data_1ag6_residue save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 1ag6 _Structure_validation_residue.Date_analyzed 2016-10-12 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 ecloud orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 14.6 p . . . . . 0 N--CA 1.494 1.751 0 N-CA-C 108.47 -0.937 . . . . 26.05 108.47 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -111.68 136.45 50.91 Favored 'General case' 0 C--O 1.252 1.22 0 N-CA-C 109.495 -0.558 . . . . 23.37 109.495 174.859 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 90.7 t -123.47 125.28 71.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 N-CA-C 107.677 -1.231 . . . . 18.82 107.677 -178.655 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 82.1 mt -85.46 140.11 30.97 Favored 'General case' 0 C--O 1.221 -0.427 0 O-C-N 120.197 -1.565 . . . . 19.34 110.876 176.806 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 62.8 mt -96.43 98.25 10.1 Favored 'General case' 0 N--CA 1.442 -0.833 0 C-N-CA 124.827 1.251 . . . . 21.83 109.154 175.593 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 97.3 140.53 11.4 Favored Glycine 0 N--CA 1.484 1.847 0 O-C-N 126.624 2.453 . . . . 18.55 109.538 -178.354 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -75.76 170.28 54.64 Favored Glycine 0 C--N 1.345 1.08 0 O-C-N 119.154 -2.38 . . . . 21.27 108.598 169.095 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 23.4 m-20 -63.96 -26.64 68.68 Favored 'General case' 0 C--O 1.244 0.795 0 O-C-N 119.323 -2.28 . . . . 22.96 111.844 178.838 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 44.8 p-10 -81.46 3.28 25.23 Favored 'General case' 0 N--CA 1.448 -0.559 0 C-N-CA 125.16 1.384 . . . . 26.28 112.231 178.874 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 84.63 10.68 78.96 Favored Glycine 0 C--O 1.258 1.604 0 CA-C-O 116.894 -2.059 . . . . 24.41 114.241 -177.783 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 12.9 p -66.79 144.48 56.29 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 119.745 1.772 . . . . 23.38 109.339 178.31 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 97.1 mt -96.97 75.88 2.67 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 125.821 1.951 . . . . 23.97 108.973 -166.324 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -139.18 144.47 38.58 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-N 114.935 -1.03 . . . . 19.69 109.768 -170.35 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 78.8 m-85 -80.14 135.38 36.29 Favored 'General case' 0 C--O 1.259 1.572 0 N-CA-C 108.261 -1.014 . . . . 18.86 108.261 160.458 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 20.5 mt -126.24 108.73 24.14 Favored Pre-proline 0 C--O 1.246 0.903 0 O-C-N 120.744 -1.222 . . . . 22.06 111.246 177.861 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -78.31 161.47 90.25 Favored 'Cis proline' 0 N--CA 1.43 -2.206 0 N-CA-C 115.992 1.497 . . . . 19.95 115.992 -0.568 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -103.15 -16.27 21.43 Favored Glycine 0 C--O 1.218 -0.852 0 C-N-CA 120.179 -1.01 . . . . 24.78 111.408 -172.151 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 32.6 t0 -140.87 112.0 7.22 Favored 'General case' 0 C--N 1.309 -1.172 0 N-CA-C 105.019 -2.215 . . . . 35.31 105.019 -179.405 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 28.7 p90 -150.06 168.5 23.71 Favored 'General case' 0 C--N 1.323 -0.563 0 O-C-N 121.085 -1.009 . . . . 24.79 108.893 -170.9 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 4.0 m -122.43 145.17 48.54 Favored 'General case' 0 C--N 1.314 -0.953 0 O-C-N 126.64 2.462 . . . . 33.29 109.326 -179.288 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 27.5 m -133.95 163.59 36.82 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.662 0 N-CA-C 108.025 -1.102 . . . . 26.27 108.025 174.115 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -82.89 151.3 26.03 Favored 'General case' 0 C--O 1.239 0.538 0 CA-C-O 116.9 -1.524 . . . . 26.53 107.746 170.661 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 38.6 t -52.42 131.73 33.84 Favored 'General case' 0 C--N 1.321 -0.663 0 O-C-N 125.471 1.732 . . . . 29.97 109.611 168.814 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 83.26 2.65 90.37 Favored Glycine 0 CA--C 1.498 -0.988 0 N-CA-C 117.8 1.88 . . . . 25.89 117.8 -178.944 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 59.8 tt0 -83.06 137.95 33.91 Favored 'General case' 0 C--N 1.322 -0.601 0 O-C-N 120.131 -1.805 . . . . 32.82 109.732 176.022 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -80.81 141.52 34.62 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 118.967 0.803 . . . . 30.86 110.115 -176.343 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 73.8 mt -110.96 121.33 63.44 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 N-CA-C 105.346 -2.094 . . . . 23.98 105.346 176.483 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 60.8 t -106.04 110.46 31.41 Favored 'Isoleucine or valine' 0 C--O 1.252 1.237 0 CA-C-N 114.4 -1.273 . . . . 19.47 108.467 -179.972 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 96.5 m-85 -92.87 121.05 33.85 Favored 'General case' 0 N--CA 1.473 0.712 0 O-C-N 124.582 1.176 . . . . 18.39 107.985 175.748 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -113.58 120.63 41.59 Favored 'General case' 0 C--O 1.24 0.572 0 O-C-N 121.674 -0.641 . . . . 19.12 111.934 -175.715 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 36.1 t30 -68.58 132.84 47.6 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 118.942 -1.103 . . . . 20.51 110.685 -176.61 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 61.9 t30 -119.95 -70.01 0.81 Allowed 'General case' 0 C--O 1.24 0.578 0 C-N-CA 117.15 -1.82 . . . . 21.43 110.376 -171.355 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -152.67 166.6 31.61 Favored 'General case' 0 C--O 1.248 0.977 0 CA-C-N 119.479 1.036 . . . . 20.44 109.462 -179.454 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 75.38 13.78 82.54 Favored Glycine 0 CA--C 1.53 0.984 0 CA-C-N 120.663 1.574 . . . . 22.5 113.73 179.314 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 8.1 p90 -71.69 171.11 9.83 Favored Pre-proline 0 N--CA 1.485 1.303 0 N-CA-C 105.938 -1.875 . . . . 29.77 105.938 -175.114 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -65.66 149.93 76.89 Favored 'Cis proline' 0 N--CA 1.439 -1.708 0 N-CA-C 116.142 1.555 . . . . 27.82 116.142 4.575 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 89.2 m-70 -136.88 158.13 45.15 Favored 'General case' 0 CA--C 1.537 0.444 0 O-C-N 120.028 -1.67 . . . . 20.76 108.787 173.341 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 52.5 p-10 -147.2 -170.8 3.64 Favored 'General case' 0 C--O 1.246 0.897 0 CA-C-O 123.929 1.823 . . . . 26.25 107.319 162.187 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 88.9 t -137.49 114.52 12.42 Favored 'Isoleucine or valine' 0 C--O 1.248 1.014 0 N-CA-C 106.738 -1.579 . . . . 19.54 106.738 -175.11 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 49.3 t -126.18 138.3 55.05 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.753 0 O-C-N 125.943 2.027 . . . . 22.37 107.619 177.745 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 62.7 m-85 -92.59 141.05 28.91 Favored 'General case' 0 N--CA 1.475 0.817 0 O-C-N 119.952 -1.717 . . . . 22.75 110.715 176.277 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 36.6 t0 -82.83 118.56 23.5 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-O 117.975 -1.012 . . . . 34.35 109.627 -177.792 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 25.3 pt-20 -73.97 -15.48 61.11 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 117.498 -1.681 . . . . 44.22 111.291 -168.232 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 72.1 m-20 -80.11 -14.32 58.59 Favored 'General case' 0 C--O 1.241 0.649 0 N-CA-C 115.607 1.706 . . . . 42.54 115.607 171.198 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -126.26 41.25 3.56 Favored 'General case' 0 C--O 1.243 0.746 0 CA-C-O 118.904 -0.57 . . . . 45.44 111.415 -172.268 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 27.7 pt -131.96 169.8 12.94 Favored Pre-proline 0 N--CA 1.47 0.556 0 N-CA-C 106.621 -1.622 . . . . 28.22 106.621 172.356 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -63.37 154.46 68.1 Favored 'Trans proline' 0 C--N 1.312 -1.395 0 CA-C-O 125.383 2.159 . . . . 27.65 113.505 -177.115 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 73.0 m -61.21 139.71 58.08 Favored 'General case' 0 C--N 1.355 0.825 0 CA-C-N 114.118 -1.401 . . . . 39.02 108.685 -179.716 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 86.63 2.69 84.49 Favored Glycine 0 C--O 1.245 0.796 0 CA-C-O 118.188 -1.34 . . . . 34.68 111.923 175.793 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 96.5 t -100.5 132.04 46.89 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.946 0 C-N-CA 117.583 -1.647 . . . . 26.55 107.855 175.631 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 66.2 t0 -91.06 115.77 28.28 Favored 'General case' 0 N--CA 1.493 1.72 0 C-N-CA 119.653 -0.819 . . . . 24.45 109.583 175.018 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.82 -22.36 66.97 Favored 'General case' 0 N--CA 1.496 1.858 0 C-N-CA 118.478 -1.289 . . . . 20.75 110.964 -176.064 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -68.33 -25.72 65.26 Favored 'General case' 0 N--CA 1.443 -0.795 0 O-C-N 118.808 -2.432 . . . . 24.2 112.466 -178.498 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 35.8 mtpt -78.59 -25.89 45.33 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 120.146 1.339 . . . . 36.48 111.15 -179.262 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 22.6 pt -106.83 -9.94 10.56 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.138 0 CA-C-O 116.958 -1.496 . . . . 22.72 109.683 -172.281 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 50.2 m -92.93 152.96 19.06 Favored 'General case' 0 C--O 1.247 0.971 0 CA-C-N 120.435 1.471 . . . . 20.02 108.859 -176.463 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 96.2 mtp -65.59 152.51 43.94 Favored 'General case' 0 C--O 1.244 0.805 0 CA-C-O 122.219 1.009 . . . . 21.58 112.498 167.545 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 25.9 t -58.88 145.04 42.58 Favored 'General case' 0 C--O 1.243 0.738 0 C-N-CA 124.128 0.971 . . . . 24.55 108.858 171.304 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 6.6 tm-20 -64.33 -30.79 71.82 Favored 'General case' 0 N--CA 1.472 0.625 0 N-CA-C 113.104 0.779 . . . . 40.88 113.104 -171.262 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -93.8 -2.09 54.07 Favored 'General case' 0 C--O 1.235 0.338 0 O-C-N 120.463 -1.398 . . . . 37.27 111.092 -178.155 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 38.7 t0 -91.92 110.72 22.08 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 106.656 -1.609 . . . . 35.32 106.656 -175.844 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 88.5 mt -117.03 147.36 42.4 Favored 'General case' 0 C--O 1.243 0.726 0 N-CA-C 106.364 -1.717 . . . . 29.18 106.364 178.49 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 47.0 mt -87.82 119.37 28.09 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 108.257 -1.016 . . . . 25.32 108.257 173.346 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 34.9 m-80 -124.19 12.49 8.9 Favored 'General case' 0 C--O 1.253 1.24 0 N-CA-C 112.544 0.572 . . . . 34.55 112.544 -170.428 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -139.64 145.83 45.1 Favored Pre-proline 0 C--O 1.246 0.872 0 O-C-N 121.62 -0.675 . . . . 24.75 110.096 173.732 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 15.4 Cg_exo -51.25 129.63 29.47 Favored 'Trans proline' 0 N--CA 1.444 -1.438 0 C-N-CA 123.221 2.614 . . . . 25.44 114.372 176.726 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 95.42 -14.03 65.69 Favored Glycine 0 CA--C 1.534 1.28 0 CA-C-O 113.749 -3.806 . . . . 20.99 110.97 168.672 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -58.3 145.2 38.67 Favored 'General case' 0 N--CA 1.472 0.654 0 O-C-N 127.41 2.477 . . . . 30.57 111.155 174.04 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 73.0 p -126.08 158.93 34.16 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 120.686 1.585 . . . . 21.41 110.964 -175.292 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 39.1 t80 -128.89 127.44 41.82 Favored 'General case' 0 C--O 1.255 1.35 0 N-CA-C 105.581 -2.007 . . . . 24.57 105.581 167.774 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 88.0 mttt -116.98 135.03 54.01 Favored 'General case' 0 C--N 1.314 -0.975 0 N-CA-C 107.917 -1.142 . . . . 23.25 107.917 -175.419 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 14.3 p -145.44 150.11 16.04 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.215 0 O-C-N 124.95 1.407 . . . . 21.56 108.437 178.94 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 42.9 m -125.24 131.18 53.18 Favored 'General case' 0 C--O 1.235 0.318 0 N-CA-C 109.069 -0.715 . . . . 24.5 109.069 178.688 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 91.4 mt -110.38 137.26 48.34 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-O 116.952 -1.499 . . . . 23.21 107.03 -174.435 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 44.0 p -118.57 -34.66 3.94 Favored 'General case' 0 C--O 1.245 0.838 0 O-C-N 125.988 2.055 . . . . 27.03 113.237 -179.529 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 39.5 tp10 -71.99 127.64 33.19 Favored 'General case' 0 C--N 1.317 -0.843 0 O-C-N 120.294 -1.504 . . . . 39.73 107.439 -176.719 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 17.6 mtpt -68.0 149.93 49.09 Favored 'General case' 0 CA--C 1.512 -0.506 0 N-CA-C 112.895 0.702 . . . . 41.9 112.895 -177.567 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 137.13 -171.2 23.21 Favored Glycine 0 CA--C 1.532 1.127 0 C-N-CA 118.072 -2.014 . . . . 25.92 110.179 178.29 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 23.2 p -107.85 140.06 41.51 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-O 123.771 1.748 . . . . 33.43 110.73 179.39 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 5.0 m-85 -126.99 124.84 40.36 Favored 'General case' 0 N--CA 1.442 -0.846 0 CA-C-N 113.762 -1.563 . . . . 22.49 109.692 -176.497 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 27.2 tttp -93.48 133.14 37.07 Favored 'General case' 0 C--N 1.31 -1.114 0 CA-C-N 115.393 -0.821 . . . . 38.78 110.84 171.516 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 46.7 p90 -135.71 168.58 19.01 Favored 'General case' 0 N--CA 1.448 -0.569 0 C-N-CA 119.708 -0.797 . . . . 21.58 109.643 174.122 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 38.9 p90 -153.5 166.87 31.34 Favored 'General case' 0 C--N 1.321 -0.64 0 C-N-CA 118.399 -1.32 . . . . 29.87 109.95 -179.671 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 35.6 t -96.52 117.03 30.07 Favored 'General case' 0 C--N 1.345 0.408 0 CA-C-N 112.945 -1.934 . . . . 22.77 109.177 170.797 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 2.9 t -53.68 -51.69 74.08 Favored Pre-proline 0 C--N 1.317 -0.817 0 N-CA-C 117.46 2.393 . . . . 36.12 117.46 -171.191 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -61.61 -26.73 80.74 Favored 'Trans proline' 0 CA--C 1.501 -1.149 0 C-N-CA 122.671 2.247 . . . . 28.53 115.563 175.207 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 35.9 m170 -115.67 15.66 16.49 Favored 'General case' 0 N--CA 1.445 -0.695 0 O-C-N 117.972 -2.955 . . . . 25.21 113.078 -172.068 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -65.93 -41.06 91.85 Favored 'General case' 0 C--N 1.34 0.167 0 C-N-CA 119.074 -1.05 . . . . 40.09 111.767 -174.754 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.0 -25.91 66.68 Favored Glycine 0 C--O 1.247 0.945 0 CA-C-N 119.006 0.821 . . . . 36.73 114.688 171.858 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -86.04 2.99 44.32 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 119.808 1.804 . . . . 33.72 114.296 175.728 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 100.7 12.91 36.29 Favored Glycine 0 CA--C 1.528 0.89 0 CA-C-N 120.163 1.347 . . . . 30.66 111.447 173.476 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 23.6 ttt -88.55 83.53 6.79 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 116.395 -2.122 . . . . 21.51 109.161 -176.814 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 23.5 m -137.7 153.76 28.43 Favored 'Isoleucine or valine' 0 C--O 1.254 1.295 0 N-CA-C 107.076 -1.453 . . . . 24.47 107.076 -171.979 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -150.65 173.83 30.13 Favored Glycine 0 CA--C 1.539 1.578 0 C-N-CA 118.371 -1.871 . . . . 20.51 110.112 177.315 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 9.9 tttm -140.75 135.74 31.83 Favored 'General case' 0 CA--C 1.504 -0.798 0 O-C-N 128.621 3.189 . . . . 41.67 108.66 -178.13 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 3.0 p -124.54 132.27 71.57 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 N-CA-C 107.03 -1.47 . . . . 22.01 107.03 176.82 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 95.6 m -101.86 127.43 48.67 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 108.191 -1.04 . . . . 25.49 108.191 173.361 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 74.1 t -103.67 122.13 55.96 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.587 0 C-N-CA 123.337 0.655 . . . . 25.74 110.466 178.123 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.268 2.063 0 C-N-CA 116.886 -1.926 . . . . 39.56 113.574 179.73 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 200' ' ' ' CU' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 223' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 225' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 226' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 227' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 228' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 229' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 230' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 231' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 232' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 233' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 234' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 235' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 236' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 237' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 238' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 239' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 240' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 241' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 242' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 243' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 244' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 245' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 246' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 247' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 248' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 249' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 250' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 251' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 252' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 253' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 254' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 255' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 256' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 257' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 258' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 259' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 260' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 261' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 262' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 263' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 264' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 265' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 14.6 p . . . . . 0 N--CA 1.494 1.751 0 N-CA-C 108.47 -0.937 . . . . 26.05 108.47 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -111.68 136.45 50.91 Favored 'General case' 0 C--O 1.252 1.22 0 N-CA-C 109.495 -0.558 . . . . 23.37 109.495 174.859 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 90.7 t -123.47 125.28 71.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 N-CA-C 107.677 -1.231 . . . . 18.82 107.677 -178.655 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 82.1 mt -85.46 140.11 30.97 Favored 'General case' 0 C--O 1.221 -0.427 0 O-C-N 120.197 -1.565 . . . . 19.34 110.876 176.806 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 62.8 mt -96.43 98.25 10.1 Favored 'General case' 0 N--CA 1.442 -0.833 0 C-N-CA 124.827 1.251 . . . . 21.83 109.154 175.593 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 97.3 140.53 11.4 Favored Glycine 0 N--CA 1.484 1.847 0 O-C-N 126.624 2.453 . . . . 18.55 109.538 -178.354 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -75.76 170.28 54.64 Favored Glycine 0 C--N 1.345 1.08 0 O-C-N 119.154 -2.38 . . . . 21.27 108.598 169.095 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 23.4 m-20 -63.96 -26.64 68.68 Favored 'General case' 0 C--O 1.244 0.795 0 O-C-N 119.323 -2.28 . . . . 22.96 111.844 178.838 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 44.8 p-10 -81.46 3.28 25.23 Favored 'General case' 0 N--CA 1.448 -0.559 0 C-N-CA 125.16 1.384 . . . . 26.28 112.231 178.874 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 84.63 10.68 78.96 Favored Glycine 0 C--O 1.258 1.604 0 CA-C-O 116.894 -2.059 . . . . 24.41 114.241 -177.783 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 12.9 p -66.79 144.48 56.29 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 119.745 1.772 . . . . 23.38 109.339 178.31 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 97.1 mt -96.97 75.88 2.67 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 125.821 1.951 . . . . 23.97 108.973 -166.324 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -139.18 144.47 38.58 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-N 114.935 -1.03 . . . . 19.69 109.768 -170.35 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 78.8 m-85 -80.14 135.38 36.29 Favored 'General case' 0 C--O 1.259 1.572 0 N-CA-C 108.261 -1.014 . . . . 18.86 108.261 160.458 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 20.5 mt -126.24 108.73 24.14 Favored Pre-proline 0 C--O 1.246 0.903 0 O-C-N 120.744 -1.222 . . . . 22.06 111.246 177.861 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -78.31 161.47 90.25 Favored 'Cis proline' 0 N--CA 1.43 -2.206 0 N-CA-C 115.992 1.497 . . . . 19.95 115.992 -0.568 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -103.15 -16.27 21.43 Favored Glycine 0 C--O 1.218 -0.852 0 C-N-CA 120.179 -1.01 . . . . 24.78 111.408 -172.151 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 32.6 t0 -140.87 112.0 7.22 Favored 'General case' 0 C--N 1.309 -1.172 0 N-CA-C 105.019 -2.215 . . . . 35.31 105.019 -179.405 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 28.7 p90 -150.06 168.5 23.71 Favored 'General case' 0 C--N 1.323 -0.563 0 O-C-N 121.085 -1.009 . . . . 24.79 108.893 -170.9 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 4.0 m -122.43 145.17 48.54 Favored 'General case' 0 C--N 1.314 -0.953 0 O-C-N 126.64 2.462 . . . . 33.29 109.326 -179.288 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 27.5 m -133.95 163.59 36.82 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.662 0 N-CA-C 108.025 -1.102 . . . . 26.27 108.025 174.115 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -82.89 151.3 26.03 Favored 'General case' 0 C--O 1.239 0.538 0 CA-C-O 116.9 -1.524 . . . . 26.53 107.746 170.661 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 38.6 t -52.42 131.73 33.84 Favored 'General case' 0 C--N 1.321 -0.663 0 O-C-N 125.471 1.732 . . . . 29.97 109.611 168.814 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 83.26 2.65 90.37 Favored Glycine 0 CA--C 1.498 -0.988 0 N-CA-C 117.8 1.88 . . . . 25.89 117.8 -178.944 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 59.8 tt0 -83.06 137.95 33.91 Favored 'General case' 0 C--N 1.322 -0.601 0 O-C-N 120.131 -1.805 . . . . 32.82 109.732 176.022 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -80.81 141.52 34.62 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 118.967 0.803 . . . . 30.86 110.115 -176.343 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 73.8 mt -110.96 121.33 63.44 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 N-CA-C 105.346 -2.094 . . . . 23.98 105.346 176.483 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 60.8 t -106.04 110.46 31.41 Favored 'Isoleucine or valine' 0 C--O 1.252 1.237 0 CA-C-N 114.4 -1.273 . . . . 19.47 108.467 -179.972 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 96.5 m-85 -92.87 121.05 33.85 Favored 'General case' 0 N--CA 1.473 0.712 0 O-C-N 124.582 1.176 . . . . 18.39 107.985 175.748 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -113.58 120.63 41.59 Favored 'General case' 0 C--O 1.24 0.572 0 O-C-N 121.674 -0.641 . . . . 19.12 111.934 -175.715 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 36.1 t30 -68.58 132.84 47.6 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 118.942 -1.103 . . . . 20.51 110.685 -176.61 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 61.9 t30 -119.95 -70.01 0.81 Allowed 'General case' 0 C--O 1.24 0.578 0 C-N-CA 117.15 -1.82 . . . . 21.43 110.376 -171.355 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -152.67 166.6 31.61 Favored 'General case' 0 C--O 1.248 0.977 0 CA-C-N 119.479 1.036 . . . . 20.44 109.462 -179.454 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 75.38 13.78 82.54 Favored Glycine 0 CA--C 1.53 0.984 0 CA-C-N 120.663 1.574 . . . . 22.5 113.73 179.314 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' PHE . . . . . 0.582 ' HB2' ' HA ' ' A' ' 36' ' ' PRO . 8.1 p90 -71.69 171.11 9.83 Favored Pre-proline 0 N--CA 1.485 1.303 0 N-CA-C 105.938 -1.875 . . . . 29.77 105.938 -175.114 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 36' ' ' PRO . . . . . 0.582 ' HA ' ' HB2' ' A' ' 35' ' ' PHE . 39.4 Cg_endo -65.66 149.93 76.89 Favored 'Cis proline' 0 N--CA 1.439 -1.708 0 N-CA-C 116.142 1.555 . . . . 27.82 116.142 4.575 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 89.2 m-70 -136.88 158.13 45.15 Favored 'General case' 0 CA--C 1.537 0.444 0 O-C-N 120.028 -1.67 . . . . 20.76 108.787 173.341 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 52.5 p-10 -147.2 -170.8 3.64 Favored 'General case' 0 C--O 1.246 0.897 0 CA-C-O 123.929 1.823 . . . . 26.25 107.319 162.187 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 88.9 t -137.49 114.52 12.42 Favored 'Isoleucine or valine' 0 C--O 1.248 1.014 0 N-CA-C 106.738 -1.579 . . . . 19.54 106.738 -175.11 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 49.3 t -126.18 138.3 55.05 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.753 0 O-C-N 125.943 2.027 . . . . 22.37 107.619 177.745 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 62.7 m-85 -92.59 141.05 28.91 Favored 'General case' 0 N--CA 1.475 0.817 0 O-C-N 119.952 -1.717 . . . . 22.75 110.715 176.277 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 36.6 t0 -82.83 118.56 23.5 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-O 117.975 -1.012 . . . . 34.35 109.627 -177.792 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' GLU . . . . . 0.576 ' HG2' ' O ' ' A' ' 239' ' ' HOH . 25.3 pt-20 -73.97 -15.48 61.11 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 117.498 -1.681 . . . . 44.22 111.291 -168.232 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 72.1 m-20 -80.11 -14.32 58.59 Favored 'General case' 0 C--O 1.241 0.649 0 N-CA-C 115.607 1.706 . . . . 42.54 115.607 171.198 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' GLU . . . . . 0.47 ' HB2' ' HB3' ' A' ' 81' ' ' LYS . 3.0 mm-40 -126.26 41.25 3.56 Favored 'General case' 0 C--O 1.243 0.746 0 CA-C-O 118.904 -0.57 . . . . 45.44 111.415 -172.268 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 27.7 pt -131.96 169.8 12.94 Favored Pre-proline 0 N--CA 1.47 0.556 0 N-CA-C 106.621 -1.622 . . . . 28.22 106.621 172.356 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -63.37 154.46 68.1 Favored 'Trans proline' 0 C--N 1.312 -1.395 0 CA-C-O 125.383 2.159 . . . . 27.65 113.505 -177.115 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 73.0 m -61.21 139.71 58.08 Favored 'General case' 0 C--N 1.355 0.825 0 CA-C-N 114.118 -1.401 . . . . 39.02 108.685 -179.716 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 86.63 2.69 84.49 Favored Glycine 0 C--O 1.245 0.796 0 CA-C-O 118.188 -1.34 . . . . 34.68 111.923 175.793 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 96.5 t -100.5 132.04 46.89 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.946 0 C-N-CA 117.583 -1.647 . . . . 26.55 107.855 175.631 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 66.2 t0 -91.06 115.77 28.28 Favored 'General case' 0 N--CA 1.493 1.72 0 C-N-CA 119.653 -0.819 . . . . 24.45 109.583 175.018 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.82 -22.36 66.97 Favored 'General case' 0 N--CA 1.496 1.858 0 C-N-CA 118.478 -1.289 . . . . 20.75 110.964 -176.064 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -68.33 -25.72 65.26 Favored 'General case' 0 N--CA 1.443 -0.795 0 O-C-N 118.808 -2.432 . . . . 24.2 112.466 -178.498 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 35.8 mtpt -78.59 -25.89 45.33 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 120.146 1.339 . . . . 36.48 111.15 -179.262 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 22.6 pt -106.83 -9.94 10.56 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.138 0 CA-C-O 116.958 -1.496 . . . . 22.72 109.683 -172.281 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 50.2 m -92.93 152.96 19.06 Favored 'General case' 0 C--O 1.247 0.971 0 CA-C-N 120.435 1.471 . . . . 20.02 108.859 -176.463 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 96.2 mtp -65.59 152.51 43.94 Favored 'General case' 0 C--O 1.244 0.805 0 CA-C-O 122.219 1.009 . . . . 21.58 112.498 167.545 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 25.9 t -58.88 145.04 42.58 Favored 'General case' 0 C--O 1.243 0.738 0 C-N-CA 124.128 0.971 . . . . 24.55 108.858 171.304 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 6.6 tm-20 -64.33 -30.79 71.82 Favored 'General case' 0 N--CA 1.472 0.625 0 N-CA-C 113.104 0.779 . . . . 40.88 113.104 -171.262 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -93.8 -2.09 54.07 Favored 'General case' 0 C--O 1.235 0.338 0 O-C-N 120.463 -1.398 . . . . 37.27 111.092 -178.155 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 38.7 t0 -91.92 110.72 22.08 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 106.656 -1.609 . . . . 35.32 106.656 -175.844 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 88.5 mt -117.03 147.36 42.4 Favored 'General case' 0 C--O 1.243 0.726 0 N-CA-C 106.364 -1.717 . . . . 29.18 106.364 178.49 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 47.0 mt -87.82 119.37 28.09 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 108.257 -1.016 . . . . 25.32 108.257 173.346 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 34.9 m-80 -124.19 12.49 8.9 Favored 'General case' 0 C--O 1.253 1.24 0 N-CA-C 112.544 0.572 . . . . 34.55 112.544 -170.428 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -139.64 145.83 45.1 Favored Pre-proline 0 C--O 1.246 0.872 0 O-C-N 121.62 -0.675 . . . . 24.75 110.096 173.732 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 15.4 Cg_exo -51.25 129.63 29.47 Favored 'Trans proline' 0 N--CA 1.444 -1.438 0 C-N-CA 123.221 2.614 . . . . 25.44 114.372 176.726 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 95.42 -14.03 65.69 Favored Glycine 0 CA--C 1.534 1.28 0 CA-C-O 113.749 -3.806 . . . . 20.99 110.97 168.672 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -58.3 145.2 38.67 Favored 'General case' 0 N--CA 1.472 0.654 0 O-C-N 127.41 2.477 . . . . 30.57 111.155 174.04 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 73.0 p -126.08 158.93 34.16 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 120.686 1.585 . . . . 21.41 110.964 -175.292 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 39.1 t80 -128.89 127.44 41.82 Favored 'General case' 0 C--O 1.255 1.35 0 N-CA-C 105.581 -2.007 . . . . 24.57 105.581 167.774 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 88.0 mttt -116.98 135.03 54.01 Favored 'General case' 0 C--N 1.314 -0.975 0 N-CA-C 107.917 -1.142 . . . . 23.25 107.917 -175.419 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 14.3 p -145.44 150.11 16.04 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.215 0 O-C-N 124.95 1.407 . . . . 21.56 108.437 178.94 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 42.9 m -125.24 131.18 53.18 Favored 'General case' 0 C--O 1.235 0.318 0 N-CA-C 109.069 -0.715 . . . . 24.5 109.069 178.688 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 91.4 mt -110.38 137.26 48.34 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-O 116.952 -1.499 . . . . 23.21 107.03 -174.435 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 44.0 p -118.57 -34.66 3.94 Favored 'General case' 0 C--O 1.245 0.838 0 O-C-N 125.988 2.055 . . . . 27.03 113.237 -179.529 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 39.5 tp10 -71.99 127.64 33.19 Favored 'General case' 0 C--N 1.317 -0.843 0 O-C-N 120.294 -1.504 . . . . 39.73 107.439 -176.719 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' LYS . . . . . 0.628 ' HE3' ' HA ' ' A' ' 99' ' ' ASN . 17.6 mtpt -68.0 149.93 49.09 Favored 'General case' 0 CA--C 1.512 -0.506 0 N-CA-C 112.895 0.702 . . . . 41.9 112.895 -177.567 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 137.13 -171.2 23.21 Favored Glycine 0 CA--C 1.532 1.127 0 C-N-CA 118.072 -2.014 . . . . 25.92 110.179 178.29 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 23.2 p -107.85 140.06 41.51 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-O 123.771 1.748 . . . . 33.43 110.73 179.39 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 5.0 m-85 -126.99 124.84 40.36 Favored 'General case' 0 N--CA 1.442 -0.846 0 CA-C-N 113.762 -1.563 . . . . 22.49 109.692 -176.497 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' LYS . . . . . 0.47 ' HB3' ' HB2' ' A' ' 45' ' ' GLU . 27.2 tttp -93.48 133.14 37.07 Favored 'General case' 0 C--N 1.31 -1.114 0 CA-C-N 115.393 -0.821 . . . . 38.78 110.84 171.516 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 46.7 p90 -135.71 168.58 19.01 Favored 'General case' 0 N--CA 1.448 -0.569 0 C-N-CA 119.708 -0.797 . . . . 21.58 109.643 174.122 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 38.9 p90 -153.5 166.87 31.34 Favored 'General case' 0 C--N 1.321 -0.64 0 C-N-CA 118.399 -1.32 . . . . 29.87 109.95 -179.671 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 35.6 t -96.52 117.03 30.07 Favored 'General case' 0 C--N 1.345 0.408 0 CA-C-N 112.945 -1.934 . . . . 22.77 109.177 170.797 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' SER . . . . . 0.448 ' HB3' ' HD3' ' A' ' 86' ' ' PRO . 2.9 t -53.68 -51.69 74.08 Favored Pre-proline 0 C--N 1.317 -0.817 0 N-CA-C 117.46 2.393 . . . . 36.12 117.46 -171.191 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 86' ' ' PRO . . . . . 0.448 ' HD3' ' HB3' ' A' ' 85' ' ' SER . 9.9 Cg_endo -61.61 -26.73 80.74 Favored 'Trans proline' 0 CA--C 1.501 -1.149 0 C-N-CA 122.671 2.247 . . . . 28.53 115.563 175.207 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 35.9 m170 -115.67 15.66 16.49 Favored 'General case' 0 N--CA 1.445 -0.695 0 O-C-N 117.972 -2.955 . . . . 25.21 113.078 -172.068 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 47.3 tt0 -65.93 -41.06 91.85 Favored 'General case' 0 C--N 1.34 0.167 0 C-N-CA 119.074 -1.05 . . . . 40.09 111.767 -174.754 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.0 -25.91 66.68 Favored Glycine 0 C--O 1.247 0.945 0 CA-C-N 119.006 0.821 . . . . 36.73 114.688 171.858 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -86.04 2.99 44.32 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 119.808 1.804 . . . . 33.72 114.296 175.728 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 100.7 12.91 36.29 Favored Glycine 0 CA--C 1.528 0.89 0 CA-C-N 120.163 1.347 . . . . 30.66 111.447 173.476 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 23.6 ttt -88.55 83.53 6.79 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 116.395 -2.122 . . . . 21.51 109.161 -176.814 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 23.5 m -137.7 153.76 28.43 Favored 'Isoleucine or valine' 0 C--O 1.254 1.295 0 N-CA-C 107.076 -1.453 . . . . 24.47 107.076 -171.979 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -150.65 173.83 30.13 Favored Glycine 0 CA--C 1.539 1.578 0 C-N-CA 118.371 -1.871 . . . . 20.51 110.112 177.315 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 9.9 tttm -140.75 135.74 31.83 Favored 'General case' 0 CA--C 1.504 -0.798 0 O-C-N 128.621 3.189 . . . . 41.67 108.66 -178.13 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 3.0 p -124.54 132.27 71.57 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 N-CA-C 107.03 -1.47 . . . . 22.01 107.03 176.82 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 95.6 m -101.86 127.43 48.67 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 108.191 -1.04 . . . . 25.49 108.191 173.361 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 74.1 t -103.67 122.13 55.96 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.587 0 C-N-CA 123.337 0.655 . . . . 25.74 110.466 178.123 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' ASN . . . . . 0.628 ' HA ' ' HE3' ' A' ' 77' ' ' LYS . 26.6 p30 . . . . . 0 C--O 1.268 2.063 0 C-N-CA 116.886 -1.926 . . . . 39.56 113.574 179.73 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 200' ' ' ' CU' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 223' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 225' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 226' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 227' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 228' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 229' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 230' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 231' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 232' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 233' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 234' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 235' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 236' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 237' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 238' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 239' ' ' HOH . . . . . 0.576 ' O ' ' HG2' ' A' ' 43' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 240' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 241' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 242' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 243' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 244' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 245' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 246' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 247' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 248' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 249' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 250' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 251' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 252' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 253' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 254' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 255' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 256' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 257' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 258' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 259' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 260' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 261' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 262' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 263' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 264' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 265' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 14.6 p . . . . . 0 N--CA 1.494 1.751 0 N-CA-C 108.47 -0.937 . . . . 26.050000000000001 108.47 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -111.68 136.45 50.91 Favored 'General case' 0 C--O 1.252 1.22 0 N-CA-C 109.495 -0.558 . . . . 23.370000000000001 109.495 174.859 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 90.7 t -123.47 125.28 71.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 N-CA-C 107.677 -1.231 . . . . 18.82 107.677 -178.655 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 82.1 mt -85.46 140.11 30.97 Favored 'General case' 0 C--O 1.221 -0.427 0 O-C-N 120.197 -1.565 . . . . 19.34 110.876 176.806 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 62.8 mt -96.43 98.25 10.1 Favored 'General case' 0 N--CA 1.442 -0.833 0 C-N-CA 124.827 1.251 . . . . 21.829999999999998 109.154 175.593 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 97.3 140.53 11.4 Favored Glycine 0 N--CA 1.484 1.847 0 O-C-N 126.624 2.453 . . . . 18.550000000000001 109.538 -178.354 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -75.76 170.28 54.64 Favored Glycine 0 C--N 1.345 1.08 0 O-C-N 119.154 -2.38 . . . . 21.27 108.598 169.095 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 23.4 m-20 -63.96 -26.64 68.68 Favored 'General case' 0 C--O 1.244 0.795 0 O-C-N 119.323 -2.28 . . . . 22.960000000000001 111.844 178.838 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 44.8 p-10 -81.46 3.28 25.23 Favored 'General case' 0 N--CA 1.448 -0.559 0 C-N-CA 125.16 1.384 . . . . 26.280000000000001 112.231 178.874 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 84.63 10.68 78.96 Favored Glycine 0 C--O 1.258 1.604 0 CA-C-O 116.894 -2.059 . . . . 24.41 114.241 -177.783 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 12.9 p -66.79 144.48 56.29 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 119.745 1.772 . . . . 23.379999999999999 109.339 178.31 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 97.1 mt -96.97 75.88 2.67 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 125.821 1.951 . . . . 23.969999999999999 108.973 -166.324 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -139.18 144.47 38.58 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-N 114.935 -1.03 . . . . 19.690000000000001 109.768 -170.35 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 78.8 m-85 -80.14 135.38 36.29 Favored 'General case' 0 C--O 1.259 1.572 0 N-CA-C 108.261 -1.014 . . . . 18.859999999999999 108.261 160.458 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 20.5 mt -126.24 108.73 24.14 Favored Pre-proline 0 C--O 1.246 0.903 0 O-C-N 120.744 -1.222 . . . . 22.059999999999999 111.246 177.861 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -78.31 161.47 90.25 Favored 'Cis proline' 0 N--CA 1.43 -2.206 0 N-CA-C 115.992 1.497 . . . . 19.949999999999999 115.992 -0.568 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -103.15 -16.27 21.43 Favored Glycine 0 C--O 1.218 -0.852 0 C-N-CA 120.179 -1.01 . . . . 24.780000000000001 111.408 -172.151 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 32.6 t0 -140.87 112.0 7.22 Favored 'General case' 0 C--N 1.309 -1.172 0 N-CA-C 105.019 -2.215 . . . . 35.310000000000002 105.019 -179.405 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 28.7 p90 -150.06 168.5 23.71 Favored 'General case' 0 C--N 1.323 -0.563 0 O-C-N 121.085 -1.009 . . . . 24.789999999999999 108.893 -170.9 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 4.0 m -122.43 145.17 48.54 Favored 'General case' 0 C--N 1.314 -0.953 0 O-C-N 126.64 2.462 . . . . 33.289999999999999 109.326 -179.288 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 27.5 m -133.95 163.59 36.82 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.662 0 N-CA-C 108.025 -1.102 . . . . 26.27 108.025 174.115 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -82.89 151.3 26.03 Favored 'General case' 0 C--O 1.239 0.538 0 CA-C-O 116.9 -1.524 . . . . 26.530000000000001 107.746 170.661 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 38.6 t -52.42 131.73 33.84 Favored 'General case' 0 C--N 1.321 -0.663 0 O-C-N 125.471 1.732 . . . . 29.969999999999999 109.611 168.814 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 83.26 2.65 90.37 Favored Glycine 0 CA--C 1.498 -0.988 0 N-CA-C 117.8 1.88 . . . . 25.890000000000001 117.8 -178.944 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 59.8 tt0 -83.06 137.95 33.91 Favored 'General case' 0 C--N 1.322 -0.601 0 O-C-N 120.131 -1.805 . . . . 32.82 109.732 176.022 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -80.81 141.52 34.62 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 118.967 0.803 . . . . 30.859999999999999 110.115 -176.343 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 73.8 mt -110.96 121.33 63.44 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 N-CA-C 105.346 -2.094 . . . . 23.98 105.346 176.483 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 60.8 t -106.04 110.46 31.41 Favored 'Isoleucine or valine' 0 C--O 1.252 1.237 0 CA-C-N 114.4 -1.273 . . . . 19.469999999999999 108.467 -179.972 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 96.5 m-85 -92.87 121.05 33.85 Favored 'General case' 0 N--CA 1.473 0.712 0 O-C-N 124.582 1.176 . . . . 18.390000000000001 107.985 175.748 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -113.58 120.63 41.59 Favored 'General case' 0 C--O 1.24 0.572 0 O-C-N 121.674 -0.641 . . . . 19.120000000000001 111.934 -175.715 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 36.1 t30 -68.58 132.84 47.6 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 118.942 -1.103 . . . . 20.510000000000002 110.685 -176.61 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 61.9 t30 -119.95 -70.01 0.81 Allowed 'General case' 0 C--O 1.24 0.578 0 C-N-CA 117.15 -1.82 . . . . 21.43 110.376 -171.355 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -152.67 166.6 31.61 Favored 'General case' 0 C--O 1.248 0.977 0 CA-C-N 119.479 1.036 . . . . 20.440000000000001 109.462 -179.454 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 75.38 13.78 82.54 Favored Glycine 0 CA--C 1.53 0.984 0 CA-C-N 120.663 1.574 . . . . 22.5 113.73 179.314 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.582 ' HB2' ' HA ' ' A' ' 36' ' ' PRO . 8.1 p90 -71.69 171.11 9.83 Favored Pre-proline 0 N--CA 1.485 1.303 0 N-CA-C 105.938 -1.875 . . . . 29.77 105.938 -175.114 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.582 ' HA ' ' HB2' ' A' ' 35' ' ' PHE . 39.4 Cg_endo -65.66 149.93 76.89 Favored 'Cis proline' 0 N--CA 1.439 -1.708 0 N-CA-C 116.142 1.555 . . . . 27.82 116.142 4.575 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 89.2 m-70 -136.88 158.13 45.15 Favored 'General case' 0 CA--C 1.537 0.444 0 O-C-N 120.028 -1.67 . . . . 20.760000000000002 108.787 173.341 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 52.5 p-10 -147.2 -170.8 3.64 Favored 'General case' 0 C--O 1.246 0.897 0 CA-C-O 123.929 1.823 . . . . 26.25 107.319 162.187 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 88.9 t -137.49 114.52 12.42 Favored 'Isoleucine or valine' 0 C--O 1.248 1.014 0 N-CA-C 106.738 -1.579 . . . . 19.539999999999999 106.738 -175.11 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 49.3 t -126.18 138.3 55.05 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.753 0 O-C-N 125.943 2.027 . . . . 22.370000000000001 107.619 177.745 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 62.7 m-85 -92.59 141.05 28.91 Favored 'General case' 0 N--CA 1.475 0.817 0 O-C-N 119.952 -1.717 . . . . 22.75 110.715 176.277 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 36.6 t0 -82.83 118.56 23.5 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-O 117.975 -1.012 . . . . 34.350000000000001 109.627 -177.792 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.576 ' HG2' ' O ' ' A' ' 239' ' ' HOH . 25.3 pt-20 -73.97 -15.48 61.11 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 117.498 -1.681 . . . . 44.219999999999999 111.291 -168.232 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 72.1 m-20 -80.11 -14.32 58.59 Favored 'General case' 0 C--O 1.241 0.649 0 N-CA-C 115.607 1.706 . . . . 42.539999999999999 115.607 171.198 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.47 ' HB2' ' HB3' ' A' ' 81' ' ' LYS . 3.0 mm-40 -126.26 41.25 3.56 Favored 'General case' 0 C--O 1.243 0.746 0 CA-C-O 118.904 -0.57 . . . . 45.439999999999998 111.415 -172.268 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 27.7 pt -131.96 169.8 12.94 Favored Pre-proline 0 N--CA 1.47 0.556 0 N-CA-C 106.621 -1.622 . . . . 28.219999999999999 106.621 172.356 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -63.37 154.46 68.1 Favored 'Trans proline' 0 C--N 1.312 -1.395 0 CA-C-O 125.383 2.159 . . . . 27.649999999999999 113.505 -177.115 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 73.0 m -61.21 139.71 58.08 Favored 'General case' 0 C--N 1.355 0.825 0 CA-C-N 114.118 -1.401 . . . . 39.020000000000003 108.685 -179.716 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 86.63 2.69 84.49 Favored Glycine 0 C--O 1.245 0.796 0 CA-C-O 118.188 -1.34 . . . . 34.68 111.923 175.793 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 96.5 t -100.5 132.04 46.89 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.946 0 C-N-CA 117.583 -1.647 . . . . 26.550000000000001 107.855 175.631 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 66.2 t0 -91.06 115.77 28.28 Favored 'General case' 0 N--CA 1.493 1.72 0 C-N-CA 119.653 -0.819 . . . . 24.449999999999999 109.583 175.018 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.82 -22.36 66.97 Favored 'General case' 0 N--CA 1.496 1.858 0 C-N-CA 118.478 -1.289 . . . . 20.75 110.964 -176.064 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -68.33 -25.72 65.26 Favored 'General case' 0 N--CA 1.443 -0.795 0 O-C-N 118.808 -2.432 . . . . 24.199999999999999 112.466 -178.498 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 35.8 mtpt -78.59 -25.89 45.33 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 120.146 1.339 . . . . 36.479999999999997 111.15 -179.262 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 22.6 pt -106.83 -9.94 10.56 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.138 0 CA-C-O 116.958 -1.496 . . . . 22.719999999999999 109.683 -172.281 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 50.2 m -92.93 152.96 19.06 Favored 'General case' 0 C--O 1.247 0.971 0 CA-C-N 120.435 1.471 . . . . 20.02 108.859 -176.463 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 96.2 mtp -65.59 152.51 43.94 Favored 'General case' 0 C--O 1.244 0.805 0 CA-C-O 122.219 1.009 . . . . 21.579999999999998 112.498 167.545 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 25.9 t -58.88 145.04 42.58 Favored 'General case' 0 C--O 1.243 0.738 0 C-N-CA 124.128 0.971 . . . . 24.550000000000001 108.858 171.304 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 6.6 tm-20 -64.33 -30.79 71.82 Favored 'General case' 0 N--CA 1.472 0.625 0 N-CA-C 113.104 0.779 . . . . 40.880000000000003 113.104 -171.262 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -93.8 -2.09 54.07 Favored 'General case' 0 C--O 1.235 0.338 0 O-C-N 120.463 -1.398 . . . . 37.270000000000003 111.092 -178.155 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 38.7 t0 -91.92 110.72 22.08 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 106.656 -1.609 . . . . 35.32 106.656 -175.844 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 88.5 mt -117.03 147.36 42.4 Favored 'General case' 0 C--O 1.243 0.726 0 N-CA-C 106.364 -1.717 . . . . 29.18 106.364 178.49 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 47.0 mt -87.82 119.37 28.09 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 108.257 -1.016 . . . . 25.32 108.257 173.346 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 34.9 m-80 -124.19 12.49 8.9 Favored 'General case' 0 C--O 1.253 1.24 0 N-CA-C 112.544 0.572 . . . . 34.549999999999997 112.544 -170.428 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -139.64 145.83 45.1 Favored Pre-proline 0 C--O 1.246 0.872 0 O-C-N 121.62 -0.675 . . . . 24.75 110.096 173.732 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 15.4 Cg_exo -51.25 129.63 29.47 Favored 'Trans proline' 0 N--CA 1.444 -1.438 0 C-N-CA 123.221 2.614 . . . . 25.440000000000001 114.372 176.726 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 95.42 -14.03 65.69 Favored Glycine 0 CA--C 1.534 1.28 0 CA-C-O 113.749 -3.806 . . . . 20.989999999999998 110.97 168.672 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -58.3 145.2 38.67 Favored 'General case' 0 N--CA 1.472 0.654 0 O-C-N 127.41 2.477 . . . . 30.57 111.155 174.04 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 73.0 p -126.08 158.93 34.16 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 120.686 1.585 . . . . 21.41 110.964 -175.292 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 39.1 t80 -128.89 127.44 41.82 Favored 'General case' 0 C--O 1.255 1.35 0 N-CA-C 105.581 -2.007 . . . . 24.57 105.581 167.774 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 88.0 mttt -116.98 135.03 54.01 Favored 'General case' 0 C--N 1.314 -0.975 0 N-CA-C 107.917 -1.142 . . . . 23.25 107.917 -175.419 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 14.3 p -145.44 150.11 16.04 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.215 0 O-C-N 124.95 1.407 . . . . 21.559999999999999 108.437 178.94 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 42.9 m -125.24 131.18 53.18 Favored 'General case' 0 C--O 1.235 0.318 0 N-CA-C 109.069 -0.715 . . . . 24.5 109.069 178.688 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 91.4 mt -110.38 137.26 48.34 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-O 116.952 -1.499 . . . . 23.210000000000001 107.03 -174.435 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 44.0 p -118.57 -34.66 3.94 Favored 'General case' 0 C--O 1.245 0.838 0 O-C-N 125.988 2.055 . . . . 27.030000000000001 113.237 -179.529 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 39.5 tp10 -71.99 127.64 33.19 Favored 'General case' 0 C--N 1.317 -0.843 0 O-C-N 120.294 -1.504 . . . . 39.729999999999997 107.439 -176.719 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.628 ' HE3' ' HA ' ' A' ' 99' ' ' ASN . 17.6 mtpt -68.0 149.93 49.09 Favored 'General case' 0 CA--C 1.512 -0.506 0 N-CA-C 112.895 0.702 . . . . 41.899999999999999 112.895 -177.567 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 137.13 -171.2 23.21 Favored Glycine 0 CA--C 1.532 1.127 0 C-N-CA 118.072 -2.014 . . . . 25.920000000000002 110.179 178.29 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 23.2 p -107.85 140.06 41.51 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-O 123.771 1.748 . . . . 33.43 110.73 179.39 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 5.0 m-85 -126.99 124.84 40.36 Favored 'General case' 0 N--CA 1.442 -0.846 0 CA-C-N 113.762 -1.563 . . . . 22.489999999999998 109.692 -176.497 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.47 ' HB3' ' HB2' ' A' ' 45' ' ' GLU . 27.2 tttp -93.48 133.14 37.07 Favored 'General case' 0 C--N 1.31 -1.114 0 CA-C-N 115.393 -0.821 . . . . 38.780000000000001 110.84 171.516 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 46.7 p90 -135.71 168.58 19.01 Favored 'General case' 0 N--CA 1.448 -0.569 0 C-N-CA 119.708 -0.797 . . . . 21.579999999999998 109.643 174.122 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 38.9 p90 -153.5 166.87 31.34 Favored 'General case' 0 C--N 1.321 -0.64 0 C-N-CA 118.399 -1.32 . . . . 29.870000000000001 109.95 -179.671 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 35.6 t -96.52 117.03 30.07 Favored 'General case' 0 C--N 1.345 0.408 0 CA-C-N 112.945 -1.934 . . . . 22.77 109.177 170.797 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' SER . . . . . 0.448 ' HB3' ' HD3' ' A' ' 86' ' ' PRO . 2.9 t -53.68 -51.69 74.08 Favored Pre-proline 0 C--N 1.317 -0.817 0 N-CA-C 117.46 2.393 . . . . 36.119999999999997 117.46 -171.191 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' PRO . . . . . 0.448 ' HD3' ' HB3' ' A' ' 85' ' ' SER . 9.9 Cg_endo -61.61 -26.73 80.74 Favored 'Trans proline' 0 CA--C 1.501 -1.149 0 C-N-CA 122.671 2.247 . . . . 28.530000000000001 115.563 175.207 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 35.9 m170 -115.67 15.66 16.49 Favored 'General case' 0 N--CA 1.445 -0.695 0 O-C-N 117.972 -2.955 . . . . 25.210000000000001 113.078 -172.068 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -65.93 -41.06 91.85 Favored 'General case' 0 C--N 1.34 0.167 0 C-N-CA 119.074 -1.05 . . . . 40.090000000000003 111.767 -174.754 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.0 -25.91 66.68 Favored Glycine 0 C--O 1.247 0.945 0 CA-C-N 119.006 0.821 . . . . 36.729999999999997 114.688 171.858 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -86.04 2.99 44.32 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 119.808 1.804 . . . . 33.719999999999999 114.296 175.728 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 100.7 12.91 36.29 Favored Glycine 0 CA--C 1.528 0.89 0 CA-C-N 120.163 1.347 . . . . 30.66 111.447 173.476 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 23.6 ttt -88.55 83.53 6.79 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 116.395 -2.122 . . . . 21.510000000000002 109.161 -176.814 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 23.5 m -137.7 153.76 28.43 Favored 'Isoleucine or valine' 0 C--O 1.254 1.295 0 N-CA-C 107.076 -1.453 . . . . 24.469999999999999 107.076 -171.979 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -150.65 173.83 30.13 Favored Glycine 0 CA--C 1.539 1.578 0 C-N-CA 118.371 -1.871 . . . . 20.510000000000002 110.112 177.315 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 9.9 tttm -140.75 135.74 31.83 Favored 'General case' 0 CA--C 1.504 -0.798 0 O-C-N 128.621 3.189 . . . . 41.670000000000002 108.66 -178.13 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 3.0 p -124.54 132.27 71.57 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 N-CA-C 107.03 -1.47 . . . . 22.010000000000002 107.03 176.82 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 95.6 m -101.86 127.43 48.67 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 108.191 -1.04 . . . . 25.489999999999998 108.191 173.361 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 74.1 t -103.67 122.13 55.96 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.587 0 C-N-CA 123.337 0.655 . . . . 25.739999999999998 110.466 178.123 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' ASN . . . . . 0.628 ' HA ' ' HE3' ' A' ' 77' ' ' LYS . 0.4 OUTLIER . . . . . 0 C--O 1.268 2.063 0 C-N-CA 116.886 -1.926 . . . . 39.560000000000002 113.574 179.73 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 200' ' ' ' CU' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 223' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 225' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 226' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 227' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 228' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 229' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 230' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 231' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 232' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 233' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 234' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 235' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 236' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 237' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 238' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 239' ' ' HOH . . . . . 0.576 ' O ' ' HG2' ' A' ' 43' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 240' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 241' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 242' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 243' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 244' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 245' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 246' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 247' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 248' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 249' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 250' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 251' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 252' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 253' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 254' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 255' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 256' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 257' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 258' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 259' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 260' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 261' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 262' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 263' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 264' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 265' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_