data_6h4k_residue ############################ # Computer software used # ############################ save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 6h4k _Structure_validation_residue.Date_analyzed 2019-03-22 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 ecloud orig full ' A' A ' 777' ' ' LEU . . . . . . . . . . . . . 38.2 mt . . . . . 0 C--O 1.239 0.51 0 CA-C-O 121.037 0.446 . . . . 116.62 111.966 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 778' ' ' GLN . . . . . . . . . . . . . . . -66.44 -5.64 11.77 Favored 'General case' 0 C--O 1.239 0.506 0 N-CA-C 113.047 0.758 . . . . 103.04 113.047 177.04 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 779' ' ' SER . . . . . . . . . . . . . 57.9 p -115.02 6.06 15.15 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 123.532 0.733 . . . . 87.04 112.936 -174.543 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 780' ' ' ALA . . . . . . . . . . . . . . . -62.57 -34.61 77.31 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 119.615 -0.834 . . . . 81.58 110.615 176.969 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 781' ' ' ILE . . . . . . . . . . . . . 1.4 mm -66.94 -37.08 78.69 Favored 'Isoleucine or valine' 0 C--O 1.236 0.357 0 CA-C-O 120.677 0.275 . . . . 80.16 110.642 175.373 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 782' ' ' LYS . . . . . . . . . . . . . . . -70.38 -41.33 73.21 Favored 'General case' 0 C--O 1.233 0.227 0 O-C-N 121.818 -0.551 . . . . 64.07 110.795 179.301 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 783' ' ' LEU . . . . . . . . . . . . . 1.2 mp -58.12 -47.54 82.98 Favored 'General case' 0 C--O 1.236 0.358 0 C-N-CA 120.779 -0.369 . . . . 72.14 110.692 172.912 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 784' ' ' GLU . . . . . . . . . . . . . 24.9 tp10 -65.92 -41.43 91.43 Favored 'General case' 0 C--O 1.234 0.252 0 C-N-CA 119.323 -0.951 . . . . 65.46 111.002 -176.697 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 785' ' ' TYR . . . . . . . . . . . . . 9.6 t80 -59.53 -44.33 93.21 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-O 120.657 0.265 . . . . 77.54 110.701 177.055 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . -66.23 -35.35 80.2 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 120.943 -0.303 . . . . 52.02 111.391 -178.315 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 787' ' ' ARG . . . . . . . . . . . . . 69.7 ttp85 -63.71 -40.9 97.91 Favored 'General case' 0 C--O 1.239 0.519 0 O-C-N 121.984 -0.448 . . . . 60.14 111.77 173.7 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 788' ' ' LEU . . . . . . . . . . . . . 90.9 mt -73.26 -31.24 63.98 Favored 'General case' 0 C--O 1.24 0.578 0 C-N-CA 119.425 -0.91 . . . . 51.72 111.901 -176.799 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 789' ' ' VAL . . . . . . . . . . . . . 42.1 t -58.95 -47.68 88.94 Favored 'Isoleucine or valine' 0 C--O 1.238 0.463 0 CA-C-O 121.083 0.468 . . . . 52.08 110.177 172.372 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 790' ' ' LYS . . . . . . . . . . . . . 58.9 mmtt -58.9 -51.22 70.94 Favored 'General case' 0 C--O 1.238 0.465 0 O-C-N 122.169 -0.332 . . . . 90.16 111.423 177.692 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 791' ' ' LEU . . . . . . . . . . . . . 12.8 tp -53.37 -41.98 66.4 Favored 'General case' 0 C--O 1.242 0.67 0 CA-C-O 120.932 0.396 . . . . 54.42 111.778 172.148 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 792' ' ' ALA . . . . . . . . . . . . . . . -64.93 -28.17 69.35 Favored 'General case' 0 N--CA 1.463 0.181 0 O-C-N 121.835 -0.541 . . . . 49.55 112.306 -177.596 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 793' ' ' GLN . . . . . . . . . . . . . 86.7 mt-30 -93.75 -9.8 36.39 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 113.558 0.947 . . . . 78.19 113.558 -177.197 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 794' ' ' GLU . . . . . . . . . . . . . 17.2 tt0 -62.24 138.58 58.44 Favored 'General case' 0 C--O 1.238 0.48 0 CA-C-N 118.763 0.71 . . . . 96.61 111.888 -178.665 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 795' ' ' ASP . . . . . . . . . . . . . . . -81.52 126.12 31.32 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 115.673 -0.694 . . . . 75.76 109.347 170.389 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 796' ' ' THR . . . . . 0.555 ' O ' 'CL ' ' A' 1101 ' ' ' CL' . 41.8 p -128.75 149.97 73.61 Favored Pre-proline 0 C--O 1.237 0.43 0 CA-C-N 116.436 -0.347 . . . . 64.14 110.143 -172.707 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 797' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_endo -66.2 164.61 27.29 Favored 'Trans proline' 0 C--O 1.242 0.706 0 C-N-CA 120.858 1.038 . . . . 64.31 110.939 176.584 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 798' ' ' PRO . . . . . . . . . . . . . 22.8 Cg_exo -61.05 -25.01 80.66 Favored 'Trans proline' 0 N--CA 1.479 0.627 0 N-CA-C 114.23 0.819 . . . . 56.8 114.23 -172.2 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 799' ' ' GLU . . . . . . . . . . . . . 24.2 pm0 -77.64 -9.23 58.85 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 119.238 -0.985 . . . . 66.79 112.801 -178.671 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 800' ' ' THR . . . . . . . . . . . . . 95.9 m -119.41 123.26 43.66 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 107.697 -1.223 . . . . 57.81 107.697 -172.14 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 801' ' ' ASP . . . . . . . . . . . . . 66.2 t0 -137.77 97.5 3.45 Favored 'General case' 0 C--O 1.239 0.509 0 N-CA-C 107.182 -1.414 . . . . 53.48 107.182 -176.294 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 802' ' ' TYR . . . . . . . . . . . . . 23.4 m-85 -68.52 -8.85 44.94 Favored 'General case' 0 C--O 1.233 0.218 0 C-N-CA 117.995 -1.482 . . . . 50.74 112.464 -175.832 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 803' ' ' ARG . . . . . . . . . . . . . 77.5 mtm180 -62.97 -28.35 70.03 Favored 'General case' 0 C--N 1.348 0.521 0 C-N-CA 118.509 -1.277 . . . . 42.46 110.36 171.453 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 804' ' ' LEU . . . . . . . . . . . . . 78.5 mt -74.92 -19.94 59.92 Favored 'General case' 0 C--O 1.241 0.609 0 CA-C-O 119.117 -0.468 . . . . 43.68 112.169 177.155 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 805' ' ' HIS . . . . . . . . . . . . . 11.4 m80 -81.77 -34.76 30.21 Favored 'General case' 0 C--N 1.347 0.459 0 C-N-CA 120.342 -0.543 . . . . 47.05 111.912 -178.839 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 806' ' ' HIS . . . . . . . . . . . . . 18.6 t-80 -150.9 134.55 16.44 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 118.769 -1.172 . . . . 61.01 109.877 -173.446 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 807' ' ' VAL . . . . . . . . . . . . . 6.2 p -59.58 -32.37 48.95 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 CA-C-N 116.094 -0.503 . . . . 42.16 111.378 178.012 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 808' ' ' VAL . . . . . . . . . . . . . 30.4 t -69.95 -29.76 41.58 Favored 'Isoleucine or valine' 0 C--O 1.24 0.569 0 O-C-N 120.982 -1.074 . . . . 49.6 111.417 -178.099 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 809' ' ' VAL . . . . . . . . . . . . . 97.1 t -64.1 -43.56 97.49 Favored 'Isoleucine or valine' 0 C--O 1.238 0.452 0 C-N-CA 119.739 -0.784 . . . . 43.83 110.87 171.875 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 810' ' ' TYR . . . . . . . . . . . . . 59.2 t80 -56.58 -45.02 81.56 Favored 'General case' 0 C--O 1.241 0.623 0 C-N-CA 119.553 -0.859 . . . . 42.11 110.883 173.399 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 811' ' ' PHE . . . . . . . . . . . . . 16.7 m-30 -62.06 -44.23 97.13 Favored 'General case' 0 C--O 1.24 0.58 0 C-N-CA 119.904 -0.718 . . . . 44.28 111.951 -179.619 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 812' ' ' ILE . . . . . . . . . . . . . 76.6 mt -64.58 -47.47 88.93 Favored 'Isoleucine or valine' 0 C--O 1.239 0.519 0 C-N-CA 120.36 -0.536 . . . . 46.33 110.229 -175.037 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 813' ' ' GLN . . . . . . . . . . . . . 60.7 mt-30 -66.04 -15.58 63.17 Favored 'General case' 0 C--O 1.233 0.213 0 N-CA-C 112.775 0.657 . . . . 51.32 112.775 -179.553 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 814' ' ' ASN . . . . . . . . . . . . . 59.6 m-80 -112.13 24.06 13.02 Favored 'General case' 0 C--O 1.239 0.532 0 N-CA-C 112.841 0.682 . . . . 44.31 112.841 -179.905 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 815' ' ' GLN . . . . . . . . . . . . . 15.4 mp0 57.48 37.57 27.82 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.249 0.547 . . . . 69.07 112.006 171.714 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 816' ' ' ALA . . . . . . . . . . . . . . . -65.47 150.65 95.64 Favored Pre-proline 0 C--N 1.321 -0.661 0 C-N-CA 117.12 -1.832 . . . . 52.75 109.631 174.265 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 817' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -61.51 145.71 97.65 Favored 'Trans proline' 0 C--O 1.235 0.358 0 N-CA-C 110.668 -0.551 . . . . 62.17 110.668 178.951 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 818' ' ' LYS . . . . . . . . . . . . . 7.9 ttmm -55.04 -31.42 61.09 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 119.546 -0.861 . . . . 91.05 111.028 -178.912 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 819' ' ' LYS . . . . . . . . . . . . . . . -74.14 -35.01 64.05 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 120.714 -0.394 . . . . 73.07 111.724 -176.886 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 820' ' ' ILE . . . . . . . . . . . . . 23.7 mm -61.49 -42.36 93.63 Favored 'Isoleucine or valine' 0 C--O 1.235 0.296 0 CA-C-O 121.353 0.597 . . . . 60.27 109.821 174.792 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 821' ' ' ILE . . . . . . . . . . . . . 85.6 mt -66.8 -43.83 89.55 Favored 'Isoleucine or valine' 0 C--O 1.237 0.401 0 CA-C-O 120.991 0.425 . . . . 57.21 110.812 -179.041 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 822' ' ' GLU . . . . . . . . . . . . . 62.6 mt-10 -62.78 -44.94 94.86 Favored 'General case' 0 C--O 1.237 0.423 0 C-N-CA 119.815 -0.754 . . . . 86.9 111.18 -178.3 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 823' ' ' LYS . . . . . . . . . . . . . 46.8 tttt -60.21 -39.7 87.5 Favored 'General case' 0 C--O 1.238 0.458 0 C-N-CA 119.728 -0.789 . . . . 68.37 111.368 177.901 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 824' ' ' THR . . . . . . . . . . . . . 89.0 m -63.93 -40.84 97.38 Favored 'General case' 0 C--O 1.234 0.245 0 C-N-CA 120.197 -0.601 . . . . 55.34 110.647 176.098 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 825' ' ' LEU . . . . . . . . . . . . . 33.0 mt -66.65 -44.0 83.12 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 118.392 -1.323 . . . . 53.61 111.413 176.078 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 826' ' ' LEU . . . . . . . . . . . . . 92.0 mt -60.55 -41.15 93.93 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 119.366 -0.934 . . . . 63.56 111.499 -178.632 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 827' ' ' GLU . . . . . . . . . . . . . 71.5 mt-10 -71.19 -30.86 66.92 Favored 'General case' 0 C--O 1.236 0.342 0 C-N-CA 120.188 -0.605 . . . . 94.96 112.179 179.845 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 828' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -66.46 -32.31 73.59 Favored 'General case' 0 C--O 1.238 0.489 0 C-N-CA 118.591 -1.244 . . . . 82.05 110.789 175.631 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 829' ' ' PHE . . . . . . . . . . . . . 27.0 m-85 -84.32 -37.41 21.65 Favored 'General case' 0 C--O 1.234 0.238 0 N-CA-C 112.037 0.384 . . . . 87.46 112.037 177.151 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 830' ' ' GLY . . . . . . . . . . . . . . . -102.16 2.5 51.05 Favored Glycine 0 N--CA 1.443 -0.871 0 N-CA-C 118.208 2.043 . . . . 79.41 118.208 -171.852 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 831' ' ' ASP . . . . . . . . . . . . . 14.2 p-10 -76.62 -27.54 55.75 Favored 'General case' 0 C--O 1.238 0.477 0 CA-C-N 119.561 1.68 . . . . 102.93 112.787 -175.77 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 832' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -67.89 165.64 17.24 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-O 121.924 0.869 . . . . 94.58 110.675 -174.495 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 833' ' ' ASN . . . . . . . . . . . . . 5.7 m120 -108.34 -34.66 6.73 Favored 'General case' 0 CA--C 1.515 -0.368 0 N-CA-C 113.327 0.862 . . . . 104.91 113.327 179.512 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 834' ' ' LEU . . . . . . . . . . . . . 39.6 tp -121.53 148.45 44.47 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.078 -0.712 . . . . 68.85 109.078 -170.556 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 835' ' ' SER . . . . . . . . . . . . . 32.5 t -147.33 145.45 29.34 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 118.497 -1.281 . . . . 59.33 109.735 167.572 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 836' ' ' PHE . . . . . . . . . . . . . 81.5 m-85 -103.8 0.37 30.27 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 114.577 -1.192 . . . . 57.31 112.412 172.387 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 837' ' ' ASP . . . . . . . . . . . . . 45.6 t0 -112.41 112.23 23.64 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 107.674 -1.232 . . . . 74.59 107.674 -175.76 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 838' ' ' GLU . . . . . . . . . . . . . 17.0 tt0 -50.29 -50.76 49.48 Favored 'General case' 0 C--O 1.235 0.326 0 O-C-N 123.564 0.54 . . . . 106.72 112.004 179.483 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 839' ' ' ARG . . . . . . . . . . . . . 24.4 ttp85 -63.04 -44.66 95.26 Favored 'General case' 0 C--O 1.238 0.469 0 C-N-CA 119.682 -0.807 . . . . 91.89 111.555 -177.409 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 840' ' ' CYS . . . . . . . . . . . . . 63.6 m -69.79 -33.94 73.06 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 119.624 -0.83 . . . . 72.48 112.549 177.02 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 841' ' ' HIS . . . . . . . . . . . . . 45.2 t-80 -60.03 -44.06 94.9 Favored 'General case' 0 C--O 1.238 0.459 0 C-N-CA 119.524 -0.87 . . . . 71.74 110.889 175.115 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 842' ' ' ASN . . . . . . . . . . . . . 98.2 m-20 -63.84 -42.27 97.63 Favored 'General case' 0 C--O 1.233 0.198 0 C-N-CA 120.435 -0.506 . . . . 80.67 111.412 179.366 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 843' ' ' ILE . . . . . . . . . . . . . 81.5 mt -63.26 -40.33 88.64 Favored 'Isoleucine or valine' 0 C--O 1.236 0.351 0 C-N-CA 120.353 -0.539 . . . . 62.42 110.304 177.145 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 844' ' ' MSE . . . . . . . . . . . . . 61.3 ttp -55.14 -49.64 71.27 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 113.446 0.906 . . . . 90.3 113.446 173.662 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 845' ' ' LYS . . . . . . . . . . . . . 71.1 mmtt -62.82 -39.95 95.9 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 120.7 -0.4 . . . . 81.62 111.959 178.903 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 846' ' ' VAL . . . . . . . . . . . . . 41.2 t -59.31 -48.26 87.62 Favored 'Isoleucine or valine' 0 C--O 1.239 0.502 0 CA-C-O 121.292 0.568 . . . . 72.43 110.59 177.005 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 847' ' ' ALA . . . . . . . . . . . . . . . -63.59 -42.92 98.23 Favored 'General case' 0 C--O 1.234 0.282 0 O-C-N 121.979 -0.451 . . . . 66.75 111.436 179.205 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 848' ' ' GLN . . . . . . . . . . . . . 85.6 mt-30 -62.54 -29.38 70.53 Favored 'General case' 0 C--O 1.237 0.445 0 C-N-CA 119.598 -0.841 . . . . 77.58 111.139 176.089 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 849' ' ' ALA . . . . . . . . . . . . . . . -67.65 -52.93 32.29 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 120.415 -0.514 . . . . 83.89 111.242 177.006 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 850' ' ' LYS . . . . . . . . . . . . . 62.8 mttt -59.96 -41.05 91.07 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 120.401 -0.52 . . . . 89.36 111.302 179.686 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 851' ' ' LEU . . . . . . . . . . . . . 3.8 mt -60.79 -41.97 96.63 Favored 'General case' 0 C--O 1.238 0.499 0 C-N-CA 120.285 -0.566 . . . . 93.21 111.517 -178.672 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 852' ' ' GLU . . . . . . . . . . . . . . . -60.26 -16.58 35.2 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 112.257 0.466 . . . . 104.08 112.257 179.893 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 853' ' ' MSE . . . . . . . . . . . . . 20.1 mtp . . . . . 0 C--N 1.329 -0.304 0 CA-C-N 117.992 0.36 . . . . 172.15 111.54 172.166 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 857' ' ' GLU . . . . . . . . . . . . . . . . . . . . 0 C--O 1.236 0.381 0 CA-C-O 121.411 0.624 . . . . 110.16 109.432 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 858' ' ' GLU . . . . . . . . . . . . . . . -75.15 1.82 12.34 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 115.469 -0.787 . . . . 109.52 112.426 175.6 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 859' ' ' VAL . . . . . . . . . . . . . . . -73.13 -42.93 58.63 Favored 'Isoleucine or valine' 0 C--O 1.238 0.485 0 CA-C-N 118.435 0.561 . . . . 111.24 111.078 -172.449 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 860' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 40.4 77.3 0.06 Allowed 'General case' 0 C--O 1.236 0.361 0 C-N-CA 125.212 1.405 . . . . 115.61 111.73 -174.108 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 861' ' ' LEU . . . . . . . . . . . . . 22.7 tp -77.84 -35.42 51.12 Favored 'General case' 0 C--O 1.234 0.254 0 N-CA-C 112.285 0.476 . . . . 98.19 112.285 -170.398 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 862' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -62.63 -45.77 91.3 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 120.879 -0.328 . . . . 112.11 111.122 177.866 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 863' ' ' GLU . . . . . . . . . . . . . 4.9 mp0 -56.49 -41.15 76.15 Favored 'General case' 0 C--O 1.235 0.302 0 C-N-CA 119.898 -0.721 . . . . 97.71 110.539 171.719 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 864' ' ' TYR . . . . . . . . . . . . . 76.5 t80 -66.22 -48.45 70.55 Favored 'General case' 0 C--O 1.237 0.428 0 C-N-CA 120.056 -0.657 . . . . 76.64 111.28 -176.941 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 865' ' ' GLU . . . . . . . . . . . . . 59.9 mm-40 -63.6 -33.73 76.26 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 119.865 -0.734 . . . . 101.76 111.951 177.123 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 866' ' ' GLU . . . . . . . . . . . . . 23.6 tp10 -65.02 -42.3 94.51 Favored 'General case' 0 C--O 1.239 0.542 0 C-N-CA 119.333 -0.947 . . . . 88.15 111.125 -177.705 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 867' ' ' TRP . . . . . . . . . . . . . 61.0 m95 -65.22 -39.75 93.17 Favored 'General case' 0 C--O 1.238 0.466 0 C-N-CA 120.204 -0.598 . . . . 52.27 111.19 179.483 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 868' ' ' HIS . . . . . . . . . . . . . 73.1 m-70 -73.07 -32.43 65.02 Favored 'General case' 0 C--O 1.234 0.241 0 C-N-CA 118.027 -1.469 . . . . 54.03 111.921 179.971 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 869' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 -63.28 -39.29 94.16 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 118.544 0.611 . . . . 88.36 111.524 170.593 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 870' ' ' ASP . . . . . . . . . . . . . 96.3 m-20 -62.45 -37.77 87.18 Favored 'General case' 0 C--O 1.239 0.541 0 C-N-CA 119.783 -0.767 . . . . 54.69 110.79 178.907 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 871' ' ' TYR . . . . . . . . . . . . . 40.4 t80 -68.74 -40.36 79.89 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 120.337 -0.545 . . . . 41.15 111.125 178.906 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 872' ' ' ARG . . . . . . . . . . . . . 88.3 mtm-85 -63.81 -38.05 89.65 Favored 'General case' 0 C--O 1.232 0.18 0 C-N-CA 118.773 -1.171 . . . . 72.87 110.705 178.484 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 873' ' ' LYS . . . . . . . . . . . . . 56.0 tttp -64.58 -35.87 82.41 Favored 'General case' 0 C--O 1.242 0.707 0 N-CA-C 111.938 0.347 . . . . 44.29 111.938 174.258 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 874' ' ' PHE . . . . . . . . . . . . . 54.4 t80 -63.19 -41.55 99.2 Favored 'General case' 0 C--O 1.237 0.446 0 O-C-N 121.521 -0.737 . . . . 36.14 111.042 174.593 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 875' ' ' ARG . . . . . 1.045 ' NH2' ' O ' ' A' 1201 ' ' HOH . 65.9 mtp85 -66.35 -43.56 85.7 Favored 'General case' 0 C--O 1.233 0.228 0 C-N-CA 119.287 -0.965 . . . . 92.78 111.67 -179.77 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 876' ' ' GLU . . . . . . . . . . . . . 87.1 mt-10 -67.13 -39.6 86.63 Favored 'General case' 0 C--O 1.238 0.484 0 C-N-CA 120.202 -0.599 . . . . 95.04 111.078 179.984 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 877' ' ' THR . . . . . . . . . . . . . 90.4 m -56.82 -43.84 81.43 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 120.492 -0.483 . . . . 37.65 110.739 174.981 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 878' ' ' THR . . . . . . . . . . . . . 34.1 m -59.0 -41.32 87.39 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-O 120.745 0.307 . . . . 37.47 111.743 176.788 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 879' ' ' MSE . . . . . . . . . . . . . 29.0 tpp -70.14 -42.14 72.96 Favored 'General case' 0 C--N 1.32 -0.679 0 O-C-N 121.981 -0.449 . . . . 89.46 109.936 -176.477 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 880' ' ' TYR . . . . . . . . . . . . . 41.3 m-85 -55.0 -49.19 72.12 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 119.974 -0.69 . . . . 55.77 111.276 170.758 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 881' ' ' LEU . . . . . . . . . . . . . 63.5 tp -59.2 -43.99 92.25 Favored 'General case' 0 C--O 1.235 0.334 0 C-N-CA 120.769 -0.373 . . . . 40.03 111.017 -178.43 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 882' ' ' ILE . . . . . . . . . . . . . 50.9 mt -60.74 -49.06 86.07 Favored 'Isoleucine or valine' 0 C--O 1.238 0.451 0 CA-C-O 121.348 0.594 . . . . 42.85 110.538 -177.628 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 883' ' ' ILE . . . . . . . . . . . . . 96.9 mt -65.04 -39.29 85.17 Favored 'Isoleucine or valine' 0 C--O 1.237 0.426 0 C-N-CA 119.871 -0.732 . . . . 45.34 110.628 -177.996 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 884' ' ' GLY . . . . . . . . . . . . . . . -58.66 -50.07 70.89 Favored Glycine 0 C--N 1.335 0.502 0 C-N-CA 120.595 -0.812 . . . . 44.2 112.617 173.899 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 885' ' ' LEU . . . . . . . . . . . . . 91.3 mt -67.08 -40.02 86.92 Favored 'General case' 0 C--O 1.239 0.53 0 O-C-N 122.128 -0.631 . . . . 42.81 111.858 179.529 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 886' ' ' GLU . . . . . 0.656 ' OE2' ' O ' ' A' 1203 ' ' HOH . 85.1 mt-10 -59.22 -42.32 90.72 Favored 'General case' 0 C--O 1.238 0.483 0 C-N-CA 118.509 -1.276 . . . . 60.7 111.24 176.871 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 887' ' ' ASN . . . . . . . . . . . . . 44.2 m-80 -74.38 -34.2 63.26 Favored 'General case' 0 C--O 1.239 0.546 0 C-N-CA 117.885 -1.526 . . . . 60.45 111.244 -177.67 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 888' ' ' PHE . . . . . . . . . . . . . 58.3 t80 -56.39 -45.9 80.37 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 120.045 -0.662 . . . . 47.99 110.5 171.279 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 889' ' ' GLN . . . . . . . . . . . . . 18.9 tt0 -67.45 -34.68 77.68 Favored 'General case' 0 CA--C 1.518 -0.26 0 C-N-CA 119.031 -1.068 . . . . 87.56 111.492 -175.676 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 890' ' ' ARG . . . . . . . . . . . . . 55.1 mtp85 -72.4 -6.2 41.86 Favored 'General case' 0 N--CA 1.45 -0.437 0 N-CA-C 112.937 0.717 . . . . 74.59 112.937 173.195 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 891' ' ' GLU . . . . . . . . . . . . . 56.1 mt-10 64.28 33.73 11.3 Favored 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 124.195 0.998 . . . . 67.77 111.893 -176.715 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 892' ' ' SER . . . . . . . . . . . . . 4.9 m -99.74 78.52 2.15 Favored 'General case' 0 CA--C 1.516 -0.327 0 N-CA-C 105.905 -1.887 . . . . 67.6 105.905 171.762 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 893' ' ' TYR . . . . . . . . . . . . . 63.7 m-85 -73.66 -31.22 63.36 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 118.09 -1.444 . . . . 54.14 111.68 -165.061 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 894' ' ' ILE . . . . . . . . . . . . . 83.3 mt -60.5 -48.92 86.42 Favored 'Isoleucine or valine' 0 C--N 1.346 0.432 0 C-N-CA 119.419 -0.913 . . . . 59.25 110.534 176.442 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 895' ' ' ASP . . . . . . . . . . . . . 87.6 m-20 -64.61 -38.12 89.92 Favored 'General case' 0 C--O 1.236 0.375 0 O-C-N 121.757 -0.59 . . . . 71.62 111.181 179.248 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 896' ' ' SER . . . . . . . . . . . . . 45.2 t -63.32 -44.04 96.09 Favored 'General case' 0 C--O 1.235 0.328 0 N-CA-C 112.454 0.538 . . . . 46.39 112.454 -178.282 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 897' ' ' LEU . . . . . . . . . . . . . 53.3 tp -60.68 -49.07 78.99 Favored 'General case' 0 C--O 1.239 0.511 0 C-N-CA 120.565 -0.454 . . . . 49.25 111.946 -157.724 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 898' ' ' LEU . . . . . . . . . . . . . 12.7 tp -64.4 -38.53 91.35 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 119.508 -0.877 . . . . 63.5 111.491 -175.485 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 899' ' ' PHE . . . . . . . . . . . . . 75.7 m-85 -59.02 -43.75 91.61 Favored 'General case' 0 C--O 1.244 0.768 0 C-N-CA 119.572 -0.851 . . . . 50.36 111.935 173.297 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 900' ' ' LEU . . . . . . . . . . . . . 92.8 mt -67.53 -38.33 84.05 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 118.157 -1.417 . . . . 38.09 111.265 -178.911 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 901' ' ' ILE . . . . . . . . . . . . . 30.2 mt -65.35 -40.68 89.22 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.519 0 CA-C-O 121.191 0.519 . . . . 43.88 109.963 179.133 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 902' ' ' CYS . . . . . . . . . . . . . 50.0 t -66.67 -42.91 85.82 Favored 'General case' 0 C--O 1.239 0.501 0 C-N-CA 119.952 -0.699 . . . . 47.42 110.574 178.382 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 903' ' ' ALA . . . . . . . . . . . . . . . -60.74 -46.06 91.9 Favored 'General case' 0 CA--C 1.52 -0.193 0 C-N-CA 120.612 -0.435 . . . . 36.2 111.134 179.168 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 904' ' ' TYR . . . . . . . . . . . . . 11.8 t80 -57.86 -45.68 85.93 Favored 'General case' 0 C--O 1.239 0.531 0 CA-C-O 120.974 0.416 . . . . 47.68 111.196 -179.463 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 905' ' ' GLN . . . . . . . . . . . . . 7.6 tp60 -71.69 -43.67 65.57 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 120.036 -0.666 . . . . 59.63 111.32 -174.802 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 906' ' ' ASN . . . . . . . . . . . . . 12.5 m-80 -57.85 -39.86 78.73 Favored 'General case' 0 CA--C 1.514 -0.412 0 C-N-CA 120.376 -0.53 . . . . 57.81 110.89 173.172 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 907' ' ' ASN . . . . . . . . . . . . . 55.8 t30 -64.98 -40.33 94.81 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 120.164 -0.614 . . . . 38.84 111.359 -176.9 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 908' ' ' LYS . . . . . . . . . . . . . 69.6 mmtt -62.11 -36.35 81.47 Favored 'General case' 0 C--O 1.235 0.307 0 C-N-CA 120.991 -0.284 . . . . 58.34 110.943 175.748 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 909' ' ' GLU . . . . . . . . . . . . . 85.0 mt-10 -66.74 -42.2 86.6 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 120.659 -0.417 . . . . 51.88 111.578 176.413 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 910' ' ' LEU . . . . . . . . . . . . . 96.9 mt -57.61 -52.45 65.39 Favored 'General case' 0 C--O 1.233 0.218 0 O-C-N 121.48 -0.763 . . . . 40.0 111.014 173.108 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 911' ' ' LEU . . . . . . . . . . . . . 79.6 mt -69.38 -15.11 63.24 Favored 'General case' 0 C--O 1.237 0.438 0 C-N-CA 119.619 -0.833 . . . . 46.33 112.5 -172.695 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 912' ' ' SER . . . . . . . . . . . . . 14.1 m -49.43 -34.75 17.35 Favored 'General case' 0 C--O 1.235 0.32 0 N-CA-C 112.209 0.448 . . . . 51.69 112.209 167.726 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 913' ' ' LYS . . . . . . . . . . . . . 77.9 mttt -94.78 -12.43 27.1 Favored 'General case' 0 CA--C 1.515 -0.39 0 N-CA-C 113.063 0.764 . . . . 70.02 113.063 -172.426 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 914' ' ' GLY . . . . . . . . . . . . . . . 165.53 161.1 13.78 Favored Glycine 0 N--CA 1.448 -0.502 0 C-N-CA 119.779 -1.201 . . . . 44.94 114.062 177.745 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 915' ' ' LEU . . . . . . . . . . . . . 89.8 mt -65.95 -29.81 70.27 Favored 'General case' 0 CA--C 1.513 -0.469 0 CA-C-N 115.126 -0.537 . . . . 60.47 112.303 -169.425 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 916' ' ' TYR . . . . . . . . . . . . . 65.3 m-85 -105.3 18.43 22.29 Favored 'General case' 0 N--CA 1.463 0.179 0 N-CA-C 112.983 0.734 . . . . 62.14 112.983 -172.507 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 917' ' ' ARG . . . . . . . . . . . . . 14.5 mmt180 -81.39 -17.01 50.47 Favored 'General case' 0 CA--C 1.512 -0.499 0 N-CA-C 113.886 1.069 . . . . 42.85 113.886 -176.363 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . -142.75 -147.32 4.75 Favored Glycine 0 N--CA 1.447 -0.602 0 C-N-CA 120.441 -0.885 . . . . 38.49 112.874 -162.754 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 919' ' ' HIS . . . . . . . . . . . . . 91.9 m-70 -122.9 165.92 15.9 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-O 122.083 0.944 . . . . 42.8 110.365 -174.551 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 920' ' ' ASP . . . . . . . . . . . . . 66.0 t0 -50.44 109.38 0.3 Allowed 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 114.91 -1.041 . . . . 65.62 113.18 -178.534 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 921' ' ' GLU . . . . . . . . . . . . . 30.7 mt-10 -63.4 -41.8 98.76 Favored 'General case' 0 C--O 1.233 0.206 0 N-CA-C 112.154 0.428 . . . . 68.15 112.154 -176.839 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 922' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -65.09 -32.52 74.26 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 119.052 -1.059 . . . . 93.54 111.416 -177.657 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 923' ' ' LEU . . . . . . . . . . . . . 8.6 tt -66.38 -52.79 43.14 Favored 'General case' 0 C--O 1.243 0.712 0 O-C-N 122.314 -0.241 . . . . 51.59 111.225 176.817 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 924' ' ' ILE . . . . . . . . . . . . . 15.8 mt -63.57 -41.84 94.05 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.307 0 C-N-CA 120.153 -0.619 . . . . 44.32 110.328 -179.974 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 925' ' ' SER . . . . . . . . . . . . . 34.5 t -55.15 -43.53 74.32 Favored 'General case' 0 C--O 1.238 0.477 0 C-N-CA 120.461 -0.495 . . . . 53.85 111.518 174.235 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 926' ' ' HIS . . . . . . . . . . . . . 40.4 t-80 -62.49 -47.37 84.27 Favored 'General case' 0 C--O 1.238 0.466 0 C-N-CA 120.551 -0.46 . . . . 49.51 111.207 -178.263 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 927' ' ' TYR . . . . . . . . . . . . . 51.4 m-85 -77.81 -33.13 52.57 Favored 'General case' 0 CA--C 1.515 -0.366 0 C-N-CA 119.248 -0.981 . . . . 50.8 112.444 -173.124 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 928' ' ' ARG . . . . . . . . . . . . . 30.7 ttp180 -60.82 -45.17 95.48 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 119.166 -1.013 . . . . 42.55 110.615 173.937 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 929' ' ' ARG . . . . . 0.588 ' NH2' ' O ' ' A' 1207 ' ' HOH . 34.2 ttp-105 -66.68 -46.84 74.34 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 111.802 0.297 . . . . 51.35 111.802 -179.511 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 930' ' ' GLU . . . . . . . . . . . . . 74.5 mm-40 -65.02 -33.25 75.59 Favored 'General case' 0 CA--C 1.517 -0.305 0 C-N-CA 120.461 -0.496 . . . . 71.58 111.828 178.987 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 931' ' ' CYS . . . . . . . . . . . . . 29.7 t -68.7 -37.72 79.74 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 118.958 -1.097 . . . . 44.06 110.894 178.469 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 932' ' ' LEU . . . . . . . . . . . . . 42.5 mt -61.65 -46.39 89.95 Favored 'General case' 0 C--O 1.237 0.402 0 O-C-N 121.854 -0.529 . . . . 56.97 111.127 174.408 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 933' ' ' LEU . . . . . . . . . . . . . 44.4 mt -64.78 -37.85 88.99 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 120.066 -0.654 . . . . 52.75 111.387 -177.385 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 934' ' ' LYS . . . . . . . . . . . . . 53.6 mmtt -70.23 -39.4 75.11 Favored 'General case' 0 C--O 1.235 0.311 0 C-N-CA 119.52 -0.872 . . . . 79.65 111.11 -179.504 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 935' ' ' LEU . . . . . . . . . . . . . 7.6 tp -65.17 -39.33 92.77 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 119.44 -0.904 . . . . 46.91 110.835 174.851 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 936' ' ' ASN . . . . . 0.687 ' ND2' ' O ' ' A' 1205 ' ' HOH . 19.2 t30 -62.13 -44.25 97.04 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 120.013 -0.675 . . . . 52.96 110.571 176.322 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 937' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -55.76 -43.87 77.11 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-O 120.768 0.318 . . . . 92.54 111.306 173.48 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 938' ' ' GLN . . . . . 0.85 ' OE1' ' O ' ' A' 1202 ' ' HOH . 50.9 tt0 -61.59 -45.73 92.87 Favored 'General case' 0 C--O 1.234 0.244 0 O-C-N 121.907 -0.496 . . . . 56.77 111.187 179.0 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 939' ' ' ALA . . . . . . . . . . . . . . . -63.52 -39.5 94.58 Favored 'General case' 0 C--O 1.238 0.481 0 N-CA-C 112.184 0.439 . . . . 53.66 112.184 178.212 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 940' ' ' ALA . . . . . . . . . . . . . . . -70.5 -40.94 73.27 Favored 'General case' 0 C--O 1.236 0.395 0 C-N-CA 120.34 -0.544 . . . . 55.18 111.045 -176.412 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 941' ' ' GLU . . . . . . . . . . . . . 94.0 mt-10 -64.89 -34.42 78.35 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 120.126 -0.629 . . . . 89.14 111.098 178.804 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 942' ' ' LEU . . . . . . . . . . . . . 29.9 mt -58.95 -44.58 91.48 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 120.079 -0.649 . . . . 54.65 110.758 169.33 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 943' ' ' PHE . . . . . . . . . . . . . 74.1 t80 -63.82 -43.34 96.54 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 120.524 -0.47 . . . . 72.65 111.399 -179.712 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 944' ' ' GLU . . . . . 0.517 ' OE2' ' OH ' ' A' ' 992' ' ' TYR . 81.4 mt-10 -63.34 -22.52 66.93 Favored 'General case' 0 CA--C 1.517 -0.298 0 N-CA-C 112.45 0.537 . . . . 73.68 112.45 -177.778 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 945' ' ' SER . . . . . . . . . . . . . 15.7 p -61.04 -34.89 75.57 Favored 'General case' 0 C--O 1.235 0.325 0 C-N-CA 120.215 -0.594 . . . . 77.41 111.88 179.73 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 946' ' ' GLY . . . . . . . . . . . . . . . 84.19 9.3 82.38 Favored Glycine 0 N--CA 1.448 -0.536 0 N-CA-C 116.158 1.223 . . . . 99.52 116.158 175.824 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 947' ' ' GLU . . . . . . . . . . . . . 75.2 mm-40 -98.29 145.21 26.89 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 118.948 1.374 . . . . 106.02 110.201 178.195 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 948' ' ' ASP . . . . . 0.413 ' OD1' ' NE2' ' A' 1000 ' ' HIS . 75.9 m-20 -62.91 -45.1 94.07 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-N 115.912 -0.585 . . . . 109.48 111.819 -166.441 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 949' ' ' ARG . . . . . . . . . . . . . 58.7 mtt180 -63.94 -47.05 82.02 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 119.906 -0.717 . . . . 80.55 111.0 179.142 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 950' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -67.0 -37.55 84.4 Favored 'General case' 0 C--O 1.237 0.405 0 O-C-N 122.189 -0.32 . . . . 104.27 111.81 -177.613 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 951' ' ' VAL . . . . . . . . . . . . . 24.4 t -62.35 -48.2 89.46 Favored 'Isoleucine or valine' 0 C--O 1.234 0.283 0 C-N-CA 119.837 -0.745 . . . . 68.33 110.208 175.792 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 952' ' ' ASN . . . . . . . . . . . . . 92.4 m-20 -60.67 -38.08 83.72 Favored 'General case' 0 C--O 1.234 0.258 0 C-N-CA 120.001 -0.679 . . . . 81.68 111.11 179.066 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 953' ' ' ASN . . . . . . . . . . . . . 91.5 m-20 -68.06 -40.65 82.71 Favored 'General case' 0 CA--C 1.513 -0.449 0 C-N-CA 120.704 -0.398 . . . . 64.81 111.253 -179.754 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 954' ' ' GLY . . . . . . . . . . . . . . . -64.01 -42.66 98.13 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 119.87 -1.157 . . . . 53.31 112.147 177.482 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 955' ' ' LEU . . . . . . . . . . . . . 48.1 mt -66.86 -30.92 71.22 Favored 'General case' 0 C--O 1.236 0.393 0 O-C-N 122.426 -0.455 . . . . 60.27 111.687 177.511 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 956' ' ' ILE . . . . . . . . . . . . . 24.7 mt -68.72 -37.72 77.9 Favored 'Isoleucine or valine' 0 C--O 1.236 0.382 0 C-N-CA 119.706 -0.798 . . . . 60.36 110.525 175.557 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 957' ' ' ILE . . . . . . . . . . . . . 73.8 mt -59.43 -48.63 86.5 Favored 'Isoleucine or valine' 0 C--O 1.237 0.421 0 O-C-N 121.669 -0.644 . . . . 51.22 110.635 173.889 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 958' ' ' MSE . . . . . . . . . . . . . 95.9 mmm -60.89 -45.03 96.21 Favored 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 119.584 -0.847 . . . . 68.13 111.211 -178.608 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 959' ' ' ASN . . . . . . . . . . . . . 69.6 m-20 -74.81 -28.4 60.69 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 112.924 0.712 . . . . 59.31 112.924 -176.735 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 960' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -85.77 -41.7 14.85 Favored 'General case' 0 C--O 1.236 0.354 0 C-N-CA 119.928 -0.709 . . . . 96.48 112.591 -177.628 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 961' ' ' PHE . . . . . . . . . . . . . 69.1 m-85 -112.03 -20.13 12.08 Favored 'General case' 0 C--O 1.232 0.168 0 N-CA-C 115.255 1.576 . . . . 58.77 115.255 -166.948 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 962' ' ' ILE . . . . . . . . . . . . . 11.9 mm -112.66 -63.1 2.01 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 119.589 1.086 . . . . 59.62 111.284 -169.95 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 963' ' ' VAL . . . . . . . . . . . . . 51.1 t -47.7 -44.41 56.01 Favored Pre-proline 0 C--O 1.249 1.075 0 CA-C-O 118.371 -0.823 . . . . 55.32 112.359 -179.726 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 964' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -63.92 -21.23 68.88 Favored 'Trans proline' 0 C--O 1.236 0.413 0 CA-C-N 122.029 1.76 . . . . 57.51 114.678 -178.688 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 965' ' ' PHE . . . . . . . . . . . . . 63.8 m-85 -108.5 -5.06 16.75 Favored 'General case' 0 C--O 1.241 0.637 0 N-CA-C 114.523 1.305 . . . . 56.54 114.523 -177.297 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 966' ' ' LEU . . . . . . . . . . . . . 16.1 mt -46.53 -43.85 39.15 Favored Pre-proline 0 C--O 1.242 0.696 0 CA-C-O 117.934 -1.032 . . . . 69.02 113.609 169.997 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 967' ' ' PRO . . . . . . . . . . . . . 77.1 Cg_exo -57.79 -29.4 85.81 Favored 'Trans proline' 0 C--O 1.235 0.33 0 CA-C-N 121.193 1.462 . . . . 68.42 113.897 176.201 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 968' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -62.84 -35.17 79.06 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-N 118.998 0.817 . . . . 69.16 111.946 178.129 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 969' ' ' LEU . . . . . . . . . . . . . 7.1 mp -87.34 -1.02 57.62 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 119.584 -0.846 . . . . 64.62 113.102 -177.045 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 970' ' ' LEU . . . . . . . . . . . . . 31.5 mt -107.49 -1.31 21.51 Favored 'General case' 0 C--O 1.233 0.228 0 N-CA-C 113.174 0.805 . . . . 76.03 113.174 176.92 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 971' ' ' VAL . . . . . . . . . . . . . 35.4 m -62.07 -27.21 42.01 Favored 'Isoleucine or valine' 0 C--O 1.239 0.511 0 CA-C-N 118.68 0.673 . . . . 81.09 112.414 -173.356 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 972' ' ' ASP . . . . . . . . . . . . . 50.6 t0 -133.26 114.18 13.49 Favored 'General case' 0 C--O 1.236 0.359 0 O-C-N 121.374 -0.829 . . . . 95.75 110.749 -168.425 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 973' ' ' GLU . . . . . . . . . . . . . . . -66.33 -21.83 66.26 Favored 'General case' 0 C--O 1.238 0.476 0 N-CA-C 112.925 0.713 . . . . 94.44 112.925 179.085 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 974' ' ' MSE . . . . . . . . . . . . . 84.6 mmm -73.46 -23.46 60.09 Favored 'General case' 0 N--CA 1.463 0.186 0 N-CA-C 113.082 0.771 . . . . 158.08 113.082 176.745 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 975' ' ' GLU . . . . . . . . . . . . . 63.2 mm-40 -83.09 74.56 9.97 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 122.748 1.261 . . . . 87.98 108.361 175.771 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 976' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -68.23 -34.1 75.62 Favored 'General case' 0 C--O 1.238 0.458 0 CA-C-N 114.499 -1.228 . . . . 120.58 112.144 -168.174 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 977' ' ' LYS . . . . . . . . . . . . . 92.0 mttt -65.16 -34.69 78.98 Favored 'General case' 0 C--O 1.237 0.441 0 C-N-CA 120.136 -0.625 . . . . 86.55 111.991 179.56 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 92.6 m-20 -69.18 -39.86 78.44 Favored 'General case' 0 C--O 1.235 0.318 0 C-N-CA 120.789 -0.364 . . . . 65.76 111.576 176.499 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 979' ' ' ILE . . . . . . . . . . . . . 47.6 mm -61.34 -47.23 94.42 Favored 'Isoleucine or valine' 0 C--O 1.235 0.31 0 N-CA-C 109.771 -0.455 . . . . 72.91 109.771 177.273 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 980' ' ' LEU . . . . . . . . . . . . . 93.3 mt -64.95 -33.77 76.82 Favored 'General case' 0 C--O 1.238 0.467 0 CA-C-N 116.631 -0.259 . . . . 74.35 111.335 -179.148 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 981' ' ' ALA . . . . . . . . . . . . . . . -68.58 -40.14 80.68 Favored 'General case' 0 N--CA 1.455 -0.178 0 C-N-CA 119.889 -0.725 . . . . 54.97 111.333 178.702 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 982' ' ' VAL . . . . . . . . . . . . . 49.4 t -63.12 -41.24 92.1 Favored 'Isoleucine or valine' 0 C--O 1.239 0.531 0 C-N-CA 119.673 -0.811 . . . . 54.83 110.193 175.982 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 983' ' ' GLU . . . . . 0.546 ' O ' ' ND2' ' A' ' 987' ' ' ASN . 65.7 mm-40 -65.55 -35.95 82.37 Favored 'General case' 0 N--CA 1.463 0.199 0 C-N-CA 119.928 -0.709 . . . . 94.69 111.691 177.382 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 984' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -66.85 -41.28 87.62 Favored 'General case' 0 C--O 1.239 0.553 0 O-C-N 121.999 -0.438 . . . . 99.47 111.058 178.433 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 985' ' ' MSE . . . . . . . . . . . . . 3.3 mtm -65.61 -39.75 91.89 Favored 'General case' 0 C--O 1.233 0.196 0 C-N-CA 120.462 -0.495 . . . . 81.25 111.255 177.168 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 986' ' ' ARG . . . . . . . . . . . . . 91.7 mtt180 -67.06 -42.8 84.15 Favored 'General case' 0 C--O 1.24 0.585 0 C-N-CA 120.602 -0.439 . . . . 63.7 111.894 178.79 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 987' ' ' ASN . . . . . 0.546 ' ND2' ' O ' ' A' ' 983' ' ' GLU . 68.8 m-80 -59.62 -41.31 90.11 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 120.067 -0.653 . . . . 84.24 110.802 177.511 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 988' ' ' ARG . . . . . . . . . . . . . 11.9 tpt180 -56.34 -49.92 72.99 Favored 'General case' 0 CA--C 1.519 -0.223 0 CA-C-O 120.782 0.325 . . . . 69.96 110.642 -177.529 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 989' ' ' TRP . . . . . . . . . . . . . 80.0 m95 -71.9 -30.19 65.12 Favored 'General case' 0 C--O 1.238 0.463 0 N-CA-C 112.455 0.539 . . . . 58.5 112.455 -177.985 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 990' ' ' CYS . . . . . . . . . . . . . 99.0 m -72.05 -31.32 66.03 Favored 'General case' 0 C--O 1.237 0.439 0 N-CA-C 112.289 0.477 . . . . 64.75 112.289 175.075 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 991' ' ' SER . . . . . . . . . . . . . 70.4 p -64.22 -14.74 57.42 Favored 'General case' 0 C--O 1.232 0.171 0 C-N-CA 119.096 -1.042 . . . . 70.59 112.416 -177.919 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 992' ' ' TYR . . . . . 0.517 ' OH ' ' OE2' ' A' ' 944' ' ' GLU . 25.7 m-85 -73.84 -15.17 61.17 Favored 'General case' 0 C--O 1.238 0.467 0 CA-C-N 118.962 0.801 . . . . 80.33 112.563 174.882 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 993' ' ' LEU . . . . . . . . . . . . . 74.9 mt -58.25 -40.13 80.98 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 119.919 -0.712 . . . . 91.76 111.077 168.03 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 994' ' ' GLY . . . . . . . . . . . . . . . -71.04 7.19 5.89 Favored Glycine 0 C--N 1.342 0.909 0 CA-C-O 118.769 -1.017 . . . . 106.81 115.568 175.087 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 995' ' ' GLN . . . . . . . . . . . . . . . -116.69 143.55 45.51 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-N 118.558 1.179 . . . . 103.45 110.399 175.79 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 996' ' ' GLU . . . . . . . . . . . . . . . -92.76 135.9 33.71 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.275 -0.42 . . . . 105.18 109.915 176.793 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 997' ' ' MSE . . . . . . . . . . . . . 2.0 ptt? -157.33 177.93 10.89 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.322 -0.399 . . . . 127.69 111.956 -173.994 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 998' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -54.6 133.64 64.03 Favored Pre-proline 0 C--O 1.24 0.555 0 N-CA-C 109.797 -0.445 . . . . 119.2 109.797 177.314 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 999' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -68.39 -30.28 30.14 Favored 'Trans proline' 0 C--O 1.237 0.457 0 N-CA-C 114.114 0.775 . . . . 95.54 114.114 -171.78 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1000 ' ' HIS . . . . . 0.413 ' NE2' ' OD1' ' A' ' 948' ' ' ASP . 15.9 p-80 -69.3 -27.89 65.79 Favored 'General case' 0 C--O 1.239 0.502 0 C-N-CA 118.44 -1.304 . . . . 126.38 110.672 178.27 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A 1001 ' ' LEU . . . . . . . . . . . . . 40.9 mt -71.33 -34.53 70.63 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 120.678 -0.409 . . . . 97.81 111.115 169.23 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1002 ' ' GLN . . . . . . . . . . . . . 14.0 tp60 -66.09 -36.56 83.5 Favored 'General case' 0 CA--C 1.516 -0.332 0 C-N-CA 119.37 -0.932 . . . . 113.03 111.171 176.799 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1003 ' ' GLU . . . . . . . . . . . . . . . -60.87 -37.82 83.47 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 119.942 -0.703 . . . . 81.26 110.758 171.956 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1004 ' ' LYS . . . . . . . . . . . . . 47.4 mttm -64.38 -48.57 74.94 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 120.109 -0.636 . . . . 86.62 111.096 177.616 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1005 ' ' LEU . . . . . . . . . . . . . 59.1 tp -58.09 -40.25 80.65 Favored 'General case' 0 C--O 1.238 0.478 0 C-N-CA 120.438 -0.505 . . . . 66.89 111.067 177.793 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1006 ' ' THR . . . . . . . . . . . . . 1.3 m -65.42 -39.44 92.13 Favored 'General case' 0 C--O 1.237 0.406 0 N-CA-C 112.144 0.424 . . . . 76.46 112.144 -176.654 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1007 ' ' ASP . . . . . . . . . . . . . 73.5 m-20 -73.04 -28.37 62.3 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 120.076 -0.649 . . . . 100.74 111.693 176.695 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1008 ' ' PHE . . . . . . . . . . . . . 38.4 t80 -78.66 -40.42 34.09 Favored 'General case' 0 C--O 1.238 0.492 0 N-CA-C 112.649 0.611 . . . . 58.15 112.649 -175.614 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1009 ' ' LEU . . . . . . . . . . . . . 37.7 mt -57.13 -43.11 99.15 Favored Pre-proline 0 C--O 1.244 0.816 0 N-CA-C 113.864 1.061 . . . . 61.6 113.864 -171.099 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1010 ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -55.83 -36.39 95.31 Favored 'Trans proline' 0 C--O 1.237 0.432 0 CA-C-N 121.763 1.665 . . . . 72.59 112.793 175.238 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1011 ' ' LYS . . . . . . . . . . . . . 58.0 mttp -60.15 -43.32 95.83 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-N 117.899 0.318 . . . . 82.56 111.23 177.316 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1012 ' ' LEU . . . . . . . . . . . . . 47.6 tp -73.67 -29.98 62.63 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 120.807 -0.357 . . . . 63.39 111.602 -178.449 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1013 ' ' LEU . . . . . . . . . . . . . 19.6 mt -98.71 7.31 46.24 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 113.014 0.746 . . . . 81.05 113.014 -174.387 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1014 ' ' ASP . . . . . . . . . . . . . 35.0 t0 -63.82 139.38 58.76 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-N 118.408 0.549 . . . . 107.62 111.35 -171.723 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1015 ' ' CYS . . . . . . . . . . . . . 43.1 m -75.12 -27.39 59.8 Favored 'General case' 0 C--O 1.236 0.379 0 CA-C-N 115.348 -0.842 . . . . 115.9 112.395 178.487 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1016 ' ' SER . . . . . . . . . . . . . 27.6 m -63.51 139.58 58.78 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 121.413 0.625 . . . . 112.13 111.285 -172.802 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1017 ' ' MSE . . . . . . . . . . . . . 3.5 mmt -100.05 21.59 12.55 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.38 -0.827 . . . . 170.84 110.965 -179.178 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1018 ' ' GLU . . . . . . . . . . . . . . . -64.68 118.76 9.38 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-N 116.191 -0.459 . . . . 120.2 110.421 -176.826 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1019 ' ' ILE . . . . . . . . . . . . . 3.7 tp -149.4 133.97 9.52 Favored 'Isoleucine or valine' 0 C--O 1.235 0.337 0 N-CA-C 107.636 -1.246 . . . . 99.01 107.636 176.705 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1020 ' ' LYS . . . . . . . . . . . . . . . -56.52 145.74 27.08 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 121.132 0.492 . . . . 77.12 109.838 178.359 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1021 ' ' SER . . . . . . . . . . . . . 17.6 p -83.0 -24.98 32.64 Favored 'General case' 0 C--N 1.331 -0.205 0 C-N-CA 118.693 -1.203 . . . . 69.52 112.1 -172.02 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1022 ' ' PHE . . . . . . . . . . . . . 78.1 t80 -120.42 131.67 54.9 Favored 'General case' 0 CA--C 1.518 -0.287 0 CA-C-N 118.601 0.637 . . . . 57.37 109.546 177.762 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1023 ' ' HIS . . . . . . . . . . . . . 17.7 t-80 -121.33 134.7 55.14 Favored 'General case' 0 C--O 1.24 0.563 0 N-CA-C 108.49 -0.93 . . . . 73.6 108.49 172.073 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1024 ' ' GLU . . . . . . . . . . . . . 39.1 tp10 -68.41 135.58 90.91 Favored Pre-proline 0 C--N 1.319 -0.754 0 N-CA-C 109.184 -0.673 . . . . 92.27 109.184 177.816 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1025 ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -77.28 152.49 30.73 Favored 'Trans proline' 0 C--N 1.331 -0.358 0 CA-C-N 119.216 0.756 . . . . 56.25 111.45 -177.898 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1026 ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -60.26 157.44 35.3 Favored 'Trans proline' 0 C--N 1.331 -0.376 0 N-CA-C 109.766 -0.898 . . . . 60.76 109.766 173.539 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1027 ' ' LYS . . . . . . . . . . . . . . . -75.9 137.13 40.19 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.604 -0.726 . . . . 65.97 109.817 -177.023 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1028 ' ' LEU . . . . . . . . . . . . . 34.5 mt -101.75 126.51 33.82 Favored Pre-proline 0 C--O 1.237 0.419 0 C-N-CA 124.042 0.937 . . . . 64.08 109.588 173.513 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1029 ' ' PRO . . . . . . . . . . . . . 35.3 Cg_exo -66.08 151.34 84.04 Favored 'Trans proline' 0 C--N 1.329 -0.496 0 N-CA-C 109.415 -1.033 . . . . 69.67 109.415 168.733 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1030 ' ' SER . . . . . . . . . . . . . 78.8 p -59.63 146.29 41.54 Favored 'General case' 0 C--O 1.234 0.251 0 C-N-CA 119.969 -0.692 . . . . 71.81 109.215 176.446 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1031 ' ' TYR . . . . . . . . . . . . . 34.3 p90 -148.49 147.96 29.69 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.674 -0.694 . . . . 64.41 109.133 -174.017 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1032 ' ' SER . . . . . . . . . . . . . 90.7 p -90.94 161.41 15.19 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.769 0.795 . . . . 69.91 110.601 172.023 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1033 ' ' THR . . . . . . . . . . . . . 62.4 m -61.08 -37.07 81.37 Favored 'General case' 0 C--O 1.239 0.549 0 CA-C-N 115.272 -0.877 . . . . 61.03 110.163 178.149 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1034 ' ' HIS . . . . . 0.523 ' NE2' ' OE2' ' A' 1038 ' ' GLU . 33.4 t-80 -56.03 -45.79 79.04 Favored 'General case' 0 C--O 1.243 0.729 0 CA-C-N 115.794 -0.639 . . . . 103.24 111.244 175.29 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A 1035 ' ' GLU . . . . . . . . . . . . . 58.6 mt-10 -63.77 -44.24 93.98 Favored 'General case' 0 CA--C 1.517 -0.3 0 O-C-N 122.089 -0.382 . . . . 96.86 111.462 177.113 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1036 ' ' LEU . . . . . . . . . . . . . 37.0 tp -52.82 -55.54 22.3 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-O 121.107 0.48 . . . . 51.85 111.114 179.472 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1037 ' ' CYS . . . . . . . . . . . . . 71.0 m -62.93 -44.76 95.19 Favored 'General case' 0 CA--C 1.52 -0.176 0 CA-C-N 116.112 -0.495 . . . . 52.02 111.391 -177.274 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1038 ' ' GLU . . . . . 0.523 ' OE2' ' NE2' ' A' 1034 ' ' HIS . 59.3 mt-10 -72.74 -38.87 67.26 Favored 'General case' 0 C--O 1.24 0.557 0 C-N-CA 119.922 -0.711 . . . . 79.63 111.983 -175.28 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A 1039 ' ' ARG . . . . . . . . . . . . . 80.2 mtp180 -70.75 -31.08 67.77 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 117.422 -1.711 . . . . 54.01 110.494 178.767 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1040 ' ' PHE . . . . . . . . . . . . . 86.9 t80 -63.58 -48.81 75.9 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 120.099 -0.64 . . . . 49.7 110.395 176.106 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1041 ' ' ALA . . . . . . . . . . . . . . . -58.58 -41.72 86.4 Favored 'General case' 0 C--O 1.238 0.468 0 CA-C-N 116.241 -0.436 . . . . 46.11 111.157 178.269 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1042 ' ' ARG . . . . . . . . . . . . . 6.3 ttm-85 -70.16 -39.02 75.58 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 120.845 -0.342 . . . . 85.96 111.849 -173.974 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1043 ' ' ILE . . . . . . . . . . . . . 8.8 tp -76.93 -34.03 21.68 Favored 'Isoleucine or valine' 0 C--O 1.238 0.482 0 C-N-CA 117.924 -1.51 . . . . 50.67 110.547 -179.833 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1044 ' ' MSE . . . . . . . . . . . . . 91.9 mmm -64.14 -33.29 75.45 Favored 'General case' 0 C--N 1.329 -0.312 0 O-C-N 121.305 -0.872 . . . . 77.31 111.08 177.62 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 22.9 mt -80.14 -24.54 40.37 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 113.683 0.994 . . . . 62.73 113.683 -179.552 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1046 ' ' SER . . . . . . . . . . . . . 92.0 p -97.42 -10.65 25.07 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 118.216 -1.394 . . . . 65.34 112.817 -177.046 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1047 ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -72.56 130.56 40.89 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 118.071 0.396 . . . . 77.35 111.315 -178.22 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A 1048 ' ' SER . . . . . 0.409 ' O ' ' OG ' ' A' 1048 ' ' SER . 13.5 p -109.76 104.34 13.29 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 109.107 -0.701 . . . . 101.18 109.107 -178.751 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A 1049 ' ' ARG . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.424 0 CA-C-O 120.709 0.29 . . . . 112.82 110.836 178.072 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1101 ' ' ' CL' . . . . . 1.094 'CL ' ' O ' ' A' 1255 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1102 ' ' ' CL' . . . . . 0.76 'CL ' 'CL ' ' A' 1101 ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1201 ' ' HOH . . . . . 1.045 ' O ' ' NH2' ' A' ' 875' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1202 ' ' HOH . . . . . 0.85 ' O ' ' OE1' ' A' ' 938' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1203 ' ' HOH . . . . . 0.656 ' O ' ' OE2' ' A' ' 886' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1204 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1205 ' ' HOH . . . . . 0.687 ' O ' ' ND2' ' A' ' 936' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1206 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1207 ' ' HOH . . . . . 0.588 ' O ' ' NH2' ' A' ' 929' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1208 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1209 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1210 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1211 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1212 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1213 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1214 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1215 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1216 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1217 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1218 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1219 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1220 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1221 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1222 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1223 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1224 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1225 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1226 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1227 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1228 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1229 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1230 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1231 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1232 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1233 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1234 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1235 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1236 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1237 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1238 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1239 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1240 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1241 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1242 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1243 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1244 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1245 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1246 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1247 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1248 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1249 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1250 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1251 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1252 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1253 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1254 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1255 ' ' HOH . . . . . 1.094 ' O ' 'CL ' ' A' 1101 ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1256 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1257 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 777' ' ' LEU . . . . . . . . . . . . . 38.2 mt . . . . . 0 C--O 1.239 0.51 0 CA-C-O 121.037 0.446 . . . . 116.62 111.966 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 778' ' ' GLN . . . . . . . . . . . . . . . -66.44 -5.64 11.77 Favored 'General case' 0 C--O 1.239 0.506 0 N-CA-C 113.047 0.758 . . . . 103.04 113.047 177.04 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 779' ' ' SER . . . . . . . . . . . . . 57.9 p -115.02 6.06 15.15 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 123.532 0.733 . . . . 87.04 112.936 -174.543 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 780' ' ' ALA . . . . . . . . . . . . . . . -62.57 -34.61 77.31 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 119.615 -0.834 . . . . 81.58 110.615 176.969 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 781' ' ' ILE . . . . . 0.4 ' H ' HG12 ' A' ' 781' ' ' ILE . 1.4 mm -66.94 -37.08 78.69 Favored 'Isoleucine or valine' 0 C--O 1.236 0.357 0 CA-C-O 120.677 0.275 . . . . 80.16 110.642 175.373 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 782' ' ' LYS . . . . . . . . . . . . . . . -70.38 -41.33 73.21 Favored 'General case' 0 C--O 1.233 0.227 0 O-C-N 121.818 -0.551 . . . . 64.07 110.795 179.301 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 783' ' ' LEU . . . . . . . . . . . . . 1.2 mp -58.12 -47.54 82.98 Favored 'General case' 0 C--O 1.236 0.358 0 C-N-CA 120.779 -0.369 . . . . 72.14 110.692 172.912 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 784' ' ' GLU . . . . . . . . . . . . . 24.9 tp10 -65.92 -41.43 91.43 Favored 'General case' 0 C--O 1.234 0.252 0 C-N-CA 119.323 -0.951 . . . . 65.46 111.002 -176.697 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 785' ' ' TYR . . . . . . . . . . . . . 9.6 t80 -59.53 -44.33 93.21 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-O 120.657 0.265 . . . . 77.54 110.701 177.055 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . -66.23 -35.35 80.2 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 120.943 -0.303 . . . . 52.02 111.391 -178.315 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 787' ' ' ARG . . . . . . . . . . . . . 69.7 ttp85 -63.71 -40.9 97.91 Favored 'General case' 0 C--O 1.239 0.519 0 O-C-N 121.984 -0.448 . . . . 60.14 111.77 173.7 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 788' ' ' LEU . . . . . . . . . . . . . 90.9 mt -73.26 -31.24 63.98 Favored 'General case' 0 C--O 1.24 0.578 0 C-N-CA 119.425 -0.91 . . . . 51.72 111.901 -176.799 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 789' ' ' VAL . . . . . . . . . . . . . 42.1 t -58.95 -47.68 88.94 Favored 'Isoleucine or valine' 0 C--O 1.238 0.463 0 CA-C-O 121.083 0.468 . . . . 52.08 110.177 172.372 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 790' ' ' LYS . . . . . . . . . . . . . 58.9 mmtt -58.9 -51.22 70.94 Favored 'General case' 0 C--O 1.238 0.465 0 O-C-N 122.169 -0.332 . . . . 90.16 111.423 177.692 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 791' ' ' LEU . . . . . . . . . . . . . 12.8 tp -53.37 -41.98 66.4 Favored 'General case' 0 C--O 1.242 0.67 0 CA-C-O 120.932 0.396 . . . . 54.42 111.778 172.148 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 792' ' ' ALA . . . . . . . . . . . . . . . -64.93 -28.17 69.35 Favored 'General case' 0 N--CA 1.463 0.181 0 O-C-N 121.835 -0.541 . . . . 49.55 112.306 -177.596 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 793' ' ' GLN . . . . . . . . . . . . . 86.7 mt-30 -93.75 -9.8 36.39 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 113.558 0.947 . . . . 78.19 113.558 -177.197 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 794' ' ' GLU . . . . . . . . . . . . . 17.2 tt0 -62.24 138.58 58.44 Favored 'General case' 0 C--O 1.238 0.48 0 CA-C-N 118.763 0.71 . . . . 96.61 111.888 -178.665 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 795' ' ' ASP . . . . . . . . . . . . . . . -81.52 126.12 31.32 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 115.673 -0.694 . . . . 75.76 109.347 170.389 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 796' ' ' THR . . . . . 0.555 ' O ' 'CL ' ' A' 1101 ' ' ' CL' . 41.8 p -128.75 149.97 73.61 Favored Pre-proline 0 C--O 1.237 0.43 0 CA-C-N 116.436 -0.347 . . . . 64.14 110.143 -172.707 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 797' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_endo -66.2 164.61 27.29 Favored 'Trans proline' 0 C--O 1.242 0.706 0 C-N-CA 120.858 1.038 . . . . 64.31 110.939 176.584 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 798' ' ' PRO . . . . . . . . . . . . . 22.8 Cg_exo -61.05 -25.01 80.66 Favored 'Trans proline' 0 N--CA 1.479 0.627 0 N-CA-C 114.23 0.819 . . . . 56.8 114.23 -172.2 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 799' ' ' GLU . . . . . . . . . . . . . 24.2 pm0 -77.64 -9.23 58.85 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 119.238 -0.985 . . . . 66.79 112.801 -178.671 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 800' ' ' THR . . . . . . . . . . . . . 95.9 m -119.41 123.26 43.66 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 107.697 -1.223 . . . . 57.81 107.697 -172.14 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 801' ' ' ASP . . . . . . . . . . . . . 66.2 t0 -137.77 97.5 3.45 Favored 'General case' 0 C--O 1.239 0.509 0 N-CA-C 107.182 -1.414 . . . . 53.48 107.182 -176.294 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 802' ' ' TYR . . . . . . . . . . . . . 23.4 m-85 -68.52 -8.85 44.94 Favored 'General case' 0 C--O 1.233 0.218 0 C-N-CA 117.995 -1.482 . . . . 50.74 112.464 -175.832 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 803' ' ' ARG . . . . . . . . . . . . . 77.5 mtm180 -62.97 -28.35 70.03 Favored 'General case' 0 C--N 1.348 0.521 0 C-N-CA 118.509 -1.277 . . . . 42.46 110.36 171.453 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 804' ' ' LEU . . . . . . . . . . . . . 78.5 mt -74.92 -19.94 59.92 Favored 'General case' 0 C--O 1.241 0.609 0 CA-C-O 119.117 -0.468 . . . . 43.68 112.169 177.155 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 805' ' ' HIS . . . . . . . . . . . . . 11.4 m80 -81.77 -34.76 30.21 Favored 'General case' 0 C--N 1.347 0.459 0 C-N-CA 120.342 -0.543 . . . . 47.05 111.912 -178.839 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 806' ' ' HIS . . . . . . . . . . . . . 18.6 t-80 -150.9 134.55 16.44 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 118.769 -1.172 . . . . 61.01 109.877 -173.446 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 807' ' ' VAL . . . . . . . . . . . . . 6.2 p -59.58 -32.37 48.95 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 CA-C-N 116.094 -0.503 . . . . 42.16 111.378 178.012 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 808' ' ' VAL . . . . . . . . . . . . . 30.4 t -69.95 -29.76 41.58 Favored 'Isoleucine or valine' 0 C--O 1.24 0.569 0 O-C-N 120.982 -1.074 . . . . 49.6 111.417 -178.099 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 809' ' ' VAL . . . . . . . . . . . . . 97.1 t -64.1 -43.56 97.49 Favored 'Isoleucine or valine' 0 C--O 1.238 0.452 0 C-N-CA 119.739 -0.784 . . . . 43.83 110.87 171.875 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 810' ' ' TYR . . . . . . . . . . . . . 59.2 t80 -56.58 -45.02 81.56 Favored 'General case' 0 C--O 1.241 0.623 0 C-N-CA 119.553 -0.859 . . . . 42.11 110.883 173.399 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 811' ' ' PHE . . . . . . . . . . . . . 16.7 m-30 -62.06 -44.23 97.13 Favored 'General case' 0 C--O 1.24 0.58 0 C-N-CA 119.904 -0.718 . . . . 44.28 111.951 -179.619 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 812' ' ' ILE . . . . . . . . . . . . . 76.6 mt -64.58 -47.47 88.93 Favored 'Isoleucine or valine' 0 C--O 1.239 0.519 0 C-N-CA 120.36 -0.536 . . . . 46.33 110.229 -175.037 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 813' ' ' GLN . . . . . . . . . . . . . 60.7 mt-30 -66.04 -15.58 63.17 Favored 'General case' 0 C--O 1.233 0.213 0 N-CA-C 112.775 0.657 . . . . 51.32 112.775 -179.553 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 814' ' ' ASN . . . . . . . . . . . . . 59.6 m-80 -112.13 24.06 13.02 Favored 'General case' 0 C--O 1.239 0.532 0 N-CA-C 112.841 0.682 . . . . 44.31 112.841 -179.905 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 815' ' ' GLN . . . . . . . . . . . . . 15.4 mp0 57.48 37.57 27.82 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.249 0.547 . . . . 69.07 112.006 171.714 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 816' ' ' ALA . . . . . . . . . . . . . . . -65.47 150.65 95.64 Favored Pre-proline 0 C--N 1.321 -0.661 0 C-N-CA 117.12 -1.832 . . . . 52.75 109.631 174.265 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 817' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -61.51 145.71 97.65 Favored 'Trans proline' 0 C--O 1.235 0.358 0 N-CA-C 110.668 -0.551 . . . . 62.17 110.668 178.951 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 818' ' ' LYS . . . . . . . . . . . . . 7.9 ttmm -55.04 -31.42 61.09 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 119.546 -0.861 . . . . 91.05 111.028 -178.912 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 819' ' ' LYS . . . . . . . . . . . . . . . -74.14 -35.01 64.05 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 120.714 -0.394 . . . . 73.07 111.724 -176.886 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 820' ' ' ILE . . . . . . . . . . . . . 23.7 mm -61.49 -42.36 93.63 Favored 'Isoleucine or valine' 0 C--O 1.235 0.296 0 CA-C-O 121.353 0.597 . . . . 60.27 109.821 174.792 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 821' ' ' ILE . . . . . . . . . . . . . 85.6 mt -66.8 -43.83 89.55 Favored 'Isoleucine or valine' 0 C--O 1.237 0.401 0 CA-C-O 120.991 0.425 . . . . 57.21 110.812 -179.041 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 822' ' ' GLU . . . . . . . . . . . . . 62.6 mt-10 -62.78 -44.94 94.86 Favored 'General case' 0 C--O 1.237 0.423 0 C-N-CA 119.815 -0.754 . . . . 86.9 111.18 -178.3 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 823' ' ' LYS . . . . . . . . . . . . . 46.8 tttt -60.21 -39.7 87.5 Favored 'General case' 0 C--O 1.238 0.458 0 C-N-CA 119.728 -0.789 . . . . 68.37 111.368 177.901 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 824' ' ' THR . . . . . . . . . . . . . 89.0 m -63.93 -40.84 97.38 Favored 'General case' 0 C--O 1.234 0.245 0 C-N-CA 120.197 -0.601 . . . . 55.34 110.647 176.098 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 825' ' ' LEU . . . . . 0.4 HD23 ' HA ' ' A' ' 825' ' ' LEU . 33.0 mt -66.65 -44.0 83.12 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 118.392 -1.323 . . . . 53.61 111.413 176.078 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 826' ' ' LEU . . . . . . . . . . . . . 92.0 mt -60.55 -41.15 93.93 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 119.366 -0.934 . . . . 63.56 111.499 -178.632 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 827' ' ' GLU . . . . . . . . . . . . . 71.5 mt-10 -71.19 -30.86 66.92 Favored 'General case' 0 C--O 1.236 0.342 0 C-N-CA 120.188 -0.605 . . . . 94.96 112.179 179.845 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 828' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -66.46 -32.31 73.59 Favored 'General case' 0 C--O 1.238 0.489 0 C-N-CA 118.591 -1.244 . . . . 82.05 110.789 175.631 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 829' ' ' PHE . . . . . . . . . . . . . 27.0 m-85 -84.32 -37.41 21.65 Favored 'General case' 0 C--O 1.234 0.238 0 N-CA-C 112.037 0.384 . . . . 87.46 112.037 177.151 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 830' ' ' GLY . . . . . . . . . . . . . . . -102.16 2.5 51.05 Favored Glycine 0 N--CA 1.443 -0.871 0 N-CA-C 118.208 2.043 . . . . 79.41 118.208 -171.852 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 831' ' ' ASP . . . . . . . . . . . . . 14.2 p-10 -76.62 -27.54 55.75 Favored 'General case' 0 C--O 1.238 0.477 0 CA-C-N 119.561 1.68 . . . . 102.93 112.787 -175.77 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 832' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -67.89 165.64 17.24 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-O 121.924 0.869 . . . . 94.58 110.675 -174.495 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 833' ' ' ASN . . . . . . . . . . . . . 5.7 m120 -108.34 -34.66 6.73 Favored 'General case' 0 CA--C 1.515 -0.368 0 N-CA-C 113.327 0.862 . . . . 104.91 113.327 179.512 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 834' ' ' LEU . . . . . . . . . . . . . 39.6 tp -121.53 148.45 44.47 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.078 -0.712 . . . . 68.85 109.078 -170.556 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 835' ' ' SER . . . . . . . . . . . . . 32.5 t -147.33 145.45 29.34 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 118.497 -1.281 . . . . 59.33 109.735 167.572 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 836' ' ' PHE . . . . . . . . . . . . . 81.5 m-85 -103.8 0.37 30.27 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 114.577 -1.192 . . . . 57.31 112.412 172.387 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 837' ' ' ASP . . . . . . . . . . . . . 45.6 t0 -112.41 112.23 23.64 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 107.674 -1.232 . . . . 74.59 107.674 -175.76 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 838' ' ' GLU . . . . . . . . . . . . . 17.0 tt0 -50.29 -50.76 49.48 Favored 'General case' 0 C--O 1.235 0.326 0 O-C-N 123.564 0.54 . . . . 106.72 112.004 179.483 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 839' ' ' ARG . . . . . . . . . . . . . 24.4 ttp85 -63.04 -44.66 95.26 Favored 'General case' 0 C--O 1.238 0.469 0 C-N-CA 119.682 -0.807 . . . . 91.89 111.555 -177.409 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 840' ' ' CYS . . . . . . . . . . . . . 63.6 m -69.79 -33.94 73.06 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 119.624 -0.83 . . . . 72.48 112.549 177.02 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 841' ' ' HIS . . . . . . . . . . . . . 45.2 t-80 -60.03 -44.06 94.9 Favored 'General case' 0 C--O 1.238 0.459 0 C-N-CA 119.524 -0.87 . . . . 71.74 110.889 175.115 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 842' ' ' ASN . . . . . . . . . . . . . 98.2 m-20 -63.84 -42.27 97.63 Favored 'General case' 0 C--O 1.233 0.198 0 C-N-CA 120.435 -0.506 . . . . 80.67 111.412 179.366 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 843' ' ' ILE . . . . . . . . . . . . . 81.5 mt -63.26 -40.33 88.64 Favored 'Isoleucine or valine' 0 C--O 1.236 0.351 0 C-N-CA 120.353 -0.539 . . . . 62.42 110.304 177.145 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 844' ' ' MSE . . . . . . . . . . . . . 61.3 ttp -55.14 -49.64 71.27 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 113.446 0.906 . . . . 90.3 113.446 173.662 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 845' ' ' LYS . . . . . . . . . . . . . 71.1 mmtt -62.82 -39.95 95.9 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 120.7 -0.4 . . . . 81.62 111.959 178.903 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 846' ' ' VAL . . . . . . . . . . . . . 41.2 t -59.31 -48.26 87.62 Favored 'Isoleucine or valine' 0 C--O 1.239 0.502 0 CA-C-O 121.292 0.568 . . . . 72.43 110.59 177.005 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 847' ' ' ALA . . . . . . . . . . . . . . . -63.59 -42.92 98.23 Favored 'General case' 0 C--O 1.234 0.282 0 O-C-N 121.979 -0.451 . . . . 66.75 111.436 179.205 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 848' ' ' GLN . . . . . . . . . . . . . 85.6 mt-30 -62.54 -29.38 70.53 Favored 'General case' 0 C--O 1.237 0.445 0 C-N-CA 119.598 -0.841 . . . . 77.58 111.139 176.089 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 849' ' ' ALA . . . . . . . . . . . . . . . -67.65 -52.93 32.29 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 120.415 -0.514 . . . . 83.89 111.242 177.006 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 850' ' ' LYS . . . . . . . . . . . . . 62.8 mttt -59.96 -41.05 91.07 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 120.401 -0.52 . . . . 89.36 111.302 179.686 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 851' ' ' LEU . . . . . . . . . . . . . 3.8 mt -60.79 -41.97 96.63 Favored 'General case' 0 C--O 1.238 0.499 0 C-N-CA 120.285 -0.566 . . . . 93.21 111.517 -178.672 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 852' ' ' GLU . . . . . . . . . . . . . . . -60.26 -16.58 35.2 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 112.257 0.466 . . . . 104.08 112.257 179.893 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 853' ' ' MSE . . . . . . . . . . . . . 20.1 mtp . . . . . 0 C--N 1.329 -0.304 0 CA-C-N 117.992 0.36 . . . . 172.15 111.54 172.166 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 857' ' ' GLU . . . . . . . . . . . . . . . . . . . . 0 C--O 1.236 0.381 0 CA-C-O 121.411 0.624 . . . . 110.16 109.432 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 858' ' ' GLU . . . . . . . . . . . . . . . -75.15 1.82 12.34 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 115.469 -0.787 . . . . 109.52 112.426 175.6 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 859' ' ' VAL . . . . . . . . . . . . . . . -73.13 -42.93 58.63 Favored 'Isoleucine or valine' 0 C--O 1.238 0.485 0 CA-C-N 118.435 0.561 . . . . 111.24 111.078 -172.449 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 860' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 40.4 77.3 0.06 Allowed 'General case' 0 C--O 1.236 0.361 0 C-N-CA 125.212 1.405 . . . . 115.61 111.73 -174.108 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 861' ' ' LEU . . . . . . . . . . . . . 22.7 tp -77.84 -35.42 51.12 Favored 'General case' 0 C--O 1.234 0.254 0 N-CA-C 112.285 0.476 . . . . 98.19 112.285 -170.398 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 862' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -62.63 -45.77 91.3 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 120.879 -0.328 . . . . 112.11 111.122 177.866 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 863' ' ' GLU . . . . . . . . . . . . . 4.9 mp0 -56.49 -41.15 76.15 Favored 'General case' 0 C--O 1.235 0.302 0 C-N-CA 119.898 -0.721 . . . . 97.71 110.539 171.719 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 864' ' ' TYR . . . . . . . . . . . . . 76.5 t80 -66.22 -48.45 70.55 Favored 'General case' 0 C--O 1.237 0.428 0 C-N-CA 120.056 -0.657 . . . . 76.64 111.28 -176.941 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 865' ' ' GLU . . . . . . . . . . . . . 59.9 mm-40 -63.6 -33.73 76.26 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 119.865 -0.734 . . . . 101.76 111.951 177.123 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 866' ' ' GLU . . . . . . . . . . . . . 23.6 tp10 -65.02 -42.3 94.51 Favored 'General case' 0 C--O 1.239 0.542 0 C-N-CA 119.333 -0.947 . . . . 88.15 111.125 -177.705 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 867' ' ' TRP . . . . . . . . . . . . . 61.0 m95 -65.22 -39.75 93.17 Favored 'General case' 0 C--O 1.238 0.466 0 C-N-CA 120.204 -0.598 . . . . 52.27 111.19 179.483 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 868' ' ' HIS . . . . . . . . . . . . . 73.1 m-70 -73.07 -32.43 65.02 Favored 'General case' 0 C--O 1.234 0.241 0 C-N-CA 118.027 -1.469 . . . . 54.03 111.921 179.971 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 869' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 -63.28 -39.29 94.16 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 118.544 0.611 . . . . 88.36 111.524 170.593 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 870' ' ' ASP . . . . . . . . . . . . . 96.3 m-20 -62.45 -37.77 87.18 Favored 'General case' 0 C--O 1.239 0.541 0 C-N-CA 119.783 -0.767 . . . . 54.69 110.79 178.907 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 871' ' ' TYR . . . . . . . . . . . . . 40.4 t80 -68.74 -40.36 79.89 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 120.337 -0.545 . . . . 41.15 111.125 178.906 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 872' ' ' ARG . . . . . . . . . . . . . 88.3 mtm-85 -63.81 -38.05 89.65 Favored 'General case' 0 C--O 1.232 0.18 0 C-N-CA 118.773 -1.171 . . . . 72.87 110.705 178.484 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 873' ' ' LYS . . . . . . . . . . . . . 56.0 tttp -64.58 -35.87 82.41 Favored 'General case' 0 C--O 1.242 0.707 0 N-CA-C 111.938 0.347 . . . . 44.29 111.938 174.258 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 874' ' ' PHE . . . . . . . . . . . . . 54.4 t80 -63.19 -41.55 99.2 Favored 'General case' 0 C--O 1.237 0.446 0 O-C-N 121.521 -0.737 . . . . 36.14 111.042 174.593 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 875' ' ' ARG . . . . . 0.965 ' NH2' ' O ' ' A' 1201 ' ' HOH . 65.9 mtp85 -66.35 -43.56 85.7 Favored 'General case' 0 C--O 1.233 0.228 0 C-N-CA 119.287 -0.965 . . . . 92.78 111.67 -179.77 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 876' ' ' GLU . . . . . . . . . . . . . 87.1 mt-10 -67.13 -39.6 86.63 Favored 'General case' 0 C--O 1.238 0.484 0 C-N-CA 120.202 -0.599 . . . . 95.04 111.078 179.984 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 877' ' ' THR . . . . . . . . . . . . . 90.4 m -56.82 -43.84 81.43 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 120.492 -0.483 . . . . 37.65 110.739 174.981 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 878' ' ' THR . . . . . . . . . . . . . 34.1 m -59.0 -41.32 87.39 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-O 120.745 0.307 . . . . 37.47 111.743 176.788 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 879' ' ' MSE . . . . . 0.574 ' HE3' ' CG ' ' A' 1031 ' ' TYR . 29.0 tpp -70.14 -42.14 72.96 Favored 'General case' 0 C--N 1.32 -0.679 0 O-C-N 121.981 -0.449 . . . . 89.46 109.936 -176.477 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 880' ' ' TYR . . . . . 0.404 ' CD1' HD21 ' A' 1028 ' ' LEU . 41.3 m-85 -55.0 -49.19 72.12 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 119.974 -0.69 . . . . 55.77 111.276 170.758 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 881' ' ' LEU . . . . . . . . . . . . . 63.5 tp -59.2 -43.99 92.25 Favored 'General case' 0 C--O 1.235 0.334 0 C-N-CA 120.769 -0.373 . . . . 40.03 111.017 -178.43 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 882' ' ' ILE . . . . . . . . . . . . . 50.9 mt -60.74 -49.06 86.07 Favored 'Isoleucine or valine' 0 C--O 1.238 0.451 0 CA-C-O 121.348 0.594 . . . . 42.85 110.538 -177.628 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 883' ' ' ILE . . . . . . . . . . . . . 96.9 mt -65.04 -39.29 85.17 Favored 'Isoleucine or valine' 0 C--O 1.237 0.426 0 C-N-CA 119.871 -0.732 . . . . 45.34 110.628 -177.996 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 884' ' ' GLY . . . . . . . . . . . . . . . -58.66 -50.07 70.89 Favored Glycine 0 C--N 1.335 0.502 0 C-N-CA 120.595 -0.812 . . . . 44.2 112.617 173.899 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 885' ' ' LEU . . . . . . . . . . . . . 91.3 mt -67.08 -40.02 86.92 Favored 'General case' 0 C--O 1.239 0.53 0 O-C-N 122.128 -0.631 . . . . 42.81 111.858 179.529 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 886' ' ' GLU . . . . . 0.656 ' OE2' ' O ' ' A' 1203 ' ' HOH . 85.1 mt-10 -59.22 -42.32 90.72 Favored 'General case' 0 C--O 1.238 0.483 0 C-N-CA 118.509 -1.276 . . . . 60.7 111.24 176.871 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 887' ' ' ASN . . . . . . . . . . . . . 44.2 m-80 -74.38 -34.2 63.26 Favored 'General case' 0 C--O 1.239 0.546 0 C-N-CA 117.885 -1.526 . . . . 60.45 111.244 -177.67 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 888' ' ' PHE . . . . . . . . . . . . . 58.3 t80 -56.39 -45.9 80.37 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 120.045 -0.662 . . . . 47.99 110.5 171.279 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 889' ' ' GLN . . . . . . . . . . . . . 18.9 tt0 -67.45 -34.68 77.68 Favored 'General case' 0 CA--C 1.518 -0.26 0 C-N-CA 119.031 -1.068 . . . . 87.56 111.492 -175.676 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 890' ' ' ARG . . . . . . . . . . . . . 55.1 mtp85 -72.4 -6.2 41.86 Favored 'General case' 0 N--CA 1.45 -0.437 0 N-CA-C 112.937 0.717 . . . . 74.59 112.937 173.195 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 891' ' ' GLU . . . . . . . . . . . . . 56.1 mt-10 64.28 33.73 11.3 Favored 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 124.195 0.998 . . . . 67.77 111.893 -176.715 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 892' ' ' SER . . . . . . . . . . . . . 4.9 m -99.74 78.52 2.15 Favored 'General case' 0 CA--C 1.516 -0.327 0 N-CA-C 105.905 -1.887 . . . . 67.6 105.905 171.762 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 893' ' ' TYR . . . . . . . . . . . . . 63.7 m-85 -73.66 -31.22 63.36 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 118.09 -1.444 . . . . 54.14 111.68 -165.061 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 894' ' ' ILE . . . . . . . . . . . . . 83.3 mt -60.5 -48.92 86.42 Favored 'Isoleucine or valine' 0 C--N 1.346 0.432 0 C-N-CA 119.419 -0.913 . . . . 59.25 110.534 176.442 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 895' ' ' ASP . . . . . . . . . . . . . 87.6 m-20 -64.61 -38.12 89.92 Favored 'General case' 0 C--O 1.236 0.375 0 O-C-N 121.757 -0.59 . . . . 71.62 111.181 179.248 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 896' ' ' SER . . . . . . . . . . . . . 45.2 t -63.32 -44.04 96.09 Favored 'General case' 0 C--O 1.235 0.328 0 N-CA-C 112.454 0.538 . . . . 46.39 112.454 -178.282 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 897' ' ' LEU . . . . . . . . . . . . . 53.3 tp -60.68 -49.07 78.99 Favored 'General case' 0 C--O 1.239 0.511 0 C-N-CA 120.565 -0.454 . . . . 49.25 111.946 -157.724 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 898' ' ' LEU . . . . . . . . . . . . . 12.7 tp -64.4 -38.53 91.35 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 119.508 -0.877 . . . . 63.5 111.491 -175.485 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 899' ' ' PHE . . . . . . . . . . . . . 75.7 m-85 -59.02 -43.75 91.61 Favored 'General case' 0 C--O 1.244 0.768 0 C-N-CA 119.572 -0.851 . . . . 50.36 111.935 173.297 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 900' ' ' LEU . . . . . . . . . . . . . 92.8 mt -67.53 -38.33 84.05 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 118.157 -1.417 . . . . 38.09 111.265 -178.911 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 901' ' ' ILE . . . . . . . . . . . . . 30.2 mt -65.35 -40.68 89.22 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.519 0 CA-C-O 121.191 0.519 . . . . 43.88 109.963 179.133 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 902' ' ' CYS . . . . . . . . . . . . . 50.0 t -66.67 -42.91 85.82 Favored 'General case' 0 C--O 1.239 0.501 0 C-N-CA 119.952 -0.699 . . . . 47.42 110.574 178.382 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 903' ' ' ALA . . . . . . . . . . . . . . . -60.74 -46.06 91.9 Favored 'General case' 0 CA--C 1.52 -0.193 0 C-N-CA 120.612 -0.435 . . . . 36.2 111.134 179.168 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 904' ' ' TYR . . . . . . . . . . . . . 11.8 t80 -57.86 -45.68 85.93 Favored 'General case' 0 C--O 1.239 0.531 0 CA-C-O 120.974 0.416 . . . . 47.68 111.196 -179.463 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 905' ' ' GLN . . . . . . . . . . . . . 7.6 tp60 -71.69 -43.67 65.57 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 120.036 -0.666 . . . . 59.63 111.32 -174.802 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 906' ' ' ASN . . . . . . . . . . . . . 12.5 m-80 -57.85 -39.86 78.73 Favored 'General case' 0 CA--C 1.514 -0.412 0 C-N-CA 120.376 -0.53 . . . . 57.81 110.89 173.172 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 907' ' ' ASN . . . . . . . . . . . . . 55.8 t30 -64.98 -40.33 94.81 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 120.164 -0.614 . . . . 38.84 111.359 -176.9 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 908' ' ' LYS . . . . . . . . . . . . . 69.6 mmtt -62.11 -36.35 81.47 Favored 'General case' 0 C--O 1.235 0.307 0 C-N-CA 120.991 -0.284 . . . . 58.34 110.943 175.748 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 909' ' ' GLU . . . . . . . . . . . . . 85.0 mt-10 -66.74 -42.2 86.6 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 120.659 -0.417 . . . . 51.88 111.578 176.413 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 910' ' ' LEU . . . . . . . . . . . . . 96.9 mt -57.61 -52.45 65.39 Favored 'General case' 0 C--O 1.233 0.218 0 O-C-N 121.48 -0.763 . . . . 40.0 111.014 173.108 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 911' ' ' LEU . . . . . . . . . . . . . 79.6 mt -69.38 -15.11 63.24 Favored 'General case' 0 C--O 1.237 0.438 0 C-N-CA 119.619 -0.833 . . . . 46.33 112.5 -172.695 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 912' ' ' SER . . . . . . . . . . . . . 14.1 m -49.43 -34.75 17.35 Favored 'General case' 0 C--O 1.235 0.32 0 N-CA-C 112.209 0.448 . . . . 51.69 112.209 167.726 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 913' ' ' LYS . . . . . . . . . . . . . 77.9 mttt -94.78 -12.43 27.1 Favored 'General case' 0 CA--C 1.515 -0.39 0 N-CA-C 113.063 0.764 . . . . 70.02 113.063 -172.426 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 914' ' ' GLY . . . . . . . . . . . . . . . 165.53 161.1 13.78 Favored Glycine 0 N--CA 1.448 -0.502 0 C-N-CA 119.779 -1.201 . . . . 44.94 114.062 177.745 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 915' ' ' LEU . . . . . . . . . . . . . 89.8 mt -65.95 -29.81 70.27 Favored 'General case' 0 CA--C 1.513 -0.469 0 CA-C-N 115.126 -0.537 . . . . 60.47 112.303 -169.425 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 916' ' ' TYR . . . . . . . . . . . . . 65.3 m-85 -105.3 18.43 22.29 Favored 'General case' 0 N--CA 1.463 0.179 0 N-CA-C 112.983 0.734 . . . . 62.14 112.983 -172.507 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 917' ' ' ARG . . . . . . . . . . . . . 14.5 mmt180 -81.39 -17.01 50.47 Favored 'General case' 0 CA--C 1.512 -0.499 0 N-CA-C 113.886 1.069 . . . . 42.85 113.886 -176.363 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . -142.75 -147.32 4.75 Favored Glycine 0 N--CA 1.447 -0.602 0 C-N-CA 120.441 -0.885 . . . . 38.49 112.874 -162.754 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 919' ' ' HIS . . . . . . . . . . . . . 91.9 m-70 -122.9 165.92 15.9 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-O 122.083 0.944 . . . . 42.8 110.365 -174.551 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 920' ' ' ASP . . . . . . . . . . . . . 66.0 t0 -50.44 109.38 0.3 Allowed 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 114.91 -1.041 . . . . 65.62 113.18 -178.534 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 921' ' ' GLU . . . . . . . . . . . . . 30.7 mt-10 -63.4 -41.8 98.76 Favored 'General case' 0 C--O 1.233 0.206 0 N-CA-C 112.154 0.428 . . . . 68.15 112.154 -176.839 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 922' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -65.09 -32.52 74.26 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 119.052 -1.059 . . . . 93.54 111.416 -177.657 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 923' ' ' LEU . . . . . . . . . . . . . 8.6 tt -66.38 -52.79 43.14 Favored 'General case' 0 C--O 1.243 0.712 0 O-C-N 122.314 -0.241 . . . . 51.59 111.225 176.817 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 924' ' ' ILE . . . . . . . . . . . . . 15.8 mt -63.57 -41.84 94.05 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.307 0 C-N-CA 120.153 -0.619 . . . . 44.32 110.328 -179.974 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 925' ' ' SER . . . . . . . . . . . . . 34.5 t -55.15 -43.53 74.32 Favored 'General case' 0 C--O 1.238 0.477 0 C-N-CA 120.461 -0.495 . . . . 53.85 111.518 174.235 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 926' ' ' HIS . . . . . 0.514 ' HD2' ' O ' ' A' 1207 ' ' HOH . 40.4 t-80 -62.49 -47.37 84.27 Favored 'General case' 0 C--O 1.238 0.466 0 C-N-CA 120.551 -0.46 . . . . 49.51 111.207 -178.263 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 927' ' ' TYR . . . . . . . . . . . . . 51.4 m-85 -77.81 -33.13 52.57 Favored 'General case' 0 CA--C 1.515 -0.366 0 C-N-CA 119.248 -0.981 . . . . 50.8 112.444 -173.124 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 928' ' ' ARG . . . . . . . . . . . . . 30.7 ttp180 -60.82 -45.17 95.48 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 119.166 -1.013 . . . . 42.55 110.615 173.937 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 929' ' ' ARG . . . . . . . . . . . . . 34.2 ttp-105 -66.68 -46.84 74.34 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 111.802 0.297 . . . . 51.35 111.802 -179.511 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 930' ' ' GLU . . . . . . . . . . . . . 74.5 mm-40 -65.02 -33.25 75.59 Favored 'General case' 0 CA--C 1.517 -0.305 0 C-N-CA 120.461 -0.496 . . . . 71.58 111.828 178.987 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 931' ' ' CYS . . . . . . . . . . . . . 29.7 t -68.7 -37.72 79.74 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 118.958 -1.097 . . . . 44.06 110.894 178.469 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 932' ' ' LEU . . . . . . . . . . . . . 42.5 mt -61.65 -46.39 89.95 Favored 'General case' 0 C--O 1.237 0.402 0 O-C-N 121.854 -0.529 . . . . 56.97 111.127 174.408 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 933' ' ' LEU . . . . . . . . . . . . . 44.4 mt -64.78 -37.85 88.99 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 120.066 -0.654 . . . . 52.75 111.387 -177.385 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 934' ' ' LYS . . . . . . . . . . . . . 53.6 mmtt -70.23 -39.4 75.11 Favored 'General case' 0 C--O 1.235 0.311 0 C-N-CA 119.52 -0.872 . . . . 79.65 111.11 -179.504 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 935' ' ' LEU . . . . . . . . . . . . . 7.6 tp -65.17 -39.33 92.77 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 119.44 -0.904 . . . . 46.91 110.835 174.851 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 936' ' ' ASN . . . . . . . . . . . . . 19.2 t30 -62.13 -44.25 97.04 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 120.013 -0.675 . . . . 52.96 110.571 176.322 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 937' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -55.76 -43.87 77.11 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-O 120.768 0.318 . . . . 92.54 111.306 173.48 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 938' ' ' GLN . . . . . 0.85 ' OE1' ' O ' ' A' 1202 ' ' HOH . 50.9 tt0 -61.59 -45.73 92.87 Favored 'General case' 0 C--O 1.234 0.244 0 O-C-N 121.907 -0.496 . . . . 56.77 111.187 179.0 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 939' ' ' ALA . . . . . . . . . . . . . . . -63.52 -39.5 94.58 Favored 'General case' 0 C--O 1.238 0.481 0 N-CA-C 112.184 0.439 . . . . 53.66 112.184 178.212 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 940' ' ' ALA . . . . . . . . . . . . . . . -70.5 -40.94 73.27 Favored 'General case' 0 C--O 1.236 0.395 0 C-N-CA 120.34 -0.544 . . . . 55.18 111.045 -176.412 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 941' ' ' GLU . . . . . . . . . . . . . 94.0 mt-10 -64.89 -34.42 78.35 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 120.126 -0.629 . . . . 89.14 111.098 178.804 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 942' ' ' LEU . . . . . . . . . . . . . 29.9 mt -58.95 -44.58 91.48 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 120.079 -0.649 . . . . 54.65 110.758 169.33 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 943' ' ' PHE . . . . . 0.61 ' HZ ' ' HE1' ' A' ' 997' ' ' MSE . 74.1 t80 -63.82 -43.34 96.54 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 120.524 -0.47 . . . . 72.65 111.399 -179.712 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 944' ' ' GLU . . . . . . . . . . . . . 81.4 mt-10 -63.34 -22.52 66.93 Favored 'General case' 0 CA--C 1.517 -0.298 0 N-CA-C 112.45 0.537 . . . . 73.68 112.45 -177.778 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 945' ' ' SER . . . . . . . . . . . . . 15.7 p -61.04 -34.89 75.57 Favored 'General case' 0 C--O 1.235 0.325 0 C-N-CA 120.215 -0.594 . . . . 77.41 111.88 179.73 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 946' ' ' GLY . . . . . . . . . . . . . . . 84.19 9.3 82.38 Favored Glycine 0 N--CA 1.448 -0.536 0 N-CA-C 116.158 1.223 . . . . 99.52 116.158 175.824 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 947' ' ' GLU . . . . . . . . . . . . . 75.2 mm-40 -98.29 145.21 26.89 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 118.948 1.374 . . . . 106.02 110.201 178.195 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 75.9 m-20 -62.91 -45.1 94.07 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-N 115.912 -0.585 . . . . 109.48 111.819 -166.441 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 949' ' ' ARG . . . . . . . . . . . . . 58.7 mtt180 -63.94 -47.05 82.02 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 119.906 -0.717 . . . . 80.55 111.0 179.142 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 950' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -67.0 -37.55 84.4 Favored 'General case' 0 C--O 1.237 0.405 0 O-C-N 122.189 -0.32 . . . . 104.27 111.81 -177.613 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 951' ' ' VAL . . . . . . . . . . . . . 24.4 t -62.35 -48.2 89.46 Favored 'Isoleucine or valine' 0 C--O 1.234 0.283 0 C-N-CA 119.837 -0.745 . . . . 68.33 110.208 175.792 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 952' ' ' ASN . . . . . . . . . . . . . 92.4 m-20 -60.67 -38.08 83.72 Favored 'General case' 0 C--O 1.234 0.258 0 C-N-CA 120.001 -0.679 . . . . 81.68 111.11 179.066 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 953' ' ' ASN . . . . . . . . . . . . . 91.5 m-20 -68.06 -40.65 82.71 Favored 'General case' 0 CA--C 1.513 -0.449 0 C-N-CA 120.704 -0.398 . . . . 64.81 111.253 -179.754 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 954' ' ' GLY . . . . . . . . . . . . . . . -64.01 -42.66 98.13 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 119.87 -1.157 . . . . 53.31 112.147 177.482 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 955' ' ' LEU . . . . . . . . . . . . . 48.1 mt -66.86 -30.92 71.22 Favored 'General case' 0 C--O 1.236 0.393 0 O-C-N 122.426 -0.455 . . . . 60.27 111.687 177.511 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 956' ' ' ILE . . . . . . . . . . . . . 24.7 mt -68.72 -37.72 77.9 Favored 'Isoleucine or valine' 0 C--O 1.236 0.382 0 C-N-CA 119.706 -0.798 . . . . 60.36 110.525 175.557 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 957' ' ' ILE . . . . . . . . . . . . . 73.8 mt -59.43 -48.63 86.5 Favored 'Isoleucine or valine' 0 C--O 1.237 0.421 0 O-C-N 121.669 -0.644 . . . . 51.22 110.635 173.889 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 958' ' ' MSE . . . . . . . . . . . . . 95.9 mmm -60.89 -45.03 96.21 Favored 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 119.584 -0.847 . . . . 68.13 111.211 -178.608 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 959' ' ' ASN . . . . . . . . . . . . . 69.6 m-20 -74.81 -28.4 60.69 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 112.924 0.712 . . . . 59.31 112.924 -176.735 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 960' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -85.77 -41.7 14.85 Favored 'General case' 0 C--O 1.236 0.354 0 C-N-CA 119.928 -0.709 . . . . 96.48 112.591 -177.628 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 961' ' ' PHE . . . . . . . . . . . . . 69.1 m-85 -112.03 -20.13 12.08 Favored 'General case' 0 C--O 1.232 0.168 0 N-CA-C 115.255 1.576 . . . . 58.77 115.255 -166.948 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 962' ' ' ILE . . . . . . . . . . . . . 11.9 mm -112.66 -63.1 2.01 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 119.589 1.086 . . . . 59.62 111.284 -169.95 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 963' ' ' VAL . . . . . . . . . . . . . 51.1 t -47.7 -44.41 56.01 Favored Pre-proline 0 C--O 1.249 1.075 0 CA-C-O 118.371 -0.823 . . . . 55.32 112.359 -179.726 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 964' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -63.92 -21.23 68.88 Favored 'Trans proline' 0 C--O 1.236 0.413 0 CA-C-N 122.029 1.76 . . . . 57.51 114.678 -178.688 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 965' ' ' PHE . . . . . . . . . . . . . 63.8 m-85 -108.5 -5.06 16.75 Favored 'General case' 0 C--O 1.241 0.637 0 N-CA-C 114.523 1.305 . . . . 56.54 114.523 -177.297 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 966' ' ' LEU . . . . . 0.543 HD11 HD12 ' A' 1012 ' ' LEU . 16.1 mt -46.53 -43.85 39.15 Favored Pre-proline 0 C--O 1.242 0.696 0 CA-C-O 117.934 -1.032 . . . . 69.02 113.609 169.997 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 967' ' ' PRO . . . . . . . . . . . . . 77.1 Cg_exo -57.79 -29.4 85.81 Favored 'Trans proline' 0 C--O 1.235 0.33 0 CA-C-N 121.193 1.462 . . . . 68.42 113.897 176.201 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 968' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -62.84 -35.17 79.06 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-N 118.998 0.817 . . . . 69.16 111.946 178.129 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 969' ' ' LEU . . . . . . . . . . . . . 7.1 mp -87.34 -1.02 57.62 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 119.584 -0.846 . . . . 64.62 113.102 -177.045 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 970' ' ' LEU . . . . . . . . . . . . . 31.5 mt -107.49 -1.31 21.51 Favored 'General case' 0 C--O 1.233 0.228 0 N-CA-C 113.174 0.805 . . . . 76.03 113.174 176.92 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 971' ' ' VAL . . . . . . . . . . . . . 35.4 m -62.07 -27.21 42.01 Favored 'Isoleucine or valine' 0 C--O 1.239 0.511 0 CA-C-N 118.68 0.673 . . . . 81.09 112.414 -173.356 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 972' ' ' ASP . . . . . . . . . . . . . 50.6 t0 -133.26 114.18 13.49 Favored 'General case' 0 C--O 1.236 0.359 0 O-C-N 121.374 -0.829 . . . . 95.75 110.749 -168.425 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 973' ' ' GLU . . . . . . . . . . . . . . . -66.33 -21.83 66.26 Favored 'General case' 0 C--O 1.238 0.476 0 N-CA-C 112.925 0.713 . . . . 94.44 112.925 179.085 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 974' ' ' MSE . . . . . . . . . . . . . 84.6 mmm -73.46 -23.46 60.09 Favored 'General case' 0 N--CA 1.463 0.186 0 N-CA-C 113.082 0.771 . . . . 158.08 113.082 176.745 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 975' ' ' GLU . . . . . . . . . . . . . 63.2 mm-40 -83.09 74.56 9.97 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 122.748 1.261 . . . . 87.98 108.361 175.771 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 976' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -68.23 -34.1 75.62 Favored 'General case' 0 C--O 1.238 0.458 0 CA-C-N 114.499 -1.228 . . . . 120.58 112.144 -168.174 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 977' ' ' LYS . . . . . . . . . . . . . 92.0 mttt -65.16 -34.69 78.98 Favored 'General case' 0 C--O 1.237 0.441 0 C-N-CA 120.136 -0.625 . . . . 86.55 111.991 179.56 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 92.6 m-20 -69.18 -39.86 78.44 Favored 'General case' 0 C--O 1.235 0.318 0 C-N-CA 120.789 -0.364 . . . . 65.76 111.576 176.499 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 979' ' ' ILE . . . . . . . . . . . . . 47.6 mm -61.34 -47.23 94.42 Favored 'Isoleucine or valine' 0 C--O 1.235 0.31 0 N-CA-C 109.771 -0.455 . . . . 72.91 109.771 177.273 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 980' ' ' LEU . . . . . . . . . . . . . 93.3 mt -64.95 -33.77 76.82 Favored 'General case' 0 C--O 1.238 0.467 0 CA-C-N 116.631 -0.259 . . . . 74.35 111.335 -179.148 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 981' ' ' ALA . . . . . . . . . . . . . . . -68.58 -40.14 80.68 Favored 'General case' 0 N--CA 1.455 -0.178 0 C-N-CA 119.889 -0.725 . . . . 54.97 111.333 178.702 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 982' ' ' VAL . . . . . . . . . . . . . 49.4 t -63.12 -41.24 92.1 Favored 'Isoleucine or valine' 0 C--O 1.239 0.531 0 C-N-CA 119.673 -0.811 . . . . 54.83 110.193 175.982 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 983' ' ' GLU . . . . . 0.546 ' O ' ' ND2' ' A' ' 987' ' ' ASN . 65.7 mm-40 -65.55 -35.95 82.37 Favored 'General case' 0 N--CA 1.463 0.199 0 C-N-CA 119.928 -0.709 . . . . 94.69 111.691 177.382 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 984' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -66.85 -41.28 87.62 Favored 'General case' 0 C--O 1.239 0.553 0 O-C-N 121.999 -0.438 . . . . 99.47 111.058 178.433 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 985' ' ' MSE . . . . . . . . . . . . . 3.3 mtm -65.61 -39.75 91.89 Favored 'General case' 0 C--O 1.233 0.196 0 C-N-CA 120.462 -0.495 . . . . 81.25 111.255 177.168 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 986' ' ' ARG . . . . . . . . . . . . . 91.7 mtt180 -67.06 -42.8 84.15 Favored 'General case' 0 C--O 1.24 0.585 0 C-N-CA 120.602 -0.439 . . . . 63.7 111.894 178.79 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 987' ' ' ASN . . . . . 0.546 ' ND2' ' O ' ' A' ' 983' ' ' GLU . 68.8 m-80 -59.62 -41.31 90.11 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 120.067 -0.653 . . . . 84.24 110.802 177.511 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 988' ' ' ARG . . . . . . . . . . . . . 11.9 tpt180 -56.34 -49.92 72.99 Favored 'General case' 0 CA--C 1.519 -0.223 0 CA-C-O 120.782 0.325 . . . . 69.96 110.642 -177.529 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 989' ' ' TRP . . . . . . . . . . . . . 80.0 m95 -71.9 -30.19 65.12 Favored 'General case' 0 C--O 1.238 0.463 0 N-CA-C 112.455 0.539 . . . . 58.5 112.455 -177.985 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 990' ' ' CYS . . . . . . . . . . . . . 99.0 m -72.05 -31.32 66.03 Favored 'General case' 0 C--O 1.237 0.439 0 N-CA-C 112.289 0.477 . . . . 64.75 112.289 175.075 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 991' ' ' SER . . . . . . . . . . . . . 70.4 p -64.22 -14.74 57.42 Favored 'General case' 0 C--O 1.232 0.171 0 C-N-CA 119.096 -1.042 . . . . 70.59 112.416 -177.919 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 992' ' ' TYR . . . . . . . . . . . . . 25.7 m-85 -73.84 -15.17 61.17 Favored 'General case' 0 C--O 1.238 0.467 0 CA-C-N 118.962 0.801 . . . . 80.33 112.563 174.882 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 993' ' ' LEU . . . . . . . . . . . . . 74.9 mt -58.25 -40.13 80.98 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 119.919 -0.712 . . . . 91.76 111.077 168.03 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 994' ' ' GLY . . . . . . . . . . . . . . . -71.04 7.19 5.89 Favored Glycine 0 C--N 1.342 0.909 0 CA-C-O 118.769 -1.017 . . . . 106.81 115.568 175.087 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 995' ' ' GLN . . . . . . . . . . . . . . . -116.69 143.55 45.51 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-N 118.558 1.179 . . . . 103.45 110.399 175.79 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 996' ' ' GLU . . . . . . . . . . . . . . . -92.76 135.9 33.71 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.275 -0.42 . . . . 105.18 109.915 176.793 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 997' ' ' MSE . . . . . 0.705 ' HE2' ' HA ' ' A' 1002 ' ' GLN . 2.0 ptt? -157.33 177.93 10.89 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.322 -0.399 . . . . 127.69 111.956 -173.994 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 998' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -54.6 133.64 64.03 Favored Pre-proline 0 C--O 1.24 0.555 0 N-CA-C 109.797 -0.445 . . . . 119.2 109.797 177.314 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 999' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -68.39 -30.28 30.14 Favored 'Trans proline' 0 C--O 1.237 0.457 0 N-CA-C 114.114 0.775 . . . . 95.54 114.114 -171.78 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1000 ' ' HIS . . . . . . . . . . . . . 15.9 p-80 -69.3 -27.89 65.79 Favored 'General case' 0 C--O 1.239 0.502 0 C-N-CA 118.44 -1.304 . . . . 126.38 110.672 178.27 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1001 ' ' LEU . . . . . . . . . . . . . 40.9 mt -71.33 -34.53 70.63 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 120.678 -0.409 . . . . 97.81 111.115 169.23 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1002 ' ' GLN . . . . . 0.705 ' HA ' ' HE2' ' A' ' 997' ' ' MSE . 14.0 tp60 -66.09 -36.56 83.5 Favored 'General case' 0 CA--C 1.516 -0.332 0 C-N-CA 119.37 -0.932 . . . . 113.03 111.171 176.799 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A 1003 ' ' GLU . . . . . . . . . . . . . . . -60.87 -37.82 83.47 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 119.942 -0.703 . . . . 81.26 110.758 171.956 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1004 ' ' LYS . . . . . . . . . . . . . 47.4 mttm -64.38 -48.57 74.94 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 120.109 -0.636 . . . . 86.62 111.096 177.616 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1005 ' ' LEU . . . . . . . . . . . . . 59.1 tp -58.09 -40.25 80.65 Favored 'General case' 0 C--O 1.238 0.478 0 C-N-CA 120.438 -0.505 . . . . 66.89 111.067 177.793 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1006 ' ' THR . . . . . . . . . . . . . 1.3 m -65.42 -39.44 92.13 Favored 'General case' 0 C--O 1.237 0.406 0 N-CA-C 112.144 0.424 . . . . 76.46 112.144 -176.654 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1007 ' ' ASP . . . . . . . . . . . . . 73.5 m-20 -73.04 -28.37 62.3 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 120.076 -0.649 . . . . 100.74 111.693 176.695 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1008 ' ' PHE . . . . . . . . . . . . . 38.4 t80 -78.66 -40.42 34.09 Favored 'General case' 0 C--O 1.238 0.492 0 N-CA-C 112.649 0.611 . . . . 58.15 112.649 -175.614 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1009 ' ' LEU . . . . . . . . . . . . . 37.7 mt -57.13 -43.11 99.15 Favored Pre-proline 0 C--O 1.244 0.816 0 N-CA-C 113.864 1.061 . . . . 61.6 113.864 -171.099 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1010 ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -55.83 -36.39 95.31 Favored 'Trans proline' 0 C--O 1.237 0.432 0 CA-C-N 121.763 1.665 . . . . 72.59 112.793 175.238 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1011 ' ' LYS . . . . . . . . . . . . . 58.0 mttp -60.15 -43.32 95.83 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-N 117.899 0.318 . . . . 82.56 111.23 177.316 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1012 ' ' LEU . . . . . 0.543 HD12 HD11 ' A' ' 966' ' ' LEU . 47.6 tp -73.67 -29.98 62.63 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 120.807 -0.357 . . . . 63.39 111.602 -178.449 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A 1013 ' ' LEU . . . . . . . . . . . . . 19.6 mt -98.71 7.31 46.24 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 113.014 0.746 . . . . 81.05 113.014 -174.387 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1014 ' ' ASP . . . . . . . . . . . . . 35.0 t0 -63.82 139.38 58.76 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-N 118.408 0.549 . . . . 107.62 111.35 -171.723 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1015 ' ' CYS . . . . . . . . . . . . . 43.1 m -75.12 -27.39 59.8 Favored 'General case' 0 C--O 1.236 0.379 0 CA-C-N 115.348 -0.842 . . . . 115.9 112.395 178.487 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1016 ' ' SER . . . . . . . . . . . . . 27.6 m -63.51 139.58 58.78 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 121.413 0.625 . . . . 112.13 111.285 -172.802 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1017 ' ' MSE . . . . . . . . . . . . . 3.5 mmt -100.05 21.59 12.55 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.38 -0.827 . . . . 170.84 110.965 -179.178 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1018 ' ' GLU . . . . . . . . . . . . . . . -64.68 118.76 9.38 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-N 116.191 -0.459 . . . . 120.2 110.421 -176.826 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1019 ' ' ILE . . . . . . . . . . . . . 3.7 tp -149.4 133.97 9.52 Favored 'Isoleucine or valine' 0 C--O 1.235 0.337 0 N-CA-C 107.636 -1.246 . . . . 99.01 107.636 176.705 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1020 ' ' LYS . . . . . . . . . . . . . . . -56.52 145.74 27.08 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 121.132 0.492 . . . . 77.12 109.838 178.359 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1021 ' ' SER . . . . . . . . . . . . . 17.6 p -83.0 -24.98 32.64 Favored 'General case' 0 C--N 1.331 -0.205 0 C-N-CA 118.693 -1.203 . . . . 69.52 112.1 -172.02 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1022 ' ' PHE . . . . . . . . . . . . . 78.1 t80 -120.42 131.67 54.9 Favored 'General case' 0 CA--C 1.518 -0.287 0 CA-C-N 118.601 0.637 . . . . 57.37 109.546 177.762 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1023 ' ' HIS . . . . . . . . . . . . . 17.7 t-80 -121.33 134.7 55.14 Favored 'General case' 0 C--O 1.24 0.563 0 N-CA-C 108.49 -0.93 . . . . 73.6 108.49 172.073 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1024 ' ' GLU . . . . . . . . . . . . . 39.1 tp10 -68.41 135.58 90.91 Favored Pre-proline 0 C--N 1.319 -0.754 0 N-CA-C 109.184 -0.673 . . . . 92.27 109.184 177.816 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1025 ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -77.28 152.49 30.73 Favored 'Trans proline' 0 C--N 1.331 -0.358 0 CA-C-N 119.216 0.756 . . . . 56.25 111.45 -177.898 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1026 ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -60.26 157.44 35.3 Favored 'Trans proline' 0 C--N 1.331 -0.376 0 N-CA-C 109.766 -0.898 . . . . 60.76 109.766 173.539 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1027 ' ' LYS . . . . . . . . . . . . . . . -75.9 137.13 40.19 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.604 -0.726 . . . . 65.97 109.817 -177.023 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1028 ' ' LEU . . . . . 0.404 HD21 ' CD1' ' A' ' 880' ' ' TYR . 34.5 mt -101.75 126.51 33.82 Favored Pre-proline 0 C--O 1.237 0.419 0 C-N-CA 124.042 0.937 . . . . 64.08 109.588 173.513 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A 1029 ' ' PRO . . . . . . . . . . . . . 35.3 Cg_exo -66.08 151.34 84.04 Favored 'Trans proline' 0 C--N 1.329 -0.496 0 N-CA-C 109.415 -1.033 . . . . 69.67 109.415 168.733 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1030 ' ' SER . . . . . . . . . . . . . 78.8 p -59.63 146.29 41.54 Favored 'General case' 0 C--O 1.234 0.251 0 C-N-CA 119.969 -0.692 . . . . 71.81 109.215 176.446 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1031 ' ' TYR . . . . . 0.574 ' CG ' ' HE3' ' A' ' 879' ' ' MSE . 34.3 p90 -148.49 147.96 29.69 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.674 -0.694 . . . . 64.41 109.133 -174.017 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A 1032 ' ' SER . . . . . 0.402 ' OG ' ' HG3' ' A' 1035 ' ' GLU . 90.7 p -90.94 161.41 15.19 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.769 0.795 . . . . 69.91 110.601 172.023 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A 1033 ' ' THR . . . . . . . . . . . . . 62.4 m -61.08 -37.07 81.37 Favored 'General case' 0 C--O 1.239 0.549 0 CA-C-N 115.272 -0.877 . . . . 61.03 110.163 178.149 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1034 ' ' HIS . . . . . 0.523 ' NE2' ' OE2' ' A' 1038 ' ' GLU . 33.4 t-80 -56.03 -45.79 79.04 Favored 'General case' 0 C--O 1.243 0.729 0 CA-C-N 115.794 -0.639 . . . . 103.24 111.244 175.29 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A 1035 ' ' GLU . . . . . 0.402 ' HG3' ' OG ' ' A' 1032 ' ' SER . 58.6 mt-10 -63.77 -44.24 93.98 Favored 'General case' 0 CA--C 1.517 -0.3 0 O-C-N 122.089 -0.382 . . . . 96.86 111.462 177.113 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A 1036 ' ' LEU . . . . . 0.456 ' CD1' ' HE2' ' A' ' 879' ' ' MSE . 37.0 tp -52.82 -55.54 22.3 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-O 121.107 0.48 . . . . 51.85 111.114 179.472 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A 1037 ' ' CYS . . . . . . . . . . . . . 71.0 m -62.93 -44.76 95.19 Favored 'General case' 0 CA--C 1.52 -0.176 0 CA-C-N 116.112 -0.495 . . . . 52.02 111.391 -177.274 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1038 ' ' GLU . . . . . 0.523 ' OE2' ' NE2' ' A' 1034 ' ' HIS . 59.3 mt-10 -72.74 -38.87 67.26 Favored 'General case' 0 C--O 1.24 0.557 0 C-N-CA 119.922 -0.711 . . . . 79.63 111.983 -175.28 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A 1039 ' ' ARG . . . . . . . . . . . . . 80.2 mtp180 -70.75 -31.08 67.77 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 117.422 -1.711 . . . . 54.01 110.494 178.767 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1040 ' ' PHE . . . . . . . . . . . . . 86.9 t80 -63.58 -48.81 75.9 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 120.099 -0.64 . . . . 49.7 110.395 176.106 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1041 ' ' ALA . . . . . . . . . . . . . . . -58.58 -41.72 86.4 Favored 'General case' 0 C--O 1.238 0.468 0 CA-C-N 116.241 -0.436 . . . . 46.11 111.157 178.269 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1042 ' ' ARG . . . . . . . . . . . . . 6.3 ttm-85 -70.16 -39.02 75.58 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 120.845 -0.342 . . . . 85.96 111.849 -173.974 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1043 ' ' ILE . . . . . . . . . . . . . 8.8 tp -76.93 -34.03 21.68 Favored 'Isoleucine or valine' 0 C--O 1.238 0.482 0 C-N-CA 117.924 -1.51 . . . . 50.67 110.547 -179.833 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1044 ' ' MSE . . . . . . . . . . . . . 91.9 mmm -64.14 -33.29 75.45 Favored 'General case' 0 C--N 1.329 -0.312 0 O-C-N 121.305 -0.872 . . . . 77.31 111.08 177.62 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 22.9 mt -80.14 -24.54 40.37 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 113.683 0.994 . . . . 62.73 113.683 -179.552 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1046 ' ' SER . . . . . . . . . . . . . 92.0 p -97.42 -10.65 25.07 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 118.216 -1.394 . . . . 65.34 112.817 -177.046 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1047 ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -72.56 130.56 40.89 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 118.071 0.396 . . . . 77.35 111.315 -178.22 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A 1048 ' ' SER . . . . . . . . . . . . . 13.5 p -109.76 104.34 13.29 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 109.107 -0.701 . . . . 101.18 109.107 -178.751 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1049 ' ' ARG . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.424 0 CA-C-O 120.709 0.29 . . . . 112.82 110.836 178.072 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1101 ' ' ' CL' . . . . . 1.094 'CL ' ' O ' ' A' 1255 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1102 ' ' ' CL' . . . . . 0.76 'CL ' 'CL ' ' A' 1101 ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1201 ' ' HOH . . . . . 0.965 ' O ' ' NH2' ' A' ' 875' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1202 ' ' HOH . . . . . 0.85 ' O ' ' OE1' ' A' ' 938' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1203 ' ' HOH . . . . . 0.656 ' O ' ' OE2' ' A' ' 886' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1204 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1205 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1206 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1207 ' ' HOH . . . . . 0.514 ' O ' ' HD2' ' A' ' 926' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1208 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1209 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1210 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1211 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1212 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1213 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1214 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1215 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1216 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1217 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1218 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1219 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1220 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1221 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1222 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1223 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1224 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1225 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1226 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1227 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1228 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1229 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1230 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1231 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1232 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1233 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1234 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1235 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1236 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1237 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1238 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1239 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1240 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1241 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1242 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1243 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1244 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1245 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1246 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1247 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1248 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1249 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1250 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1251 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1252 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1253 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1254 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1255 ' ' HOH . . . . . 1.094 ' O ' 'CL ' ' A' 1101 ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1256 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1257 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 777' ' ' LEU . . . . . . . . . . . . . 38.2 mt . . . . . 0 C--O 1.239 0.51 0 CA-C-O 121.037 0.446 . . . . 116.62 111.966 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 778' ' ' GLN . . . . . . . . . . . . . . . -66.44 -5.64 11.77 Favored 'General case' 0 C--O 1.239 0.506 0 N-CA-C 113.047 0.758 . . . . 103.04 113.047 177.04 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 779' ' ' SER . . . . . . . . . . . . . 57.9 p -115.02 6.06 15.15 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 123.532 0.733 . . . . 87.04 112.936 -174.543 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 780' ' ' ALA . . . . . . . . . . . . . . . -62.57 -34.61 77.31 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 119.615 -0.834 . . . . 81.58 110.615 176.969 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 781' ' ' ILE . . . . . 0.4 ' H ' HG12 ' A' ' 781' ' ' ILE . 1.4 mm -66.94 -37.08 78.69 Favored 'Isoleucine or valine' 0 C--O 1.236 0.357 0 CA-C-O 120.677 0.275 . . . . 80.16 110.642 175.373 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 782' ' ' LYS . . . . . . . . . . . . . . . -70.38 -41.33 73.21 Favored 'General case' 0 C--O 1.233 0.227 0 O-C-N 121.818 -0.551 . . . . 64.07 110.795 179.301 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 783' ' ' LEU . . . . . . . . . . . . . 1.2 mp -58.12 -47.54 82.98 Favored 'General case' 0 C--O 1.236 0.358 0 C-N-CA 120.779 -0.369 . . . . 72.14 110.692 172.912 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 784' ' ' GLU . . . . . . . . . . . . . 24.9 tp10 -65.92 -41.43 91.43 Favored 'General case' 0 C--O 1.234 0.252 0 C-N-CA 119.323 -0.951 . . . . 65.46 111.002 -176.697 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 785' ' ' TYR . . . . . . . . . . . . . 9.6 t80 -59.53 -44.33 93.21 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-O 120.657 0.265 . . . . 77.54 110.701 177.055 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . -66.23 -35.35 80.2 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 120.943 -0.303 . . . . 52.02 111.391 -178.315 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 787' ' ' ARG . . . . . . . . . . . . . 69.7 ttp85 -63.71 -40.9 97.91 Favored 'General case' 0 C--O 1.239 0.519 0 O-C-N 121.984 -0.448 . . . . 60.14 111.77 173.7 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 788' ' ' LEU . . . . . . . . . . . . . 90.9 mt -73.26 -31.24 63.98 Favored 'General case' 0 C--O 1.24 0.578 0 C-N-CA 119.425 -0.91 . . . . 51.72 111.901 -176.799 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 789' ' ' VAL . . . . . . . . . . . . . 42.1 t -58.95 -47.68 88.94 Favored 'Isoleucine or valine' 0 C--O 1.238 0.463 0 CA-C-O 121.083 0.468 . . . . 52.08 110.177 172.372 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 790' ' ' LYS . . . . . . . . . . . . . 58.9 mmtt -58.9 -51.22 70.94 Favored 'General case' 0 C--O 1.238 0.465 0 O-C-N 122.169 -0.332 . . . . 90.16 111.423 177.692 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 791' ' ' LEU . . . . . . . . . . . . . 12.8 tp -53.37 -41.98 66.4 Favored 'General case' 0 C--O 1.242 0.67 0 CA-C-O 120.932 0.396 . . . . 54.42 111.778 172.148 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 792' ' ' ALA . . . . . . . . . . . . . . . -64.93 -28.17 69.35 Favored 'General case' 0 N--CA 1.463 0.181 0 O-C-N 121.835 -0.541 . . . . 49.55 112.306 -177.596 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 793' ' ' GLN . . . . . . . . . . . . . 86.7 mt-30 -93.75 -9.8 36.39 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 113.558 0.947 . . . . 78.19 113.558 -177.197 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 794' ' ' GLU . . . . . . . . . . . . . 17.2 tt0 -62.24 138.58 58.44 Favored 'General case' 0 C--O 1.238 0.48 0 CA-C-N 118.763 0.71 . . . . 96.61 111.888 -178.665 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 795' ' ' ASP . . . . . . . . . . . . . . . -81.52 126.12 31.32 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 115.673 -0.694 . . . . 75.76 109.347 170.389 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 796' ' ' THR . . . . . 0.555 ' O ' 'CL ' ' A' 1101 ' ' ' CL' . 41.8 p -128.75 149.97 73.61 Favored Pre-proline 0 C--O 1.237 0.43 0 CA-C-N 116.436 -0.347 . . . . 64.14 110.143 -172.707 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 797' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_endo -66.2 164.61 27.29 Favored 'Trans proline' 0 C--O 1.242 0.706 0 C-N-CA 120.858 1.038 . . . . 64.31 110.939 176.584 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 798' ' ' PRO . . . . . . . . . . . . . 22.8 Cg_exo -61.05 -25.01 80.66 Favored 'Trans proline' 0 N--CA 1.479 0.627 0 N-CA-C 114.23 0.819 . . . . 56.8 114.23 -172.2 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 799' ' ' GLU . . . . . . . . . . . . . 24.2 pm0 -77.64 -9.23 58.85 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 119.238 -0.985 . . . . 66.79 112.801 -178.671 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 800' ' ' THR . . . . . . . . . . . . . 95.9 m -119.41 123.26 43.66 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 107.697 -1.223 . . . . 57.81 107.697 -172.14 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 801' ' ' ASP . . . . . . . . . . . . . 66.2 t0 -137.77 97.5 3.45 Favored 'General case' 0 C--O 1.239 0.509 0 N-CA-C 107.182 -1.414 . . . . 53.48 107.182 -176.294 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 802' ' ' TYR . . . . . . . . . . . . . 23.4 m-85 -68.52 -8.85 44.94 Favored 'General case' 0 C--O 1.233 0.218 0 C-N-CA 117.995 -1.482 . . . . 50.74 112.464 -175.832 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 803' ' ' ARG . . . . . . . . . . . . . 77.5 mtm180 -62.97 -28.35 70.03 Favored 'General case' 0 C--N 1.348 0.521 0 C-N-CA 118.509 -1.277 . . . . 42.46 110.36 171.453 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 804' ' ' LEU . . . . . . . . . . . . . 78.5 mt -74.92 -19.94 59.92 Favored 'General case' 0 C--O 1.241 0.609 0 CA-C-O 119.117 -0.468 . . . . 43.68 112.169 177.155 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 805' ' ' HIS . . . . . . . . . . . . . 11.4 m80 -81.77 -34.76 30.21 Favored 'General case' 0 C--N 1.347 0.459 0 C-N-CA 120.342 -0.543 . . . . 47.05 111.912 -178.839 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 806' ' ' HIS . . . . . . . . . . . . . 18.6 t-80 -150.9 134.55 16.44 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 118.769 -1.172 . . . . 61.01 109.877 -173.446 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 807' ' ' VAL . . . . . . . . . . . . . 6.2 p -59.58 -32.37 48.95 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 CA-C-N 116.094 -0.503 . . . . 42.16 111.378 178.012 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 808' ' ' VAL . . . . . . . . . . . . . 30.4 t -69.95 -29.76 41.58 Favored 'Isoleucine or valine' 0 C--O 1.24 0.569 0 O-C-N 120.982 -1.074 . . . . 49.6 111.417 -178.099 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 809' ' ' VAL . . . . . . . . . . . . . 97.1 t -64.1 -43.56 97.49 Favored 'Isoleucine or valine' 0 C--O 1.238 0.452 0 C-N-CA 119.739 -0.784 . . . . 43.83 110.87 171.875 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 810' ' ' TYR . . . . . . . . . . . . . 59.2 t80 -56.58 -45.02 81.56 Favored 'General case' 0 C--O 1.241 0.623 0 C-N-CA 119.553 -0.859 . . . . 42.11 110.883 173.399 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 811' ' ' PHE . . . . . . . . . . . . . 16.7 m-30 -62.06 -44.23 97.13 Favored 'General case' 0 C--O 1.24 0.58 0 C-N-CA 119.904 -0.718 . . . . 44.28 111.951 -179.619 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 812' ' ' ILE . . . . . . . . . . . . . 76.6 mt -64.58 -47.47 88.93 Favored 'Isoleucine or valine' 0 C--O 1.239 0.519 0 C-N-CA 120.36 -0.536 . . . . 46.33 110.229 -175.037 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 813' ' ' GLN . . . . . . . . . . . . . 60.7 mt-30 -66.04 -15.58 63.17 Favored 'General case' 0 C--O 1.233 0.213 0 N-CA-C 112.775 0.657 . . . . 51.32 112.775 -179.553 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 814' ' ' ASN . . . . . . . . . . . . . 59.6 m-80 -112.13 24.06 13.02 Favored 'General case' 0 C--O 1.239 0.532 0 N-CA-C 112.841 0.682 . . . . 44.31 112.841 -179.905 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 815' ' ' GLN . . . . . . . . . . . . . 15.4 mp0 57.48 37.57 27.82 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.249 0.547 . . . . 69.07 112.006 171.714 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 816' ' ' ALA . . . . . . . . . . . . . . . -65.47 150.65 95.64 Favored Pre-proline 0 C--N 1.321 -0.661 0 C-N-CA 117.12 -1.832 . . . . 52.75 109.631 174.265 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 817' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -61.51 145.71 97.65 Favored 'Trans proline' 0 C--O 1.235 0.358 0 N-CA-C 110.668 -0.551 . . . . 62.17 110.668 178.951 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 818' ' ' LYS . . . . . . . . . . . . . 7.9 ttmm -55.04 -31.42 61.09 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 119.546 -0.861 . . . . 91.05 111.028 -178.912 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 819' ' ' LYS . . . . . . . . . . . . . . . -74.14 -35.01 64.05 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 120.714 -0.394 . . . . 73.07 111.724 -176.886 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 820' ' ' ILE . . . . . . . . . . . . . 23.7 mm -61.49 -42.36 93.63 Favored 'Isoleucine or valine' 0 C--O 1.235 0.296 0 CA-C-O 121.353 0.597 . . . . 60.27 109.821 174.792 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 821' ' ' ILE . . . . . . . . . . . . . 85.6 mt -66.8 -43.83 89.55 Favored 'Isoleucine or valine' 0 C--O 1.237 0.401 0 CA-C-O 120.991 0.425 . . . . 57.21 110.812 -179.041 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 822' ' ' GLU . . . . . . . . . . . . . 62.6 mt-10 -62.78 -44.94 94.86 Favored 'General case' 0 C--O 1.237 0.423 0 C-N-CA 119.815 -0.754 . . . . 86.9 111.18 -178.3 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 823' ' ' LYS . . . . . . . . . . . . . 46.8 tttt -60.21 -39.7 87.5 Favored 'General case' 0 C--O 1.238 0.458 0 C-N-CA 119.728 -0.789 . . . . 68.37 111.368 177.901 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 824' ' ' THR . . . . . . . . . . . . . 89.0 m -63.93 -40.84 97.38 Favored 'General case' 0 C--O 1.234 0.245 0 C-N-CA 120.197 -0.601 . . . . 55.34 110.647 176.098 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 825' ' ' LEU . . . . . 0.4 HD23 ' HA ' ' A' ' 825' ' ' LEU . 33.0 mt -66.65 -44.0 83.12 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 118.392 -1.323 . . . . 53.61 111.413 176.078 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 826' ' ' LEU . . . . . . . . . . . . . 92.0 mt -60.55 -41.15 93.93 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 119.366 -0.934 . . . . 63.56 111.499 -178.632 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 827' ' ' GLU . . . . . . . . . . . . . 71.5 mt-10 -71.19 -30.86 66.92 Favored 'General case' 0 C--O 1.236 0.342 0 C-N-CA 120.188 -0.605 . . . . 94.96 112.179 179.845 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 828' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -66.46 -32.31 73.59 Favored 'General case' 0 C--O 1.238 0.489 0 C-N-CA 118.591 -1.244 . . . . 82.05 110.789 175.631 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 829' ' ' PHE . . . . . . . . . . . . . 27.0 m-85 -84.32 -37.41 21.65 Favored 'General case' 0 C--O 1.234 0.238 0 N-CA-C 112.037 0.384 . . . . 87.46 112.037 177.151 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 830' ' ' GLY . . . . . . . . . . . . . . . -102.16 2.5 51.05 Favored Glycine 0 N--CA 1.443 -0.871 0 N-CA-C 118.208 2.043 . . . . 79.41 118.208 -171.852 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 831' ' ' ASP . . . . . . . . . . . . . 14.2 p-10 -76.62 -27.54 55.75 Favored 'General case' 0 C--O 1.238 0.477 0 CA-C-N 119.561 1.68 . . . . 102.93 112.787 -175.77 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 832' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -67.89 165.64 17.24 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-O 121.924 0.869 . . . . 94.58 110.675 -174.495 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 833' ' ' ASN . . . . . . . . . . . . . 5.7 m120 -108.34 -34.66 6.73 Favored 'General case' 0 CA--C 1.515 -0.368 0 N-CA-C 113.327 0.862 . . . . 104.91 113.327 179.512 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 834' ' ' LEU . . . . . . . . . . . . . 39.6 tp -121.53 148.45 44.47 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.078 -0.712 . . . . 68.85 109.078 -170.556 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 835' ' ' SER . . . . . . . . . . . . . 32.5 t -147.33 145.45 29.34 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 118.497 -1.281 . . . . 59.33 109.735 167.572 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 836' ' ' PHE . . . . . . . . . . . . . 81.5 m-85 -103.8 0.37 30.27 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 114.577 -1.192 . . . . 57.31 112.412 172.387 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 837' ' ' ASP . . . . . . . . . . . . . 45.6 t0 -112.41 112.23 23.64 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 107.674 -1.232 . . . . 74.59 107.674 -175.76 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 838' ' ' GLU . . . . . . . . . . . . . 17.0 tt0 -50.29 -50.76 49.48 Favored 'General case' 0 C--O 1.235 0.326 0 O-C-N 123.564 0.54 . . . . 106.72 112.004 179.483 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 839' ' ' ARG . . . . . . . . . . . . . 24.4 ttp85 -63.04 -44.66 95.26 Favored 'General case' 0 C--O 1.238 0.469 0 C-N-CA 119.682 -0.807 . . . . 91.89 111.555 -177.409 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 840' ' ' CYS . . . . . . . . . . . . . 63.6 m -69.79 -33.94 73.06 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 119.624 -0.83 . . . . 72.48 112.549 177.02 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 841' ' ' HIS . . . . . . . . . . . . . 45.2 t-80 -60.03 -44.06 94.9 Favored 'General case' 0 C--O 1.238 0.459 0 C-N-CA 119.524 -0.87 . . . . 71.74 110.889 175.115 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 842' ' ' ASN . . . . . . . . . . . . . 98.2 m-20 -63.84 -42.27 97.63 Favored 'General case' 0 C--O 1.233 0.198 0 C-N-CA 120.435 -0.506 . . . . 80.67 111.412 179.366 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 843' ' ' ILE . . . . . . . . . . . . . 81.5 mt -63.26 -40.33 88.64 Favored 'Isoleucine or valine' 0 C--O 1.236 0.351 0 C-N-CA 120.353 -0.539 . . . . 62.42 110.304 177.145 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 844' ' ' MSE . . . . . . . . . . . . . 61.3 ttp -55.14 -49.64 71.27 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 113.446 0.906 . . . . 90.3 113.446 173.662 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 845' ' ' LYS . . . . . . . . . . . . . 71.1 mmtt -62.82 -39.95 95.9 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 120.7 -0.4 . . . . 81.62 111.959 178.903 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 846' ' ' VAL . . . . . . . . . . . . . 41.2 t -59.31 -48.26 87.62 Favored 'Isoleucine or valine' 0 C--O 1.239 0.502 0 CA-C-O 121.292 0.568 . . . . 72.43 110.59 177.005 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 847' ' ' ALA . . . . . . . . . . . . . . . -63.59 -42.92 98.23 Favored 'General case' 0 C--O 1.234 0.282 0 O-C-N 121.979 -0.451 . . . . 66.75 111.436 179.205 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 848' ' ' GLN . . . . . . . . . . . . . 85.6 mt-30 -62.54 -29.38 70.53 Favored 'General case' 0 C--O 1.237 0.445 0 C-N-CA 119.598 -0.841 . . . . 77.58 111.139 176.089 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 849' ' ' ALA . . . . . . . . . . . . . . . -67.65 -52.93 32.29 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 120.415 -0.514 . . . . 83.89 111.242 177.006 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 850' ' ' LYS . . . . . . . . . . . . . 62.8 mttt -59.96 -41.05 91.07 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 120.401 -0.52 . . . . 89.36 111.302 179.686 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 851' ' ' LEU . . . . . . . . . . . . . 3.8 mt -60.79 -41.97 96.63 Favored 'General case' 0 C--O 1.238 0.499 0 C-N-CA 120.285 -0.566 . . . . 93.21 111.517 -178.672 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 852' ' ' GLU . . . . . . . . . . . . . . . -60.26 -16.58 35.2 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 112.257 0.466 . . . . 104.08 112.257 179.893 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 853' ' ' MSE . . . . . . . . . . . . . 20.1 mtp . . . . . 0 C--N 1.329 -0.304 0 CA-C-N 117.992 0.36 . . . . 172.15 111.54 172.166 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 857' ' ' GLU . . . . . . . . . . . . . . . . . . . . 0 C--O 1.236 0.381 0 CA-C-O 121.411 0.624 . . . . 110.16 109.432 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 858' ' ' GLU . . . . . . . . . . . . . . . -75.15 1.82 12.34 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 115.469 -0.787 . . . . 109.52 112.426 175.6 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 859' ' ' VAL . . . . . . . . . . . . . . . -73.13 -42.93 58.63 Favored 'Isoleucine or valine' 0 C--O 1.238 0.485 0 CA-C-N 118.435 0.561 . . . . 111.24 111.078 -172.449 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 860' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 40.4 77.3 0.06 Allowed 'General case' 0 C--O 1.236 0.361 0 C-N-CA 125.212 1.405 . . . . 115.61 111.73 -174.108 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 861' ' ' LEU . . . . . . . . . . . . . 22.7 tp -77.84 -35.42 51.12 Favored 'General case' 0 C--O 1.234 0.254 0 N-CA-C 112.285 0.476 . . . . 98.19 112.285 -170.398 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 862' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -62.63 -45.77 91.3 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 120.879 -0.328 . . . . 112.11 111.122 177.866 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 863' ' ' GLU . . . . . . . . . . . . . 4.9 mp0 -56.49 -41.15 76.15 Favored 'General case' 0 C--O 1.235 0.302 0 C-N-CA 119.898 -0.721 . . . . 97.71 110.539 171.719 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 864' ' ' TYR . . . . . . . . . . . . . 76.5 t80 -66.22 -48.45 70.55 Favored 'General case' 0 C--O 1.237 0.428 0 C-N-CA 120.056 -0.657 . . . . 76.64 111.28 -176.941 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 865' ' ' GLU . . . . . . . . . . . . . 59.9 mm-40 -63.6 -33.73 76.26 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 119.865 -0.734 . . . . 101.76 111.951 177.123 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 866' ' ' GLU . . . . . . . . . . . . . 23.6 tp10 -65.02 -42.3 94.51 Favored 'General case' 0 C--O 1.239 0.542 0 C-N-CA 119.333 -0.947 . . . . 88.15 111.125 -177.705 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 867' ' ' TRP . . . . . . . . . . . . . 61.0 m95 -65.22 -39.75 93.17 Favored 'General case' 0 C--O 1.238 0.466 0 C-N-CA 120.204 -0.598 . . . . 52.27 111.19 179.483 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 868' ' ' HIS . . . . . . . . . . . . . 73.1 m-70 -73.07 -32.43 65.02 Favored 'General case' 0 C--O 1.234 0.241 0 C-N-CA 118.027 -1.469 . . . . 54.03 111.921 179.971 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 869' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 -63.28 -39.29 94.16 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 118.544 0.611 . . . . 88.36 111.524 170.593 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 870' ' ' ASP . . . . . . . . . . . . . 96.3 m-20 -62.45 -37.77 87.18 Favored 'General case' 0 C--O 1.239 0.541 0 C-N-CA 119.783 -0.767 . . . . 54.69 110.79 178.907 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 871' ' ' TYR . . . . . . . . . . . . . 40.4 t80 -68.74 -40.36 79.89 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 120.337 -0.545 . . . . 41.15 111.125 178.906 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 872' ' ' ARG . . . . . . . . . . . . . 88.3 mtm-85 -63.81 -38.05 89.65 Favored 'General case' 0 C--O 1.232 0.18 0 C-N-CA 118.773 -1.171 . . . . 72.87 110.705 178.484 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 873' ' ' LYS . . . . . . . . . . . . . 56.0 tttp -64.58 -35.87 82.41 Favored 'General case' 0 C--O 1.242 0.707 0 N-CA-C 111.938 0.347 . . . . 44.29 111.938 174.258 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 874' ' ' PHE . . . . . . . . . . . . . 54.4 t80 -63.19 -41.55 99.2 Favored 'General case' 0 C--O 1.237 0.446 0 O-C-N 121.521 -0.737 . . . . 36.14 111.042 174.593 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 875' ' ' ARG . . . . . 0.965 ' NH2' ' O ' ' A' 1201 ' ' HOH . 65.9 mtp85 -66.35 -43.56 85.7 Favored 'General case' 0 C--O 1.233 0.228 0 C-N-CA 119.287 -0.965 . . . . 92.78 111.67 -179.77 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 876' ' ' GLU . . . . . . . . . . . . . 87.1 mt-10 -67.13 -39.6 86.63 Favored 'General case' 0 C--O 1.238 0.484 0 C-N-CA 120.202 -0.599 . . . . 95.04 111.078 179.984 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 877' ' ' THR . . . . . . . . . . . . . 90.4 m -56.82 -43.84 81.43 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 120.492 -0.483 . . . . 37.65 110.739 174.981 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 878' ' ' THR . . . . . . . . . . . . . 34.1 m -59.0 -41.32 87.39 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-O 120.745 0.307 . . . . 37.47 111.743 176.788 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 879' ' ' MSE . . . . . 0.574 ' HE3' ' CG ' ' A' 1031 ' ' TYR . 29.0 tpp -70.14 -42.14 72.96 Favored 'General case' 0 C--N 1.32 -0.679 0 O-C-N 121.981 -0.449 . . . . 89.46 109.936 -176.477 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 880' ' ' TYR . . . . . 0.404 ' CD1' HD21 ' A' 1028 ' ' LEU . 41.3 m-85 -55.0 -49.19 72.12 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 119.974 -0.69 . . . . 55.77 111.276 170.758 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 881' ' ' LEU . . . . . . . . . . . . . 63.5 tp -59.2 -43.99 92.25 Favored 'General case' 0 C--O 1.235 0.334 0 C-N-CA 120.769 -0.373 . . . . 40.03 111.017 -178.43 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 882' ' ' ILE . . . . . . . . . . . . . 50.9 mt -60.74 -49.06 86.07 Favored 'Isoleucine or valine' 0 C--O 1.238 0.451 0 CA-C-O 121.348 0.594 . . . . 42.85 110.538 -177.628 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 883' ' ' ILE . . . . . . . . . . . . . 96.9 mt -65.04 -39.29 85.17 Favored 'Isoleucine or valine' 0 C--O 1.237 0.426 0 C-N-CA 119.871 -0.732 . . . . 45.34 110.628 -177.996 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 884' ' ' GLY . . . . . . . . . . . . . . . -58.66 -50.07 70.89 Favored Glycine 0 C--N 1.335 0.502 0 C-N-CA 120.595 -0.812 . . . . 44.2 112.617 173.899 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 885' ' ' LEU . . . . . . . . . . . . . 91.3 mt -67.08 -40.02 86.92 Favored 'General case' 0 C--O 1.239 0.53 0 O-C-N 122.128 -0.631 . . . . 42.81 111.858 179.529 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 886' ' ' GLU . . . . . 0.656 ' OE2' ' O ' ' A' 1203 ' ' HOH . 85.1 mt-10 -59.22 -42.32 90.72 Favored 'General case' 0 C--O 1.238 0.483 0 C-N-CA 118.509 -1.276 . . . . 60.7 111.24 176.871 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 887' ' ' ASN . . . . . . . . . . . . . 44.2 m-80 -74.38 -34.2 63.26 Favored 'General case' 0 C--O 1.239 0.546 0 C-N-CA 117.885 -1.526 . . . . 60.45 111.244 -177.67 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 888' ' ' PHE . . . . . . . . . . . . . 58.3 t80 -56.39 -45.9 80.37 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 120.045 -0.662 . . . . 47.99 110.5 171.279 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 889' ' ' GLN . . . . . . . . . . . . . 18.9 tt0 -67.45 -34.68 77.68 Favored 'General case' 0 CA--C 1.518 -0.26 0 C-N-CA 119.031 -1.068 . . . . 87.56 111.492 -175.676 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 890' ' ' ARG . . . . . . . . . . . . . 55.1 mtp85 -72.4 -6.2 41.86 Favored 'General case' 0 N--CA 1.45 -0.437 0 N-CA-C 112.937 0.717 . . . . 74.59 112.937 173.195 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 891' ' ' GLU . . . . . . . . . . . . . 56.1 mt-10 64.28 33.73 11.3 Favored 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 124.195 0.998 . . . . 67.77 111.893 -176.715 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 892' ' ' SER . . . . . . . . . . . . . 4.9 m -99.74 78.52 2.15 Favored 'General case' 0 CA--C 1.516 -0.327 0 N-CA-C 105.905 -1.887 . . . . 67.6 105.905 171.762 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 893' ' ' TYR . . . . . . . . . . . . . 63.7 m-85 -73.66 -31.22 63.36 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 118.09 -1.444 . . . . 54.14 111.68 -165.061 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 894' ' ' ILE . . . . . . . . . . . . . 83.3 mt -60.5 -48.92 86.42 Favored 'Isoleucine or valine' 0 C--N 1.346 0.432 0 C-N-CA 119.419 -0.913 . . . . 59.25 110.534 176.442 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 895' ' ' ASP . . . . . . . . . . . . . 87.6 m-20 -64.61 -38.12 89.92 Favored 'General case' 0 C--O 1.236 0.375 0 O-C-N 121.757 -0.59 . . . . 71.62 111.181 179.248 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 896' ' ' SER . . . . . . . . . . . . . 45.2 t -63.32 -44.04 96.09 Favored 'General case' 0 C--O 1.235 0.328 0 N-CA-C 112.454 0.538 . . . . 46.39 112.454 -178.282 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 897' ' ' LEU . . . . . . . . . . . . . 53.3 tp -60.68 -49.07 78.99 Favored 'General case' 0 C--O 1.239 0.511 0 C-N-CA 120.565 -0.454 . . . . 49.25 111.946 -157.724 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 898' ' ' LEU . . . . . . . . . . . . . 12.7 tp -64.4 -38.53 91.35 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 119.508 -0.877 . . . . 63.5 111.491 -175.485 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 899' ' ' PHE . . . . . . . . . . . . . 75.7 m-85 -59.02 -43.75 91.61 Favored 'General case' 0 C--O 1.244 0.768 0 C-N-CA 119.572 -0.851 . . . . 50.36 111.935 173.297 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 900' ' ' LEU . . . . . . . . . . . . . 92.8 mt -67.53 -38.33 84.05 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 118.157 -1.417 . . . . 38.09 111.265 -178.911 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 901' ' ' ILE . . . . . . . . . . . . . 30.2 mt -65.35 -40.68 89.22 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.519 0 CA-C-O 121.191 0.519 . . . . 43.88 109.963 179.133 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 902' ' ' CYS . . . . . . . . . . . . . 50.0 t -66.67 -42.91 85.82 Favored 'General case' 0 C--O 1.239 0.501 0 C-N-CA 119.952 -0.699 . . . . 47.42 110.574 178.382 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 903' ' ' ALA . . . . . . . . . . . . . . . -60.74 -46.06 91.9 Favored 'General case' 0 CA--C 1.52 -0.193 0 C-N-CA 120.612 -0.435 . . . . 36.2 111.134 179.168 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 904' ' ' TYR . . . . . . . . . . . . . 11.8 t80 -57.86 -45.68 85.93 Favored 'General case' 0 C--O 1.239 0.531 0 CA-C-O 120.974 0.416 . . . . 47.68 111.196 -179.463 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 905' ' ' GLN . . . . . . . . . . . . . 7.6 tp60 -71.69 -43.67 65.57 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 120.036 -0.666 . . . . 59.63 111.32 -174.802 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 906' ' ' ASN . . . . . . . . . . . . . 12.5 m-80 -57.85 -39.86 78.73 Favored 'General case' 0 CA--C 1.514 -0.412 0 C-N-CA 120.376 -0.53 . . . . 57.81 110.89 173.172 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 907' ' ' ASN . . . . . . . . . . . . . 55.8 t30 -64.98 -40.33 94.81 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 120.164 -0.614 . . . . 38.84 111.359 -176.9 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 908' ' ' LYS . . . . . . . . . . . . . 69.6 mmtt -62.11 -36.35 81.47 Favored 'General case' 0 C--O 1.235 0.307 0 C-N-CA 120.991 -0.284 . . . . 58.34 110.943 175.748 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 909' ' ' GLU . . . . . . . . . . . . . 85.0 mt-10 -66.74 -42.2 86.6 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 120.659 -0.417 . . . . 51.88 111.578 176.413 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 910' ' ' LEU . . . . . . . . . . . . . 96.9 mt -57.61 -52.45 65.39 Favored 'General case' 0 C--O 1.233 0.218 0 O-C-N 121.48 -0.763 . . . . 40.0 111.014 173.108 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 911' ' ' LEU . . . . . . . . . . . . . 79.6 mt -69.38 -15.11 63.24 Favored 'General case' 0 C--O 1.237 0.438 0 C-N-CA 119.619 -0.833 . . . . 46.33 112.5 -172.695 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 912' ' ' SER . . . . . . . . . . . . . 14.1 m -49.43 -34.75 17.35 Favored 'General case' 0 C--O 1.235 0.32 0 N-CA-C 112.209 0.448 . . . . 51.69 112.209 167.726 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 913' ' ' LYS . . . . . . . . . . . . . 77.9 mttt -94.78 -12.43 27.1 Favored 'General case' 0 CA--C 1.515 -0.39 0 N-CA-C 113.063 0.764 . . . . 70.02 113.063 -172.426 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 914' ' ' GLY . . . . . . . . . . . . . . . 165.53 161.1 13.78 Favored Glycine 0 N--CA 1.448 -0.502 0 C-N-CA 119.779 -1.201 . . . . 44.94 114.062 177.745 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 915' ' ' LEU . . . . . . . . . . . . . 89.8 mt -65.95 -29.81 70.27 Favored 'General case' 0 CA--C 1.513 -0.469 0 CA-C-N 115.126 -0.537 . . . . 60.47 112.303 -169.425 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 916' ' ' TYR . . . . . . . . . . . . . 65.3 m-85 -105.3 18.43 22.29 Favored 'General case' 0 N--CA 1.463 0.179 0 N-CA-C 112.983 0.734 . . . . 62.14 112.983 -172.507 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 917' ' ' ARG . . . . . . . . . . . . . 14.5 mmt180 -81.39 -17.01 50.47 Favored 'General case' 0 CA--C 1.512 -0.499 0 N-CA-C 113.886 1.069 . . . . 42.85 113.886 -176.363 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . -142.75 -147.32 4.75 Favored Glycine 0 N--CA 1.447 -0.602 0 C-N-CA 120.441 -0.885 . . . . 38.49 112.874 -162.754 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 919' ' ' HIS . . . . . . . . . . . . . 91.9 m-70 -122.9 165.92 15.9 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-O 122.083 0.944 . . . . 42.8 110.365 -174.551 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 920' ' ' ASP . . . . . . . . . . . . . 66.0 t0 -50.44 109.38 0.3 Allowed 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 114.91 -1.041 . . . . 65.62 113.18 -178.534 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 921' ' ' GLU . . . . . . . . . . . . . 30.7 mt-10 -63.4 -41.8 98.76 Favored 'General case' 0 C--O 1.233 0.206 0 N-CA-C 112.154 0.428 . . . . 68.15 112.154 -176.839 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 922' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -65.09 -32.52 74.26 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 119.052 -1.059 . . . . 93.54 111.416 -177.657 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 923' ' ' LEU . . . . . . . . . . . . . 8.6 tt -66.38 -52.79 43.14 Favored 'General case' 0 C--O 1.243 0.712 0 O-C-N 122.314 -0.241 . . . . 51.59 111.225 176.817 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 924' ' ' ILE . . . . . . . . . . . . . 15.8 mt -63.57 -41.84 94.05 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.307 0 C-N-CA 120.153 -0.619 . . . . 44.32 110.328 -179.974 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 925' ' ' SER . . . . . . . . . . . . . 34.5 t -55.15 -43.53 74.32 Favored 'General case' 0 C--O 1.238 0.477 0 C-N-CA 120.461 -0.495 . . . . 53.85 111.518 174.235 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 926' ' ' HIS . . . . . 0.514 ' HD2' ' O ' ' A' 1207 ' ' HOH . 40.4 t-80 -62.49 -47.37 84.27 Favored 'General case' 0 C--O 1.238 0.466 0 C-N-CA 120.551 -0.46 . . . . 49.51 111.207 -178.263 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 927' ' ' TYR . . . . . . . . . . . . . 51.4 m-85 -77.81 -33.13 52.57 Favored 'General case' 0 CA--C 1.515 -0.366 0 C-N-CA 119.248 -0.981 . . . . 50.8 112.444 -173.124 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 928' ' ' ARG . . . . . . . . . . . . . 30.7 ttp180 -60.82 -45.17 95.48 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 119.166 -1.013 . . . . 42.55 110.615 173.937 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 929' ' ' ARG . . . . . . . . . . . . . 34.2 ttp-105 -66.68 -46.84 74.34 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 111.802 0.297 . . . . 51.35 111.802 -179.511 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 930' ' ' GLU . . . . . . . . . . . . . 74.5 mm-40 -65.02 -33.25 75.59 Favored 'General case' 0 CA--C 1.517 -0.305 0 C-N-CA 120.461 -0.496 . . . . 71.58 111.828 178.987 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 931' ' ' CYS . . . . . . . . . . . . . 29.7 t -68.7 -37.72 79.74 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 118.958 -1.097 . . . . 44.06 110.894 178.469 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 932' ' ' LEU . . . . . . . . . . . . . 42.5 mt -61.65 -46.39 89.95 Favored 'General case' 0 C--O 1.237 0.402 0 O-C-N 121.854 -0.529 . . . . 56.97 111.127 174.408 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 933' ' ' LEU . . . . . . . . . . . . . 44.4 mt -64.78 -37.85 88.99 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 120.066 -0.654 . . . . 52.75 111.387 -177.385 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 934' ' ' LYS . . . . . . . . . . . . . 53.6 mmtt -70.23 -39.4 75.11 Favored 'General case' 0 C--O 1.235 0.311 0 C-N-CA 119.52 -0.872 . . . . 79.65 111.11 -179.504 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 935' ' ' LEU . . . . . . . . . . . . . 7.6 tp -65.17 -39.33 92.77 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 119.44 -0.904 . . . . 46.91 110.835 174.851 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 936' ' ' ASN . . . . . . . . . . . . . 19.2 t30 -62.13 -44.25 97.04 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 120.013 -0.675 . . . . 52.96 110.571 176.322 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 937' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -55.76 -43.87 77.11 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-O 120.768 0.318 . . . . 92.54 111.306 173.48 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 938' ' ' GLN . . . . . 0.85 ' OE1' ' O ' ' A' 1202 ' ' HOH . 50.9 tt0 -61.59 -45.73 92.87 Favored 'General case' 0 C--O 1.234 0.244 0 O-C-N 121.907 -0.496 . . . . 56.77 111.187 179.0 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 939' ' ' ALA . . . . . . . . . . . . . . . -63.52 -39.5 94.58 Favored 'General case' 0 C--O 1.238 0.481 0 N-CA-C 112.184 0.439 . . . . 53.66 112.184 178.212 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 940' ' ' ALA . . . . . . . . . . . . . . . -70.5 -40.94 73.27 Favored 'General case' 0 C--O 1.236 0.395 0 C-N-CA 120.34 -0.544 . . . . 55.18 111.045 -176.412 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 941' ' ' GLU . . . . . . . . . . . . . 94.0 mt-10 -64.89 -34.42 78.35 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 120.126 -0.629 . . . . 89.14 111.098 178.804 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 942' ' ' LEU . . . . . . . . . . . . . 29.9 mt -58.95 -44.58 91.48 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 120.079 -0.649 . . . . 54.65 110.758 169.33 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 943' ' ' PHE . . . . . 0.61 ' HZ ' ' HE1' ' A' ' 997' ' ' MSE . 74.1 t80 -63.82 -43.34 96.54 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 120.524 -0.47 . . . . 72.65 111.399 -179.712 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 944' ' ' GLU . . . . . . . . . . . . . 81.4 mt-10 -63.34 -22.52 66.93 Favored 'General case' 0 CA--C 1.517 -0.298 0 N-CA-C 112.45 0.537 . . . . 73.68 112.45 -177.778 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 945' ' ' SER . . . . . . . . . . . . . 15.7 p -61.04 -34.89 75.57 Favored 'General case' 0 C--O 1.235 0.325 0 C-N-CA 120.215 -0.594 . . . . 77.41 111.88 179.73 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 946' ' ' GLY . . . . . . . . . . . . . . . 84.19 9.3 82.38 Favored Glycine 0 N--CA 1.448 -0.536 0 N-CA-C 116.158 1.223 . . . . 99.52 116.158 175.824 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 947' ' ' GLU . . . . . . . . . . . . . 75.2 mm-40 -98.29 145.21 26.89 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 118.948 1.374 . . . . 106.02 110.201 178.195 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 75.9 m-20 -62.91 -45.1 94.07 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-N 115.912 -0.585 . . . . 109.48 111.819 -166.441 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 949' ' ' ARG . . . . . . . . . . . . . 58.7 mtt180 -63.94 -47.05 82.02 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 119.906 -0.717 . . . . 80.55 111.0 179.142 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 950' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -67.0 -37.55 84.4 Favored 'General case' 0 C--O 1.237 0.405 0 O-C-N 122.189 -0.32 . . . . 104.27 111.81 -177.613 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 951' ' ' VAL . . . . . . . . . . . . . 24.4 t -62.35 -48.2 89.46 Favored 'Isoleucine or valine' 0 C--O 1.234 0.283 0 C-N-CA 119.837 -0.745 . . . . 68.33 110.208 175.792 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 952' ' ' ASN . . . . . . . . . . . . . 92.4 m-20 -60.67 -38.08 83.72 Favored 'General case' 0 C--O 1.234 0.258 0 C-N-CA 120.001 -0.679 . . . . 81.68 111.11 179.066 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 953' ' ' ASN . . . . . . . . . . . . . 91.5 m-20 -68.06 -40.65 82.71 Favored 'General case' 0 CA--C 1.513 -0.449 0 C-N-CA 120.704 -0.398 . . . . 64.81 111.253 -179.754 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 954' ' ' GLY . . . . . . . . . . . . . . . -64.01 -42.66 98.13 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 119.87 -1.157 . . . . 53.31 112.147 177.482 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 955' ' ' LEU . . . . . . . . . . . . . 48.1 mt -66.86 -30.92 71.22 Favored 'General case' 0 C--O 1.236 0.393 0 O-C-N 122.426 -0.455 . . . . 60.27 111.687 177.511 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 956' ' ' ILE . . . . . . . . . . . . . 24.7 mt -68.72 -37.72 77.9 Favored 'Isoleucine or valine' 0 C--O 1.236 0.382 0 C-N-CA 119.706 -0.798 . . . . 60.36 110.525 175.557 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 957' ' ' ILE . . . . . . . . . . . . . 73.8 mt -59.43 -48.63 86.5 Favored 'Isoleucine or valine' 0 C--O 1.237 0.421 0 O-C-N 121.669 -0.644 . . . . 51.22 110.635 173.889 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 958' ' ' MSE . . . . . . . . . . . . . 95.9 mmm -60.89 -45.03 96.21 Favored 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 119.584 -0.847 . . . . 68.13 111.211 -178.608 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 959' ' ' ASN . . . . . . . . . . . . . 69.6 m-20 -74.81 -28.4 60.69 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 112.924 0.712 . . . . 59.31 112.924 -176.735 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 960' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -85.77 -41.7 14.85 Favored 'General case' 0 C--O 1.236 0.354 0 C-N-CA 119.928 -0.709 . . . . 96.48 112.591 -177.628 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 961' ' ' PHE . . . . . . . . . . . . . 69.1 m-85 -112.03 -20.13 12.08 Favored 'General case' 0 C--O 1.232 0.168 0 N-CA-C 115.255 1.576 . . . . 58.77 115.255 -166.948 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 962' ' ' ILE . . . . . . . . . . . . . 11.9 mm -112.66 -63.1 2.01 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 119.589 1.086 . . . . 59.62 111.284 -169.95 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 963' ' ' VAL . . . . . . . . . . . . . 51.1 t -47.7 -44.41 56.01 Favored Pre-proline 0 C--O 1.249 1.075 0 CA-C-O 118.371 -0.823 . . . . 55.32 112.359 -179.726 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 964' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -63.92 -21.23 68.88 Favored 'Trans proline' 0 C--O 1.236 0.413 0 CA-C-N 122.029 1.76 . . . . 57.51 114.678 -178.688 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 965' ' ' PHE . . . . . . . . . . . . . 63.8 m-85 -108.5 -5.06 16.75 Favored 'General case' 0 C--O 1.241 0.637 0 N-CA-C 114.523 1.305 . . . . 56.54 114.523 -177.297 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 966' ' ' LEU . . . . . 0.543 HD11 HD12 ' A' 1012 ' ' LEU . 16.1 mt -46.53 -43.85 39.15 Favored Pre-proline 0 C--O 1.242 0.696 0 CA-C-O 117.934 -1.032 . . . . 69.02 113.609 169.997 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 967' ' ' PRO . . . . . . . . . . . . . 77.1 Cg_exo -57.79 -29.4 85.81 Favored 'Trans proline' 0 C--O 1.235 0.33 0 CA-C-N 121.193 1.462 . . . . 68.42 113.897 176.201 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 968' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -62.84 -35.17 79.06 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-N 118.998 0.817 . . . . 69.16 111.946 178.129 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 969' ' ' LEU . . . . . . . . . . . . . 7.1 mp -87.34 -1.02 57.62 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 119.584 -0.846 . . . . 64.62 113.102 -177.045 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 970' ' ' LEU . . . . . . . . . . . . . 31.5 mt -107.49 -1.31 21.51 Favored 'General case' 0 C--O 1.233 0.228 0 N-CA-C 113.174 0.805 . . . . 76.03 113.174 176.92 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 971' ' ' VAL . . . . . . . . . . . . . 35.4 m -62.07 -27.21 42.01 Favored 'Isoleucine or valine' 0 C--O 1.239 0.511 0 CA-C-N 118.68 0.673 . . . . 81.09 112.414 -173.356 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 972' ' ' ASP . . . . . . . . . . . . . 50.6 t0 -133.26 114.18 13.49 Favored 'General case' 0 C--O 1.236 0.359 0 O-C-N 121.374 -0.829 . . . . 95.75 110.749 -168.425 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 973' ' ' GLU . . . . . . . . . . . . . . . -66.33 -21.83 66.26 Favored 'General case' 0 C--O 1.238 0.476 0 N-CA-C 112.925 0.713 . . . . 94.44 112.925 179.085 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 974' ' ' MSE . . . . . . . . . . . . . 84.6 mmm -73.46 -23.46 60.09 Favored 'General case' 0 N--CA 1.463 0.186 0 N-CA-C 113.082 0.771 . . . . 158.08 113.082 176.745 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 975' ' ' GLU . . . . . . . . . . . . . 63.2 mm-40 -83.09 74.56 9.97 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 122.748 1.261 . . . . 87.98 108.361 175.771 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 976' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -68.23 -34.1 75.62 Favored 'General case' 0 C--O 1.238 0.458 0 CA-C-N 114.499 -1.228 . . . . 120.58 112.144 -168.174 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 977' ' ' LYS . . . . . . . . . . . . . 92.0 mttt -65.16 -34.69 78.98 Favored 'General case' 0 C--O 1.237 0.441 0 C-N-CA 120.136 -0.625 . . . . 86.55 111.991 179.56 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 978' ' ' ASP . . . . . . . . . . . . . 92.6 m-20 -69.18 -39.86 78.44 Favored 'General case' 0 C--O 1.235 0.318 0 C-N-CA 120.789 -0.364 . . . . 65.76 111.576 176.499 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 979' ' ' ILE . . . . . . . . . . . . . 47.6 mm -61.34 -47.23 94.42 Favored 'Isoleucine or valine' 0 C--O 1.235 0.31 0 N-CA-C 109.771 -0.455 . . . . 72.91 109.771 177.273 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 980' ' ' LEU . . . . . . . . . . . . . 93.3 mt -64.95 -33.77 76.82 Favored 'General case' 0 C--O 1.238 0.467 0 CA-C-N 116.631 -0.259 . . . . 74.35 111.335 -179.148 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 981' ' ' ALA . . . . . . . . . . . . . . . -68.58 -40.14 80.68 Favored 'General case' 0 N--CA 1.455 -0.178 0 C-N-CA 119.889 -0.725 . . . . 54.97 111.333 178.702 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 982' ' ' VAL . . . . . . . . . . . . . 49.4 t -63.12 -41.24 92.1 Favored 'Isoleucine or valine' 0 C--O 1.239 0.531 0 C-N-CA 119.673 -0.811 . . . . 54.83 110.193 175.982 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 983' ' ' GLU . . . . . 0.546 ' O ' ' ND2' ' A' ' 987' ' ' ASN . 65.7 mm-40 -65.55 -35.95 82.37 Favored 'General case' 0 N--CA 1.463 0.199 0 C-N-CA 119.928 -0.709 . . . . 94.69 111.691 177.382 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 984' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -66.85 -41.28 87.62 Favored 'General case' 0 C--O 1.239 0.553 0 O-C-N 121.999 -0.438 . . . . 99.47 111.058 178.433 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 985' ' ' MSE . . . . . . . . . . . . . 3.3 mtm -65.61 -39.75 91.89 Favored 'General case' 0 C--O 1.233 0.196 0 C-N-CA 120.462 -0.495 . . . . 81.25 111.255 177.168 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 986' ' ' ARG . . . . . . . . . . . . . 91.7 mtt180 -67.06 -42.8 84.15 Favored 'General case' 0 C--O 1.24 0.585 0 C-N-CA 120.602 -0.439 . . . . 63.7 111.894 178.79 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 987' ' ' ASN . . . . . 0.546 ' ND2' ' O ' ' A' ' 983' ' ' GLU . 68.8 m-80 -59.62 -41.31 90.11 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 120.067 -0.653 . . . . 84.24 110.802 177.511 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 988' ' ' ARG . . . . . . . . . . . . . 11.9 tpt180 -56.34 -49.92 72.99 Favored 'General case' 0 CA--C 1.519 -0.223 0 CA-C-O 120.782 0.325 . . . . 69.96 110.642 -177.529 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 989' ' ' TRP . . . . . . . . . . . . . 80.0 m95 -71.9 -30.19 65.12 Favored 'General case' 0 C--O 1.238 0.463 0 N-CA-C 112.455 0.539 . . . . 58.5 112.455 -177.985 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 990' ' ' CYS . . . . . . . . . . . . . 99.0 m -72.05 -31.32 66.03 Favored 'General case' 0 C--O 1.237 0.439 0 N-CA-C 112.289 0.477 . . . . 64.75 112.289 175.075 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 991' ' ' SER . . . . . . . . . . . . . 70.4 p -64.22 -14.74 57.42 Favored 'General case' 0 C--O 1.232 0.171 0 C-N-CA 119.096 -1.042 . . . . 70.59 112.416 -177.919 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 992' ' ' TYR . . . . . . . . . . . . . 25.7 m-85 -73.84 -15.17 61.17 Favored 'General case' 0 C--O 1.238 0.467 0 CA-C-N 118.962 0.801 . . . . 80.33 112.563 174.882 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 993' ' ' LEU . . . . . . . . . . . . . 74.9 mt -58.25 -40.13 80.98 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 119.919 -0.712 . . . . 91.76 111.077 168.03 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 994' ' ' GLY . . . . . . . . . . . . . . . -71.04 7.19 5.89 Favored Glycine 0 C--N 1.342 0.909 0 CA-C-O 118.769 -1.017 . . . . 106.81 115.568 175.087 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 995' ' ' GLN . . . . . . . . . . . . . . . -116.69 143.55 45.51 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-N 118.558 1.179 . . . . 103.45 110.399 175.79 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 996' ' ' GLU . . . . . . . . . . . . . . . -92.76 135.9 33.71 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.275 -0.42 . . . . 105.18 109.915 176.793 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 997' ' ' MSE . . . . . 0.705 ' HE2' ' HA ' ' A' 1002 ' ' GLN . 2.0 ptt? -157.33 177.93 10.89 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.322 -0.399 . . . . 127.69 111.956 -173.994 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 998' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -54.6 133.64 64.03 Favored Pre-proline 0 C--O 1.24 0.555 0 N-CA-C 109.797 -0.445 . . . . 119.2 109.797 177.314 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 999' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -68.39 -30.28 30.14 Favored 'Trans proline' 0 C--O 1.237 0.457 0 N-CA-C 114.114 0.775 . . . . 95.54 114.114 -171.78 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1000 ' ' HIS . . . . . . . . . . . . . 15.9 p-80 -69.3 -27.89 65.79 Favored 'General case' 0 C--O 1.239 0.502 0 C-N-CA 118.44 -1.304 . . . . 126.38 110.672 178.27 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1001 ' ' LEU . . . . . . . . . . . . . 40.9 mt -71.33 -34.53 70.63 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 120.678 -0.409 . . . . 97.81 111.115 169.23 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1002 ' ' GLN . . . . . 0.705 ' HA ' ' HE2' ' A' ' 997' ' ' MSE . 14.0 tp60 -66.09 -36.56 83.5 Favored 'General case' 0 CA--C 1.516 -0.332 0 C-N-CA 119.37 -0.932 . . . . 113.03 111.171 176.799 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A 1003 ' ' GLU . . . . . . . . . . . . . . . -60.87 -37.82 83.47 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 119.942 -0.703 . . . . 81.26 110.758 171.956 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1004 ' ' LYS . . . . . . . . . . . . . 47.4 mttm -64.38 -48.57 74.94 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 120.109 -0.636 . . . . 86.62 111.096 177.616 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1005 ' ' LEU . . . . . . . . . . . . . 59.1 tp -58.09 -40.25 80.65 Favored 'General case' 0 C--O 1.238 0.478 0 C-N-CA 120.438 -0.505 . . . . 66.89 111.067 177.793 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1006 ' ' THR . . . . . . . . . . . . . 1.3 m -65.42 -39.44 92.13 Favored 'General case' 0 C--O 1.237 0.406 0 N-CA-C 112.144 0.424 . . . . 76.46 112.144 -176.654 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1007 ' ' ASP . . . . . . . . . . . . . 73.5 m-20 -73.04 -28.37 62.3 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 120.076 -0.649 . . . . 100.74 111.693 176.695 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1008 ' ' PHE . . . . . . . . . . . . . 38.4 t80 -78.66 -40.42 34.09 Favored 'General case' 0 C--O 1.238 0.492 0 N-CA-C 112.649 0.611 . . . . 58.15 112.649 -175.614 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1009 ' ' LEU . . . . . . . . . . . . . 37.7 mt -57.13 -43.11 99.15 Favored Pre-proline 0 C--O 1.244 0.816 0 N-CA-C 113.864 1.061 . . . . 61.6 113.864 -171.099 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1010 ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -55.83 -36.39 95.31 Favored 'Trans proline' 0 C--O 1.237 0.432 0 CA-C-N 121.763 1.665 . . . . 72.59 112.793 175.238 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1011 ' ' LYS . . . . . . . . . . . . . 58.0 mttp -60.15 -43.32 95.83 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-N 117.899 0.318 . . . . 82.56 111.23 177.316 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1012 ' ' LEU . . . . . 0.543 HD12 HD11 ' A' ' 966' ' ' LEU . 47.6 tp -73.67 -29.98 62.63 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 120.807 -0.357 . . . . 63.39 111.602 -178.449 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A 1013 ' ' LEU . . . . . . . . . . . . . 19.6 mt -98.71 7.31 46.24 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 113.014 0.746 . . . . 81.05 113.014 -174.387 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1014 ' ' ASP . . . . . . . . . . . . . 35.0 t0 -63.82 139.38 58.76 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-N 118.408 0.549 . . . . 107.62 111.35 -171.723 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1015 ' ' CYS . . . . . . . . . . . . . 43.1 m -75.12 -27.39 59.8 Favored 'General case' 0 C--O 1.236 0.379 0 CA-C-N 115.348 -0.842 . . . . 115.9 112.395 178.487 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1016 ' ' SER . . . . . . . . . . . . . 27.6 m -63.51 139.58 58.78 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 121.413 0.625 . . . . 112.13 111.285 -172.802 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1017 ' ' MSE . . . . . . . . . . . . . 3.5 mmt -100.05 21.59 12.55 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.38 -0.827 . . . . 170.84 110.965 -179.178 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1018 ' ' GLU . . . . . . . . . . . . . . . -64.68 118.76 9.38 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-N 116.191 -0.459 . . . . 120.2 110.421 -176.826 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1019 ' ' ILE . . . . . . . . . . . . . 3.7 tp -149.4 133.97 9.52 Favored 'Isoleucine or valine' 0 C--O 1.235 0.337 0 N-CA-C 107.636 -1.246 . . . . 99.01 107.636 176.705 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1020 ' ' LYS . . . . . . . . . . . . . . . -56.52 145.74 27.08 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 121.132 0.492 . . . . 77.12 109.838 178.359 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1021 ' ' SER . . . . . . . . . . . . . 17.6 p -83.0 -24.98 32.64 Favored 'General case' 0 C--N 1.331 -0.205 0 C-N-CA 118.693 -1.203 . . . . 69.52 112.1 -172.02 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1022 ' ' PHE . . . . . . . . . . . . . 78.1 t80 -120.42 131.67 54.9 Favored 'General case' 0 CA--C 1.518 -0.287 0 CA-C-N 118.601 0.637 . . . . 57.37 109.546 177.762 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1023 ' ' HIS . . . . . . . . . . . . . 17.7 t-80 -121.33 134.7 55.14 Favored 'General case' 0 C--O 1.24 0.563 0 N-CA-C 108.49 -0.93 . . . . 73.6 108.49 172.073 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1024 ' ' GLU . . . . . . . . . . . . . 39.1 tp10 -68.41 135.58 90.91 Favored Pre-proline 0 C--N 1.319 -0.754 0 N-CA-C 109.184 -0.673 . . . . 92.27 109.184 177.816 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1025 ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -77.28 152.49 30.73 Favored 'Trans proline' 0 C--N 1.331 -0.358 0 CA-C-N 119.216 0.756 . . . . 56.25 111.45 -177.898 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1026 ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -60.26 157.44 35.3 Favored 'Trans proline' 0 C--N 1.331 -0.376 0 N-CA-C 109.766 -0.898 . . . . 60.76 109.766 173.539 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1027 ' ' LYS . . . . . . . . . . . . . . . -75.9 137.13 40.19 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.604 -0.726 . . . . 65.97 109.817 -177.023 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1028 ' ' LEU . . . . . 0.404 HD21 ' CD1' ' A' ' 880' ' ' TYR . 34.5 mt -101.75 126.51 33.82 Favored Pre-proline 0 C--O 1.237 0.419 0 C-N-CA 124.042 0.937 . . . . 64.08 109.588 173.513 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A 1029 ' ' PRO . . . . . . . . . . . . . 35.3 Cg_exo -66.08 151.34 84.04 Favored 'Trans proline' 0 C--N 1.329 -0.496 0 N-CA-C 109.415 -1.033 . . . . 69.67 109.415 168.733 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1030 ' ' SER . . . . . . . . . . . . . 78.8 p -59.63 146.29 41.54 Favored 'General case' 0 C--O 1.234 0.251 0 C-N-CA 119.969 -0.692 . . . . 71.81 109.215 176.446 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1031 ' ' TYR . . . . . 0.574 ' CG ' ' HE3' ' A' ' 879' ' ' MSE . 34.3 p90 -148.49 147.96 29.69 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.674 -0.694 . . . . 64.41 109.133 -174.017 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A 1032 ' ' SER . . . . . 0.402 ' OG ' ' HG3' ' A' 1035 ' ' GLU . 90.7 p -90.94 161.41 15.19 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.769 0.795 . . . . 69.91 110.601 172.023 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A 1033 ' ' THR . . . . . . . . . . . . . 62.4 m -61.08 -37.07 81.37 Favored 'General case' 0 C--O 1.239 0.549 0 CA-C-N 115.272 -0.877 . . . . 61.03 110.163 178.149 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1034 ' ' HIS . . . . . 0.523 ' NE2' ' OE2' ' A' 1038 ' ' GLU . 33.4 t-80 -56.03 -45.79 79.04 Favored 'General case' 0 C--O 1.243 0.729 0 CA-C-N 115.794 -0.639 . . . . 103.24 111.244 175.29 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A 1035 ' ' GLU . . . . . 0.402 ' HG3' ' OG ' ' A' 1032 ' ' SER . 58.6 mt-10 -63.77 -44.24 93.98 Favored 'General case' 0 CA--C 1.517 -0.3 0 O-C-N 122.089 -0.382 . . . . 96.86 111.462 177.113 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A 1036 ' ' LEU . . . . . 0.456 ' CD1' ' HE2' ' A' ' 879' ' ' MSE . 37.0 tp -52.82 -55.54 22.3 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-O 121.107 0.48 . . . . 51.85 111.114 179.472 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A 1037 ' ' CYS . . . . . . . . . . . . . 71.0 m -62.93 -44.76 95.19 Favored 'General case' 0 CA--C 1.52 -0.176 0 CA-C-N 116.112 -0.495 . . . . 52.02 111.391 -177.274 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1038 ' ' GLU . . . . . 0.523 ' OE2' ' NE2' ' A' 1034 ' ' HIS . 59.3 mt-10 -72.74 -38.87 67.26 Favored 'General case' 0 C--O 1.24 0.557 0 C-N-CA 119.922 -0.711 . . . . 79.63 111.983 -175.28 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A 1039 ' ' ARG . . . . . . . . . . . . . 80.2 mtp180 -70.75 -31.08 67.77 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 117.422 -1.711 . . . . 54.01 110.494 178.767 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1040 ' ' PHE . . . . . . . . . . . . . 86.9 t80 -63.58 -48.81 75.9 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 120.099 -0.64 . . . . 49.7 110.395 176.106 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1041 ' ' ALA . . . . . . . . . . . . . . . -58.58 -41.72 86.4 Favored 'General case' 0 C--O 1.238 0.468 0 CA-C-N 116.241 -0.436 . . . . 46.11 111.157 178.269 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1042 ' ' ARG . . . . . . . . . . . . . 6.3 ttm-85 -70.16 -39.02 75.58 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 120.845 -0.342 . . . . 85.96 111.849 -173.974 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1043 ' ' ILE . . . . . . . . . . . . . 8.8 tp -76.93 -34.03 21.68 Favored 'Isoleucine or valine' 0 C--O 1.238 0.482 0 C-N-CA 117.924 -1.51 . . . . 50.67 110.547 -179.833 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1044 ' ' MSE . . . . . . . . . . . . . 91.9 mmm -64.14 -33.29 75.45 Favored 'General case' 0 C--N 1.329 -0.312 0 O-C-N 121.305 -0.872 . . . . 77.31 111.08 177.62 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1045 ' ' LEU . . . . . . . . . . . . . 22.9 mt -80.14 -24.54 40.37 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 113.683 0.994 . . . . 62.73 113.683 -179.552 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1046 ' ' SER . . . . . . . . . . . . . 92.0 p -97.42 -10.65 25.07 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 118.216 -1.394 . . . . 65.34 112.817 -177.046 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1047 ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -72.56 130.56 40.89 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 118.071 0.396 . . . . 77.35 111.315 -178.22 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A 1048 ' ' SER . . . . . . . . . . . . . 13.5 p -109.76 104.34 13.29 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 109.107 -0.701 . . . . 101.18 109.107 -178.751 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1049 ' ' ARG . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.424 0 CA-C-O 120.709 0.29 . . . . 112.82 110.836 178.072 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1101 ' ' ' CL' . . . . . 1.094 'CL ' ' O ' ' A' 1255 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1102 ' ' ' CL' . . . . . 0.76 'CL ' 'CL ' ' A' 1101 ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1201 ' ' HOH . . . . . 0.965 ' O ' ' NH2' ' A' ' 875' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1202 ' ' HOH . . . . . 0.85 ' O ' ' OE1' ' A' ' 938' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1203 ' ' HOH . . . . . 0.656 ' O ' ' OE2' ' A' ' 886' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1204 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1205 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1206 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1207 ' ' HOH . . . . . 0.514 ' O ' ' HD2' ' A' ' 926' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1208 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1209 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1210 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1211 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1212 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1213 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1214 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1215 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1216 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1217 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1218 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1219 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1220 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1221 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1222 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1223 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1224 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1225 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1226 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1227 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1228 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1229 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1230 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1231 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1232 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1233 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1234 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1235 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1236 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1237 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1238 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1239 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1240 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1241 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1242 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1243 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1244 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1245 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1246 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1247 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1248 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1249 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1250 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1251 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1252 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1253 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1254 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1255 ' ' HOH . . . . . 1.094 ' O ' 'CL ' ' A' 1101 ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1256 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1257 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_