 C-N-CA 121.901 1.734 . . . . 35.52 112.34 -179.176 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -57.59 -37.08 72.6 Favored 'General case' 0 N--CA 1.465 0.322 0 N-CA-C 113.263 0.838 . . . . 32.33 113.263 -174.559 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 91.2 m -65.5 -35.73 81.75 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 120.731 -0.387 . . . . 29.45 110.765 178.186 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 63.3 ttt180 -66.71 -40.85 88.6 Favored 'General case' 0 N--CA 1.456 -0.168 0 C-N-CA 119.968 -0.693 . . . . 38.99 110.341 176.358 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 29.0 mm -60.45 -43.45 94.14 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 CA-C-N 116.383 -0.371 . . . . 29.25 111.216 174.456 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 57.3 tp -52.12 -51.6 56.8 Favored 'General case' 0 N--CA 1.468 0.434 0 N-CA-C 112.004 0.372 . . . . 26.24 112.004 172.196 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 56.8 mt -60.44 -38.83 85.38 Favored 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 112.694 0.628 . . . . 24.39 112.694 179.589 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 51.5 mt -64.29 -46.01 85.48 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.533 -0.303 . . . . 25.97 111.341 -179.774 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 2.8 p -66.65 -34.02 67.29 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.714 0 C-N-CA 120.111 -0.636 . . . . 22.95 111.804 177.722 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 91.6 mt -64.5 -41.84 96.19 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 120.562 -0.455 . . . . 25.34 110.818 175.709 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -59.9 -42.73 94.47 Favored 'General case' 0 C--O 1.217 -0.617 0 N-CA-C 111.903 0.334 . . . . 22.24 111.903 174.886 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 35.4 t -60.44 -43.86 95.01 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.497 0 CA-C-O 121.092 0.472 . . . . 23.98 111.011 175.92 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 34.9 mt -62.03 -46.58 96.16 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.504 0 CA-C-N 115.905 -0.589 . . . . 25.4 111.739 -179.92 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 78.7 mt -58.51 -49.08 83.54 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.898 0 CA-C-O 120.47 0.176 . . . . 25.34 111.316 174.82 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 81.0 t80 -54.89 -51.9 64.56 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 122.955 0.502 . . . . 30.74 112.092 177.455 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -61.55 -45.4 96.42 Favored Glycine 0 N--CA 1.468 0.783 0 O-C-N 123.152 0.283 . . . . 22.02 113.261 179.077 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 89.6 m -66.44 -51.53 55.91 Favored 'General case' 0 C--O 1.237 0.414 0 N-CA-C 112.28 0.474 . . . . 22.38 112.28 -176.241 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -62.4 -44.25 96.9 Favored 'General case' 0 N--CA 1.473 0.706 0 O-C-N 123.391 0.432 . . . . 23.65 111.184 179.787 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -58.23 -52.45 52.51 Favored Glycine 0 CA--C 1.524 0.616 0 CA-C-N 116.551 -0.295 . . . . 23.65 113.365 178.641 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 20.3 t80 -62.62 -41.17 98.86 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 117.062 0.431 . . . . 24.37 110.633 -179.743 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 69.8 t60 -60.07 -47.85 84.17 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 116.604 -0.271 . . . . 29.21 111.587 179.738 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 51.4 m-85 -79.18 -36.06 40.89 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 114.312 1.227 . . . . 32.19 114.312 -176.784 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 63.3 mt -80.25 -45.93 22.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 C-N-CA 120.85 -0.34 . . . . 27.76 111.615 -179.176 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 78.4 mm-40 -99.26 -15.47 18.86 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 114.607 1.336 . . . . 26.99 114.607 -175.099 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 82.61 16.82 69.84 Favored Glycine 0 C--O 1.225 -0.454 0 N-CA-C 116.14 1.216 . . . . 26.82 116.14 171.938 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 64.5 mm-40 -84.65 159.14 20.63 Favored 'General case' 0 CA--C 1.516 -0.327 0 CA-C-N 117.628 0.714 . . . . 27.65 109.457 178.209 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 59.6 p -57.2 157.63 6.02 Favored 'General case' 0 C--O 1.241 0.637 0 O-C-N 123.425 0.453 . . . . 26.14 111.82 178.886 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 98.5 m95 -55.37 -43.59 75.27 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 116.225 -0.443 . . . . 26.72 110.308 176.868 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 21.2 m -62.34 -51.03 69.25 Favored 'General case' 0 N--CA 1.467 0.393 0 N-CA-C 111.769 0.285 . . . . 26.57 111.769 -179.63 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 25.0 t -59.48 -39.75 80.05 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.447 0 CA-C-N 116.318 -0.401 . . . . 23.64 110.68 178.382 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 70.7 m -66.75 -39.83 88.05 Favored 'General case' 0 C--O 1.224 -0.279 0 C-N-CA 122.702 0.401 . . . . 22.41 111.895 -178.58 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 55.3 tp -64.41 -48.92 73.57 Favored 'General case' 0 C--O 1.238 0.456 0 O-C-N 123.342 0.401 . . . . 23.96 110.211 176.28 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 24.2 t80 -53.78 -51.86 62.07 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 115.817 -0.628 . . . . 19.8 111.825 174.709 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' TRP . . . . . . . . . . . . . 81.0 t90 -56.94 -41.04 77.54 Favored 'General case' 0 N--CA 1.47 0.527 0 N-CA-C 112.386 0.513 . . . . 18.44 112.386 176.965 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 54.0 m -58.98 -47.57 84.67 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 111.928 0.344 . . . . 17.84 111.928 178.281 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 10.7 m-85 -62.61 -48.4 79.57 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-O 121.007 0.432 . . . . 21.41 111.93 176.849 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 31.0 t -57.6 -35.37 50.07 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.66 0 CA-C-N 115.544 -0.753 . . . . 16.79 110.83 178.667 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 99.5 m -77.77 -53.14 7.87 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 113.616 0.969 . . . . 16.9 113.616 179.435 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 19.5 pt -70.38 -21.37 23.23 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.763 0 N-CA-C 113.588 0.958 . . . . 18.37 113.588 -177.044 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -80.82 -8.97 59.85 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-O 121.214 0.53 . . . . 17.15 110.046 174.252 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 3.9 p 70.02 17.54 7.36 Favored 'General case' 0 C--O 1.251 1.16 0 C-N-CA 126.236 1.814 . . . . 17.48 112.095 -177.996 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 86.6 t -65.58 -50.17 73.45 Favored 'Isoleucine or valine' 0 C--O 1.262 1.731 0 O-C-N 121.847 -0.533 . . . . 16.76 110.828 175.528 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 50.42 58.08 9.51 Favored Glycine 0 C--O 1.26 1.743 0 N-CA-C 116.104 1.202 . . . . 16.69 116.104 173.958 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 61.3 m-85 -51.78 -40.1 59.77 Favored 'General case' 0 C--O 1.243 0.76 0 CA-C-N 118.482 1.141 . . . . 18.54 112.771 178.953 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 89.68 1.44 77.33 Favored Glycine 0 N--CA 1.467 0.762 0 C-N-CA 120.429 -0.891 . . . . 18.31 111.851 -178.73 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 23.1 p-10 -61.48 -32.61 72.63 Favored 'General case' 0 C--O 1.24 0.579 0 N-CA-C 110.047 -0.353 . . . . 21.01 110.047 170.335 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 93.5 m-85 -127.05 139.77 52.77 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 124.182 0.993 . . . . 22.22 111.193 169.967 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 63.3 p -161.47 159.53 23.42 Favored Pre-proline 0 CA--C 1.539 0.526 0 CA-C-N 115.756 -0.656 . . . . 21.68 109.39 -179.411 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -72.06 140.59 34.83 Favored 'Trans proline' 0 C--N 1.352 0.712 0 C-N-CA 117.613 -1.125 . . . . 22.93 112.673 178.642 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' HIS . . . . . 0.489 ' HD2' ' O ' ' A' ' 103' ' ' HOH . 97.5 m-70 -116.37 5.76 13.58 Favored 'General case' 0 C--O 1.237 0.4 0 N-CA-C 112.45 0.537 . . . . 30.09 112.45 178.751 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 17.1 p -116.95 154.36 49.65 Favored Pre-proline 0 C--O 1.236 0.365 0 CA-C-N 116.426 -0.352 . . . . 27.45 111.196 175.744 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_exo -57.96 -37.49 95.84 Favored 'Trans proline' 0 C--N 1.349 0.577 0 O-C-N 122.24 0.6 . . . . 27.55 113.546 174.998 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 45.4 tp -66.01 -41.74 90.59 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 120.741 -0.383 . . . . 28.76 110.079 177.406 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -61.74 -39.52 97.55 Favored Glycine 0 N--CA 1.466 0.675 0 O-C-N 123.69 0.619 . . . . 24.83 111.565 179.046 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 66.5 mtt -65.14 -47.24 77.8 Favored 'General case' 0 C--O 1.237 0.404 0 N-CA-C 111.685 0.254 . . . . 25.1 111.685 178.208 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 53.7 t80 -58.03 -47.13 84.01 Favored 'General case' 0 C--O 1.242 0.681 0 CA-C-O 120.851 0.358 . . . . 35.48 111.312 174.696 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 20.9 t80 -59.18 -44.02 92.18 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.841 -0.618 . . . . 27.04 111.247 179.277 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 95.4 m -60.13 -42.99 95.97 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.1 -0.5 . . . . 21.22 112.269 178.404 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 72.9 m -59.5 -40.55 87.42 Favored 'General case' 0 N--CA 1.47 0.547 0 N-CA-C 111.98 0.363 . . . . 23.24 111.98 175.6 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 18.0 p -65.56 -42.34 91.96 Favored 'General case' 0 N--CA 1.463 0.192 0 C-N-CA 119.939 -0.705 . . . . 25.67 111.184 177.428 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 66.5 tp -62.06 -39.43 92.36 Favored 'General case' 0 N--CA 1.467 0.413 0 O-C-N 123.391 0.432 . . . . 21.42 111.401 177.831 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' ILE . . . . . 0.605 HG23 HD12 ' A' ' 84' ' ' ILE . 25.5 mt -59.5 -50.97 77.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.669 -0.696 . . . . 23.05 109.174 178.073 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 40.1 t -65.94 -41.93 90.87 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.721 0 N-CA-C 112.641 0.608 . . . . 25.52 112.641 -177.573 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 96.8 mt -82.3 -25.56 33.86 Favored 'General case' 0 N--CA 1.465 0.292 0 N-CA-C 112.763 0.653 . . . . 29.3 112.763 -176.287 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -102.72 -34.1 4.2 Favored Glycine 0 N--CA 1.463 0.449 0 N-CA-C 117.101 1.6 . . . . 24.39 117.101 -167.937 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' ILE . . . . . 0.605 HD12 HG23 ' A' ' 80' ' ' ILE . 41.8 mt -64.66 -44.78 96.64 Favored 'Isoleucine or valine' 0 C--O 1.242 0.694 0 N-CA-C 113.039 0.755 . . . . 26.24 113.039 -172.865 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -64.66 -46.92 88.56 Favored Glycine 0 C--O 1.24 0.505 0 N-CA-C 111.354 -0.698 . . . . 23.9 111.354 177.111 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 22.2 m -57.35 -47.76 80.77 Favored 'General case' 0 C--O 1.235 0.294 0 C-N-CA 123.226 0.61 . . . . 25.36 111.444 179.364 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 46.3 t80 -63.14 -42.01 99.39 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 112.237 0.458 . . . . 26.13 112.237 177.685 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -58.35 -44.17 88.65 Favored 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 112.143 0.423 . . . . 26.73 112.143 178.536 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 99.7 t -67.16 -42.03 87.62 Favored 'Isoleucine or valine' 0 C--O 1.237 0.427 0 CA-C-N 116.796 -0.184 . . . . 29.29 110.632 178.76 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -59.34 -44.33 92.64 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 113.975 1.102 . . . . 32.09 113.975 177.571 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 34.3 m -65.8 -39.26 84.27 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 C-N-CA 120.236 -0.586 . . . . 37.14 111.422 178.772 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' GLN . . . . . 0.41 ' O ' ' HB2' ' A' ' 95' ' ' LEU . 74.4 mt-30 -57.32 -47.45 81.5 Favored 'General case' 0 N--CA 1.467 0.387 0 O-C-N 123.371 0.419 . . . . 49.55 111.739 176.933 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 5.5 mmm180 -67.06 -35.99 81.06 Favored 'General case' 0 N--CA 1.465 0.3 0 N-CA-C 112.212 0.449 . . . . 52.04 112.212 178.689 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 43.4 tp -63.98 -37.6 88.02 Favored 'General case' 0 C--O 1.233 0.218 0 C-N-CA 121.439 -0.104 . . . . 49.56 111.252 177.431 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' LEU . . . . . 0.41 ' HB2' ' O ' ' A' ' 92' ' ' GLN . 12.5 mt -49.82 -51.28 41.03 Favored 'General case' 0 N--CA 1.468 0.441 0 O-C-N 123.689 0.618 . . . . 53.97 111.213 174.168 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 67.8 mt-10 -61.29 -40.12 92.96 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 112.76 0.652 . . . . 59.2 112.76 -177.786 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 62.5 m-85 -78.54 -16.95 56.89 Favored 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 113.652 0.982 . . . . 61.75 113.652 -179.179 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 98.0 mt -93.9 -28.56 15.76 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-O 120.72 0.295 . . . . 61.07 110.787 173.703 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 59.7 mt . . . . . 0 C--O 1.233 0.192 0 CA-C-N 115.959 -0.564 . . . . 62.32 109.85 179.911 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 1' ' ' ' K' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 2' ' ' ' K' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 3' ' ' ' K' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 4' ' ' ' K' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 5' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 6' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 7' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 8' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 9' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 10' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 11' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 12' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 13' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 14' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 15' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 16' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 17' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 100' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 103' ' ' HOH . . . . . 0.489 ' O ' ' HD2' ' A' ' 68' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 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 0 . 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 nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 44.7 t . . . . . 0 N--CA 1.504 2.271 0 N-CA-C 110.322 -0.251 . . . . 38.52 110.322 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -59.83 137.54 77.21 Favored 'Trans proline' 0 C--N 1.352 0.76 0 C-N-CA 121.901 1.734 . . . . 35.52 112.34 -179.176 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -57.59 -37.08 72.6 Favored 'General case' 0 N--CA 1.465 0.322 0 N-CA-C 113.263 0.838 . . . . 32.33 113.263 -174.559 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 91.2 m -65.5 -35.73 81.75 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 120.731 -0.387 . . . . 29.45 110.765 178.186 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 63.3 ttt180 -66.71 -40.85 88.6 Favored 'General case' 0 N--CA 1.456 -0.168 0 C-N-CA 119.968 -0.693 . . . . 38.99 110.341 176.358 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 29.0 mm -60.45 -43.45 94.14 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 CA-C-N 116.383 -0.371 . . . . 29.25 111.216 174.456 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 57.3 tp -52.12 -51.6 56.8 Favored 'General case' 0 N--CA 1.468 0.434 0 N-CA-C 112.004 0.372 . . . . 26.24 112.004 172.196 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 56.8 mt -60.44 -38.83 85.38 Favored 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 112.694 0.628 . . . . 24.39 112.694 179.589 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 51.5 mt -64.29 -46.01 85.48 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.533 -0.303 . . . . 25.97 111.341 -179.774 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 2.8 p -66.65 -34.02 67.29 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.714 0 C-N-CA 120.111 -0.636 . . . . 22.95 111.804 177.722 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 91.6 mt -64.5 -41.84 96.19 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 120.562 -0.455 . . . . 25.34 110.818 175.709 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -59.9 -42.73 94.47 Favored 'General case' 0 C--O 1.217 -0.617 0 N-CA-C 111.903 0.334 . . . . 22.24 111.903 174.886 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 35.4 t -60.44 -43.86 95.01 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.497 0 CA-C-O 121.092 0.472 . . . . 23.98 111.011 175.92 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 34.9 mt -62.03 -46.58 96.16 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.504 0 CA-C-N 115.905 -0.589 . . . . 25.4 111.739 -179.92 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 78.7 mt -58.51 -49.08 83.54 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.898 0 CA-C-O 120.47 0.176 . . . . 25.34 111.316 174.82 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 81.0 t80 -54.89 -51.9 64.56 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 122.955 0.502 . . . . 30.74 112.092 177.455 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -61.55 -45.4 96.42 Favored Glycine 0 N--CA 1.468 0.783 0 O-C-N 123.152 0.283 . . . . 22.02 113.261 179.077 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 89.6 m -66.44 -51.53 55.91 Favored 'General case' 0 C--O 1.237 0.414 0 N-CA-C 112.28 0.474 . . . . 22.38 112.28 -176.241 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -62.4 -44.25 96.9 Favored 'General case' 0 N--CA 1.473 0.706 0 O-C-N 123.391 0.432 . . . . 23.65 111.184 179.787 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -58.23 -52.45 52.51 Favored Glycine 0 CA--C 1.524 0.616 0 CA-C-N 116.551 -0.295 . . . . 23.65 113.365 178.641 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 20.3 t80 -62.62 -41.17 98.86 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 117.062 0.431 . . . . 24.37 110.633 -179.743 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 69.8 t60 -60.07 -47.85 84.17 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 116.604 -0.271 . . . . 29.21 111.587 179.738 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 51.4 m-85 -79.18 -36.06 40.89 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 114.312 1.227 . . . . 32.19 114.312 -176.784 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 63.3 mt -80.25 -45.93 22.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 C-N-CA 120.85 -0.34 . . . . 27.76 111.615 -179.176 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 78.4 mm-40 -99.26 -15.47 18.86 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 114.607 1.336 . . . . 26.99 114.607 -175.099 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 82.61 16.82 69.84 Favored Glycine 0 C--O 1.225 -0.454 0 N-CA-C 116.14 1.216 . . . . 26.82 116.14 171.938 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 64.5 mm-40 -84.65 159.14 20.63 Favored 'General case' 0 CA--C 1.516 -0.327 0 CA-C-N 117.628 0.714 . . . . 27.65 109.457 178.209 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 59.6 p -57.2 157.63 6.02 Favored 'General case' 0 C--O 1.241 0.637 0 O-C-N 123.425 0.453 . . . . 26.14 111.82 178.886 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 98.5 m95 -55.37 -43.59 75.27 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 116.225 -0.443 . . . . 26.72 110.308 176.868 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 21.2 m -62.34 -51.03 69.25 Favored 'General case' 0 N--CA 1.467 0.393 0 N-CA-C 111.769 0.285 . . . . 26.57 111.769 -179.63 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 25.0 t -59.48 -39.75 80.05 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.447 0 CA-C-N 116.318 -0.401 . . . . 23.64 110.68 178.382 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 70.7 m -66.75 -39.83 88.05 Favored 'General case' 0 C--O 1.224 -0.279 0 C-N-CA 122.702 0.401 . . . . 22.41 111.895 -178.58 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 55.3 tp -64.41 -48.92 73.57 Favored 'General case' 0 C--O 1.238 0.456 0 O-C-N 123.342 0.401 . . . . 23.96 110.211 176.28 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 24.2 t80 -53.78 -51.86 62.07 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 115.817 -0.628 . . . . 19.8 111.825 174.709 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' TRP . . . . . . . . . . . . . 81.0 t90 -56.94 -41.04 77.54 Favored 'General case' 0 N--CA 1.47 0.527 0 N-CA-C 112.386 0.513 . . . . 18.44 112.386 176.965 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 54.0 m -58.98 -47.57 84.67 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 111.928 0.344 . . . . 17.84 111.928 178.281 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 10.7 m-85 -62.61 -48.4 79.57 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-O 121.007 0.432 . . . . 21.41 111.93 176.849 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 31.0 t -57.6 -35.37 50.07 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.66 0 CA-C-N 115.544 -0.753 . . . . 16.79 110.83 178.667 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 99.5 m -77.77 -53.14 7.87 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 113.616 0.969 . . . . 16.9 113.616 179.435 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 19.5 pt -70.38 -21.37 23.23 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.763 0 N-CA-C 113.588 0.958 . . . . 18.37 113.588 -177.044 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -80.82 -8.97 59.85 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-O 121.214 0.53 . . . . 17.15 110.046 174.252 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 3.9 p 70.02 17.54 7.36 Favored 'General case' 0 C--O 1.251 1.16 0 C-N-CA 126.236 1.814 . . . . 17.48 112.095 -177.996 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 86.6 t -65.58 -50.17 73.45 Favored 'Isoleucine or valine' 0 C--O 1.262 1.731 0 O-C-N 121.847 -0.533 . . . . 16.76 110.828 175.528 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 50.42 58.08 9.51 Favored Glycine 0 C--O 1.26 1.743 0 N-CA-C 116.104 1.202 . . . . 16.69 116.104 173.958 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 61.3 m-85 -51.78 -40.1 59.77 Favored 'General case' 0 C--O 1.243 0.76 0 CA-C-N 118.482 1.141 . . . . 18.54 112.771 178.953 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 89.68 1.44 77.33 Favored Glycine 0 N--CA 1.467 0.762 0 C-N-CA 120.429 -0.891 . . . . 18.31 111.851 -178.73 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 23.1 p-10 -61.48 -32.61 72.63 Favored 'General case' 0 C--O 1.24 0.579 0 N-CA-C 110.047 -0.353 . . . . 21.01 110.047 170.335 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 93.5 m-85 -127.05 139.77 52.77 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 124.182 0.993 . . . . 22.22 111.193 169.967 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 63.3 p -161.47 159.53 23.42 Favored Pre-proline 0 CA--C 1.539 0.526 0 CA-C-N 115.756 -0.656 . . . . 21.68 109.39 -179.411 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -72.06 140.59 34.83 Favored 'Trans proline' 0 C--N 1.352 0.712 0 C-N-CA 117.613 -1.125 . . . . 22.93 112.673 178.642 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' HIS . . . . . 0.489 ' HD2' ' O ' ' A' ' 103' ' ' HOH . 97.5 m-70 -116.37 5.76 13.58 Favored 'General case' 0 C--O 1.237 0.4 0 N-CA-C 112.45 0.537 . . . . 30.09 112.45 178.751 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 17.1 p -116.95 154.36 49.65 Favored Pre-proline 0 C--O 1.236 0.365 0 CA-C-N 116.426 -0.352 . . . . 27.45 111.196 175.744 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_exo -57.96 -37.49 95.84 Favored 'Trans proline' 0 C--N 1.349 0.577 0 O-C-N 122.24 0.6 . . . . 27.55 113.546 174.998 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 45.4 tp -66.01 -41.74 90.59 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 120.741 -0.383 . . . . 28.76 110.079 177.406 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -61.74 -39.52 97.55 Favored Glycine 0 N--CA 1.466 0.675 0 O-C-N 123.69 0.619 . . . . 24.83 111.565 179.046 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 66.5 mtt -65.14 -47.24 77.8 Favored 'General case' 0 C--O 1.237 0.404 0 N-CA-C 111.685 0.254 . . . . 25.1 111.685 178.208 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 53.7 t80 -58.03 -47.13 84.01 Favored 'General case' 0 C--O 1.242 0.681 0 CA-C-O 120.851 0.358 . . . . 35.48 111.312 174.696 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 20.9 t80 -59.18 -44.02 92.18 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.841 -0.618 . . . . 27.04 111.247 179.277 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 95.4 m -60.13 -42.99 95.97 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.1 -0.5 . . . . 21.22 112.269 178.404 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 72.9 m -59.5 -40.55 87.42 Favored 'General case' 0 N--CA 1.47 0.547 0 N-CA-C 111.98 0.363 . . . . 23.24 111.98 175.6 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 18.0 p -65.56 -42.34 91.96 Favored 'General case' 0 N--CA 1.463 0.192 0 C-N-CA 119.939 -0.705 . . . . 25.67 111.184 177.428 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 66.5 tp -62.06 -39.43 92.36 Favored 'General case' 0 N--CA 1.467 0.413 0 O-C-N 123.391 0.432 . . . . 21.42 111.401 177.831 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.605 HG23 HD12 ' A' ' 84' ' ' ILE . 25.5 mt -59.5 -50.97 77.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.669 -0.696 . . . . 23.05 109.174 178.073 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 40.1 t -65.94 -41.93 90.87 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.721 0 N-CA-C 112.641 0.608 . . . . 25.52 112.641 -177.573 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 96.8 mt -82.3 -25.56 33.86 Favored 'General case' 0 N--CA 1.465 0.292 0 N-CA-C 112.763 0.653 . . . . 29.3 112.763 -176.287 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -102.72 -34.1 4.2 Favored Glycine 0 N--CA 1.463 0.449 0 N-CA-C 117.101 1.6 . . . . 24.39 117.101 -167.937 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' ILE . . . . . 0.605 HD12 HG23 ' A' ' 80' ' ' ILE . 41.8 mt -64.66 -44.78 96.64 Favored 'Isoleucine or valine' 0 C--O 1.242 0.694 0 N-CA-C 113.039 0.755 . . . . 26.24 113.039 -172.865 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -64.66 -46.92 88.56 Favored Glycine 0 C--O 1.24 0.505 0 N-CA-C 111.354 -0.698 . . . . 23.9 111.354 177.111 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 22.2 m -57.35 -47.76 80.77 Favored 'General case' 0 C--O 1.235 0.294 0 C-N-CA 123.226 0.61 . . . . 25.36 111.444 179.364 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 46.3 t80 -63.14 -42.01 99.39 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 112.237 0.458 . . . . 26.13 112.237 177.685 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -58.35 -44.17 88.65 Favored 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 112.143 0.423 . . . . 26.73 112.143 178.536 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 99.7 t -67.16 -42.03 87.62 Favored 'Isoleucine or valine' 0 C--O 1.237 0.427 0 CA-C-N 116.796 -0.184 . . . . 29.29 110.632 178.76 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -59.34 -44.33 92.64 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 113.975 1.102 . . . . 32.09 113.975 177.571 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 34.3 m -65.8 -39.26 84.27 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 C-N-CA 120.236 -0.586 . . . . 37.14 111.422 178.772 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' GLN . . . . . 0.41 ' O ' ' HB2' ' A' ' 95' ' ' LEU . 74.4 mt-30 -57.32 -47.45 81.5 Favored 'General case' 0 N--CA 1.467 0.387 0 O-C-N 123.371 0.419 . . . . 49.55 111.739 176.933 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 5.5 mmm180 -67.06 -35.99 81.06 Favored 'General case' 0 N--CA 1.465 0.3 0 N-CA-C 112.212 0.449 . . . . 52.04 112.212 178.689 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 43.4 tp -63.98 -37.6 88.02 Favored 'General case' 0 C--O 1.233 0.218 0 C-N-CA 121.439 -0.104 . . . . 49.56 111.252 177.431 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.41 ' HB2' ' O ' ' A' ' 92' ' ' GLN . 12.5 mt -49.82 -51.28 41.03 Favored 'General case' 0 N--CA 1.468 0.441 0 O-C-N 123.689 0.618 . . . . 53.97 111.213 174.168 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 67.8 mt-10 -61.29 -40.12 92.96 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 112.76 0.652 . . . . 59.2 112.76 -177.786 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 62.5 m-85 -78.54 -16.95 56.89 Favored 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 113.652 0.982 . . . . 61.75 113.652 -179.179 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 98.0 mt -93.9 -28.56 15.76 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-O 120.72 0.295 . . . . 61.07 110.787 173.703 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 59.7 mt . . . . . 0 C--O 1.233 0.192 0 CA-C-N 115.959 -0.564 . . . . 62.32 109.85 179.911 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' ' K' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' ' K' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' ' K' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' ' K' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' HOH . . . . . 0.489 ' O ' ' HD2' ' A' ' 68' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 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 0 . 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 stop_ save_