data_1ux8_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 1ux8 _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 ' 6' ' ' ASN . . . . . 0.481 ' N ' ' O ' ' A' 2003 ' ' HOH . 0.9 OUTLIER . . . . . 0 N--CA 1.506 2.371 0 N-CA-C 109.176 -0.676 . . . . 38.609999999999999 109.176 . . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -61.85 140.02 95.57 Favored Pre-proline 0 C--O 1.247 0.95 0 O-C-N 123.799 0.687 . . . . 30.77 109.851 -174.947 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_exo -58.33 -25.59 73.48 Favored 'Trans proline' 0 C--O 1.203 -1.242 0 C-N-CA 121.488 1.459 . . . . 27.350000000000001 113.767 178.425 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 48.7 t80 -57.59 -36.63 71.98 Favored 'General case' 0 N--CA 1.443 -0.785 0 O-C-N 121.867 -0.521 . . . . 28.5 110.877 174.085 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -63.15 -24.48 67.91 Favored 'General case' 0 C--O 1.218 -0.554 0 C-N-CA 120.301 -0.56 . . . . 36.829999999999998 111.85 -179.083 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -74.8 -6.14 47.34 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 115.495 1.665 . . . . 24.449999999999999 115.495 175.31 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -120.87 -49.61 3.16 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.39 0 O-C-N 121.104 -0.997 . . . . 23.59 110.608 177.012 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 80.26 164.18 29.81 Favored Glycine 0 N--CA 1.448 -0.561 0 N-CA-C 117.274 1.67 . . . . 22.449999999999999 117.274 178.851 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -59.12 -45.53 90.68 Favored 'General case' 0 C--O 1.207 -1.173 0 CA-C-N 113.999 -1.1 . . . . 35.719999999999999 112.739 -169.752 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' GLU . . . . . 0.569 ' OE2' ' O ' ' A' 2011 ' ' HOH . 9.6 mp0 -68.4 -53.37 24.26 Favored 'General case' 0 C--N 1.322 -0.612 0 C-N-CA 123.133 0.573 . . . . 22.719999999999999 111.933 -174.715 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 56.9 tp -65.51 -34.65 78.77 Favored 'General case' 0 C--O 1.214 -0.788 0 O-C-N 123.87 0.731 . . . . 21.68 112.165 178.107 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 35.5 tp -65.69 -48.16 73.0 Favored 'General case' 0 C--N 1.318 -0.794 0 C-N-CA 119.412 -0.915 . . . . 20.489999999999998 109.976 176.361 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 27.7 t -54.0 -38.06 64.69 Favored 'General case' 0 C--O 1.204 -1.307 0 CA-C-O 119.253 -0.403 . . . . 21.789999999999999 112.069 175.23 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 60.1 tt0 -73.84 -39.88 63.69 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 123.17 0.588 . . . . 31.699999999999999 110.586 -178.397 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 66.0 tp -55.74 -44.47 77.6 Favored 'General case' 0 N--CA 1.483 1.203 0 CA-C-O 121.386 0.613 . . . . 18.699999999999999 111.806 174.443 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 11.3 t -79.76 -30.12 13.25 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.38 0 CA-C-N 115.597 -0.729 . . . . 19.780000000000001 111.592 -172.303 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 69.1 m-20 -75.94 -43.96 42.42 Favored 'General case' 0 CA--C 1.49 -1.342 0 N-CA-C 106.533 -1.654 . . . . 22.300000000000001 106.533 -179.27 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 90.1 m -54.5 -46.12 73.41 Favored 'General case' 0 N--CA 1.442 -0.858 0 C-N-CA 120.11 -0.636 . . . . 19.57 109.307 175.485 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 41.5 t80 -55.72 -47.87 76.14 Favored 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 109.595 -0.52 . . . . 17.460000000000001 109.595 -176.285 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 58.8 m-85 -75.32 -17.76 60.18 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 115.262 1.578 . . . . 21.690000000000001 115.262 -178.045 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 -66.55 -39.63 88.63 Favored 'General case' 0 C--O 1.199 -1.604 0 N-CA-C 109.484 -0.562 . . . . 33.329999999999998 109.484 166.21 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 69.7 mmt-85 -72.22 -45.26 60.98 Favored 'General case' 0 C--O 1.246 0.875 0 N-CA-C 113.816 1.043 . . . . 38.399999999999999 113.816 178.089 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 24.3 t -52.38 -42.45 38.19 Favored 'Isoleucine or valine' 0 CA--C 1.565 1.53 0 N-CA-C 109.745 -0.465 . . . . 22.25 109.745 171.114 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.58 -25.91 64.21 Favored 'General case' 0 CA--C 1.541 0.611 0 O-C-N 121.806 -0.559 . . . . 26.32 111.114 -174.16 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 12.0 m -89.01 -11.3 44.63 Favored 'General case' 0 C--O 1.237 0.424 0 N-CA-C 113.511 0.93 . . . . 25.07 113.511 172.202 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 49.0 t-80 -86.39 109.63 25.07 Favored Pre-proline 0 C--O 1.246 0.902 0 C-N-CA 118.702 -1.199 . . . . 27.82 112.152 -174.69 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -54.49 -28.55 55.2 Favored 'Trans proline' 0 CA--C 1.545 1.054 0 C-N-CA 122.699 2.266 . . . . 24.940000000000001 116.075 -173.356 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 15.4 tp -77.99 -30.15 49.99 Favored 'General case' 0 CA--C 1.561 1.367 0 N-CA-C 113.131 0.789 . . . . 22.539999999999999 113.131 176.282 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 62.3 mt -96.85 -41.89 8.22 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 115.856 1.799 . . . . 22.879999999999999 115.856 -176.837 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 10.5 tttp -44.36 -46.21 23.61 Favored Pre-proline 0 CA--C 1.569 1.681 0 N-CA-C 112.857 0.688 . . . . 33.799999999999997 112.857 -176.737 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -55.72 -37.98 94.86 Favored 'Trans proline' 0 N--CA 1.485 1.019 0 C-N-CA 122.554 2.17 . . . . 27.210000000000001 117.446 178.101 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 35.3 pt -90.25 -12.29 9.66 Favored 'Isoleucine or valine' 0 C--O 1.274 2.382 0 N-CA-C 114.781 1.4 . . . . 23.59 114.781 -177.006 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 30.8 m-85 -86.33 162.64 45.21 Favored Pre-proline 0 C--O 1.21 -0.974 0 CA-C-N 115.716 -0.675 . . . . 26.23 110.578 171.011 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_exo -52.46 149.49 23.41 Favored 'Trans proline' 0 CA--C 1.543 0.933 0 C-N-CA 121.15 1.233 . . . . 24.190000000000001 113.853 162.28 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 31.3 m -65.24 -45.37 84.92 Favored 'General case' 0 C--O 1.243 0.742 0 CA-C-N 115.249 -0.887 . . . . 26.940000000000001 111.048 175.211 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 4.8 t0 -91.37 116.56 28.94 Favored 'General case' 0 C--O 1.235 0.315 0 C-N-CA 124.33 1.052 . . . . 31.390000000000001 109.284 166.773 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 12.5 mt -95.2 8.51 42.83 Favored 'General case' 0 CA--C 1.545 0.769 0 N-CA-C 113.779 1.029 . . . . 24.199999999999999 113.779 178.232 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 98.6 m -51.98 -46.57 64.89 Favored 'General case' 0 CA--C 1.549 0.911 0 N-CA-C 112.246 0.461 . . . . 25.77 112.246 -178.634 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 60.2 mm-40 -76.51 -42.08 44.63 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 112.468 0.544 . . . . 34.649999999999999 112.468 -176.944 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 35.9 m -53.39 -51.64 61.89 Favored 'General case' 0 N--CA 1.479 1.015 0 CA-C-O 121.447 0.642 . . . . 21.960000000000001 111.767 176.416 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -57.31 -36.32 70.95 Favored 'General case' 0 CA--C 1.555 1.143 0 N-CA-C 113.652 0.982 . . . . 20.84 113.652 176.893 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 61.1 ttp85 -65.43 -41.28 93.69 Favored 'General case' 0 N--CA 1.464 0.232 0 N-CA-C 110.196 -0.298 . . . . 39.109999999999999 110.196 179.456 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' LYS . . . . . 0.706 ' NZ ' ' O1D' ' A' ' 700' ' ' HEM . 17.8 mtmt -74.26 -30.44 62.13 Favored 'General case' 0 C--O 1.21 -0.991 0 N-CA-C 115.295 1.591 . . . . 27.649999999999999 115.295 178.485 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 19.7 tp60 -72.27 -28.46 63.14 Favored 'General case' 0 C--O 1.213 -0.849 0 N-CA-C 109.602 -0.518 . . . . 25.079999999999998 109.602 175.151 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 61.2 mttt -73.09 -51.23 18.81 Favored 'General case' 0 CA--C 1.512 -0.517 0 N-CA-C 107.049 -1.463 . . . . 24.43 107.049 -178.592 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' GLN . . . . . 0.797 ' OE1' ' NE2' ' A' ' 67' ' ' HIS . 90.9 mt-30 -49.99 -50.85 45.72 Favored 'General case' 0 C--O 1.252 1.209 0 CA-C-O 121.863 0.839 . . . . 27.449999999999999 110.273 169.438 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 90.8 t80 -63.95 -47.24 81.21 Favored 'General case' 0 CA--C 1.508 -0.663 0 C-N-CA 117.193 -1.803 . . . . 22.109999999999999 110.517 -175.024 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 88.6 mt -65.71 -27.8 68.59 Favored 'General case' 0 CA--C 1.557 1.241 0 C-N-CA 118.849 -1.14 . . . . 20.699999999999999 112.927 -176.361 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 66.4 m -59.28 -51.67 68.95 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.154 -0.475 . . . . 20.190000000000001 109.929 173.202 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 32.1 tt0 -60.31 -40.49 90.73 Favored 'General case' 0 CA--C 1.545 0.77 0 CA-C-O 121.895 0.855 . . . . 25.25 113.087 177.368 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' TYR . . . . . 0.443 ' CE1' ' CD1' ' A' ' 114' ' ' LEU . 47.6 t80 -69.53 -23.62 63.62 Favored 'General case' 0 C--O 1.254 1.306 0 C-N-CA 125.536 1.534 . . . . 23.399999999999999 110.79 -173.453 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 47.7 mt -99.82 18.91 17.07 Favored 'General case' 0 C--O 1.216 -0.66 0 O-C-N 124.622 1.201 . . . . 24.0 110.96 -179.53 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 76.5 6.21 83.85 Favored Glycine 0 CA--C 1.525 0.677 0 N-CA-C 117.073 1.589 . . . . 24.539999999999999 117.073 179.156 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -77.12 -164.79 22.13 Favored Glycine 0 C--O 1.205 -1.656 0 N-CA-C 109.412 -1.475 . . . . 24.579999999999998 109.412 176.498 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -59.96 146.41 95.97 Favored 'Trans proline' 0 C--O 1.217 -0.566 0 CA-C-N 118.894 1.347 . . . . 25.550000000000001 110.271 178.685 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_endo -76.87 68.67 7.16 Favored 'Trans proline' 0 C--N 1.327 -0.598 0 C-N-CA 121.429 1.419 . . . . 25.629999999999999 113.043 174.583 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.21 -36.5 82.14 Favored 'General case' 0 CA--C 1.51 -0.576 0 O-C-N 124.23 0.957 . . . . 31.859999999999999 111.131 -176.962 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 58.2 t80 -70.16 -56.01 7.92 Favored 'General case' 0 CA--C 1.545 0.773 0 O-C-N 124.347 1.03 . . . . 32.840000000000003 113.719 -174.084 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 100.0 m -53.86 -56.19 19.93 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 122.679 1.228 . . . . 30.039999999999999 110.863 173.859 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -34.34 -35.33 0.03 OUTLIER 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 116.383 1.994 . . . . 34.159999999999997 116.383 168.255 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -111.19 -39.65 4.67 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 115.762 1.764 . . . . 41.359999999999999 115.762 -174.8 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' HIS . . . . . 0.797 ' NE2' ' OE1' ' A' ' 51' ' ' GLN . 29.8 m-70 -110.15 -20.87 12.53 Favored 'General case' 0 CA--C 1.499 -0.994 0 CA-C-N 116.459 -0.337 . . . . 36.670000000000002 111.556 -170.647 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 103.31 178.78 26.2 Favored Glycine 0 N--CA 1.432 -1.594 0 CA-C-O 123.661 1.701 . . . . 35.049999999999997 110.883 -175.548 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 11.4 t-80 -50.04 129.92 22.68 Favored Pre-proline 0 C--O 1.253 1.247 0 CA-C-N 112.524 -1.838 . . . . 34.25 109.398 -178.954 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' PRO . . . . . 0.461 ' O ' ' C ' ' A' ' 71' ' ' MET . 1.3 Cg_endo -78.39 -38.02 0.63 Allowed 'Trans proline' 0 C--O 1.208 -1.003 0 C-N-CA 122.515 2.144 . . . . 34.149999999999999 116.328 -161.636 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' MET . . . . . 0.461 ' C ' ' O ' ' A' ' 70' ' ' PRO . 13.8 ptt? 29.09 66.76 0.1 Allowed 'General case' 0 N--CA 1.466 0.352 0 O-C-N 124.663 1.227 . . . . 38.259999999999998 110.329 171.459 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 11.9 mt -68.51 -37.88 80.45 Favored 'General case' 0 CA--C 1.507 -0.684 0 N-CA-C 112.12 0.415 . . . . 33.619999999999997 112.12 -164.254 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 6.4 ttt85 -57.79 -36.89 72.81 Favored 'General case' 0 N--CA 1.446 -0.626 0 O-C-N 123.61 0.569 . . . . 36.060000000000002 110.731 178.816 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -68.48 -41.04 80.68 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.841 0.829 . . . . 26.600000000000001 111.341 176.916 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 13.1 mtp85 -71.07 -19.47 62.47 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.549 -0.75 . . . . 33.560000000000002 109.61 -171.888 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 8.1 m80 -98.94 -15.65 19.06 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 125.575 1.55 . . . . 32.310000000000002 111.702 -174.398 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' LEU . . . . . 0.435 ' N ' ' CD ' ' A' ' 78' ' ' PRO . 9.5 mt -59.52 -33.95 19.48 Favored Pre-proline 0 CA--C 1.548 0.881 0 N-CA-C 117.09 2.255 . . . . 29.899999999999999 117.09 -174.185 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' PRO . . . . . 0.435 ' CD ' ' N ' ' A' ' 77' ' ' LEU . 84.1 Cg_exo -57.12 -21.93 45.13 Favored 'Trans proline' 0 CA--C 1.537 0.638 0 C-N-CA 122.408 2.072 . . . . 26.649999999999999 115.319 173.14 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 72.4 m-85 -104.13 153.36 38.98 Favored Pre-proline 0 CA--C 1.515 -0.375 0 N-CA-C 108.326 -0.99 . . . . 27.43 108.326 -169.39 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_endo -87.31 71.55 3.28 Favored 'Trans proline' 0 C--O 1.208 -0.996 0 C-N-CA 122.453 2.102 . . . . 28.489999999999998 113.449 -175.985 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 1.8 mp -81.12 101.42 6.01 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-N 115.788 -0.642 . . . . 28.629999999999999 109.367 -174.514 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 11.3 p -88.08 165.55 15.06 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-N 114.947 -1.024 . . . . 27.859999999999999 110.554 175.66 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 58.9 m-20 -57.2 -36.74 71.22 Favored 'General case' 0 C--O 1.217 -0.623 0 N-CA-C 109.521 -0.548 . . . . 31.18 109.521 170.71 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . 0.329 0.0 OUTLIER -78.5 -25.36 45.64 Favored 'General case' 0 CA--C 1.545 0.751 0 N-CA-C 109.741 -0.466 . . . . 33.799999999999997 109.741 -173.332 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 15.6 mtt85 -78.93 -38.22 37.82 Favored 'General case' 0 C--O 1.238 0.499 0 C-N-CA 122.939 0.496 . . . . 26.370000000000001 110.46 173.957 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -60.52 -31.75 70.81 Favored 'General case' 0 C--O 1.249 1.03 0 CA-C-O 120.858 0.361 . . . . 21.52 110.255 174.343 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -76.56 -42.94 40.99 Favored 'General case' 0 N--CA 1.44 -0.961 0 CA-C-N 115.209 -0.905 . . . . 25.48 110.628 -178.587 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -57.13 -43.56 82.49 Favored 'General case' 0 CA--C 1.574 1.901 0 N-CA-C 113.466 0.913 . . . . 17.219999999999999 113.466 174.139 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' TRP . . . . . . . . . . . . . 8.8 t90 -58.33 -49.31 77.65 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 124.291 1.036 . . . . 19.629999999999999 109.476 176.855 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.49 -49.72 76.68 Favored 'General case' 0 C--O 1.211 -0.957 0 CA-C-N 114.982 -1.008 . . . . 17.640000000000001 111.439 176.27 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 61.0 m -55.84 -44.82 78.33 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-N 117.705 0.229 . . . . 19.91 111.081 174.04 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 58.2 m -60.42 -38.43 84.04 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 119.167 -1.013 . . . . 17.98 109.642 -179.758 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 10.1 tpt -73.73 -38.35 64.82 Favored 'General case' 0 C--O 1.218 -0.577 0 CA-C-N 115.613 -0.722 . . . . 27.289999999999999 110.075 -174.147 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 5.3 ttpt -60.49 -45.22 94.56 Favored 'General case' 0 C--O 1.244 0.775 0 CA-C-O 121.848 0.833 . . . . 32.390000000000001 110.933 174.961 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' ASP . . . . . 0.829 ' OD2' ' O ' ' A' 2061 ' ' HOH . 17.0 t70 -60.4 -40.79 92.18 Favored 'General case' 0 C--O 1.242 0.684 0 CA-C-N 114.93 -1.032 . . . . 21.920000000000002 110.97 178.826 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -65.62 -32.94 74.79 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 123.559 0.537 . . . . 18.93 111.579 -177.464 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' MET . . . . . 0.421 ' CE ' ' NE ' ' A' ' 107' ' ' ARG . 4.4 mtm -71.44 -45.92 61.41 Favored 'General case' 0 C--O 1.212 -0.892 0 N-CA-C 108.392 -0.966 . . . . 19.59 108.392 178.927 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 85.3 m-20 -50.97 -45.81 61.01 Favored 'General case' 0 C--O 1.211 -0.959 0 CA-C-O 121.299 0.571 . . . . 23.760000000000002 110.541 174.881 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 13.9 t-80 -63.37 -41.05 98.79 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.885 -0.598 . . . . 28.059999999999999 112.591 -173.321 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 18.4 m -87.06 -6.11 10.48 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.475 0 N-CA-C 109.11 -0.7 . . . . 20.129999999999999 109.11 -177.212 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 76.45 23.52 70.37 Favored Glycine 0 N--CA 1.434 -1.44 0 CA-C-N 115.303 -0.862 . . . . 21.899999999999999 112.355 178.861 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -56.23 130.96 46.55 Favored 'General case' 0 C--O 1.212 -0.894 0 CA-C-N 117.53 0.665 . . . . 28.760000000000002 110.969 171.381 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' GLU . . . . . 0.649 ' OE2' ' O ' ' A' 2065 ' ' HOH . 11.2 pt-20 -153.35 173.2 15.92 Favored 'General case' 0 C--O 1.204 -1.33 0 C-N-CA 122.219 0.208 . . . . 34.340000000000003 110.494 -178.141 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 77.27 -156.68 45.51 Favored Glycine 0 CA--C 1.523 0.532 0 CA-C-O 122.306 0.948 . . . . 25.949999999999999 115.102 173.99 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -76.31 -28.97 57.14 Favored 'General case' 0 C--O 1.208 -1.088 0 O-C-N 121.72 -0.87 . . . . 35.719999999999999 111.965 -164.16 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 7.9 tp -68.92 -33.86 61.29 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.207 0 CA-C-N 116.074 -0.512 . . . . 25.199999999999999 112.036 173.44 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' ARG . . . . . 0.421 ' NE ' ' CE ' ' A' ' 97' ' ' MET . 50.3 ttt180 -67.92 -43.53 78.98 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 112.319 0.489 . . . . 25.98 112.319 171.622 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 85.7 mt-10 -60.85 -35.19 75.92 Favored 'General case' 0 C--O 1.216 -0.706 0 N-CA-C 114.029 1.122 . . . . 25.699999999999999 114.029 174.117 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 44.2 t80 -80.96 -48.52 12.16 Favored 'General case' 0 C--O 1.206 -1.225 0 N-CA-C 107.703 -1.221 . . . . 24.09 107.703 -173.425 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 24.0 tp -57.85 -53.68 55.42 Favored 'General case' 0 N--CA 1.481 1.095 0 CA-C-O 122.991 1.377 . . . . 23.059999999999999 113.635 178.968 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 31.1 t80 -66.32 -38.58 88.03 Favored 'General case' 0 N--CA 1.44 -0.94 0 CA-C-N 114.274 -1.33 . . . . 20.73 112.423 -176.481 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -64.83 -36.24 92.87 Favored Glycine 0 C--O 1.208 -1.522 0 C-N-CA 120.649 -0.786 . . . . 21.32 111.499 178.046 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' ARG . . . . . 0.47 ' NH2' ' O ' ' A' 2070 ' ' HOH . 0.0 OUTLIER -71.51 -36.49 71.08 Favored 'General case' 0 C--N 1.319 -0.718 0 O-C-N 122.595 -0.356 . . . . 33.609999999999999 110.962 175.889 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' LEU . . . . . 0.443 ' CD1' ' CE1' ' A' ' 56' ' ' TYR . 0.0 OUTLIER -68.75 -37.98 79.79 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-O 121.628 0.728 . . . . 23.469999999999999 109.947 -177.17 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 57.2 mt-10 -58.56 -45.43 89.02 Favored 'General case' 0 C--O 1.212 -0.889 0 CA-C-N 115.278 -0.874 . . . . 23.739999999999998 110.411 174.678 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -69.68 -30.94 68.73 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-O 121.408 0.623 . . . . 22.719999999999999 110.269 -179.531 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 51.9 m -78.29 -39.13 40.81 Favored 'General case' 0 C--N 1.318 -0.792 0 O-C-N 121.189 -0.944 . . . . 24.370000000000001 111.225 -175.643 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -69.59 -35.83 75.67 Favored 'General case' 0 C--O 1.218 -0.561 0 N-CA-C 108.13 -1.063 . . . . 29.039999999999999 108.13 -174.393 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 1.4 ptp85 -68.75 -36.19 78.05 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 120.118 -0.633 . . . . 48.200000000000003 110.063 177.208 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 15.2 t60 -66.88 -17.56 64.95 Favored 'General case' 0 CA--C 1.554 1.126 0 CA-C-O 119.702 -0.189 . . . . 34.240000000000002 111.286 175.331 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' MET . . . . . . . . . . . . . 25.0 mmt -77.64 -31.16 52.57 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 113.928 1.085 . . . . 30.059999999999999 113.928 175.208 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 94.0 t -43.47 121.39 0.47 Allowed 'Isoleucine or valine' 0 CA--C 1.55 0.97 0 C-N-CA 124.141 0.976 . . . . 27.640000000000001 113.07 175.691 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' ASN . . . . . 0.402 ' ND2' ' O ' ' A' 2075 ' ' HOH . 27.0 p30 -135.1 -163.08 1.33 Allowed 'General case' 0 CA--C 1.518 -0.271 0 CA-C-O 119.133 -0.46 . . . . 29.719999999999999 112.105 -176.934 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' GLN . . . . . 0.484 ' N ' ' O ' ' A' 2076 ' ' HOH . . . . . . . . 1 C--N 1.239 -4.22 0 CA-C-N 118.498 0.59 . . . . 30.300000000000001 . . . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 700' ' ' HEM . . . . . 0.706 ' O1D' ' NZ ' ' A' ' 48' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1124 ' ' CYN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1125 ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2001 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2002 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2003 ' ' HOH . . . . . 0.481 ' O ' ' N ' ' A' ' 6' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 2004 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2005 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2006 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2007 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2008 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2009 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2010 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2011 ' ' HOH . . . . . 0.569 ' O ' ' OE2' ' A' ' 15' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 2012 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2013 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2014 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2015 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2016 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2017 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2018 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2019 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2020 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2021 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2022 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2023 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2024 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2025 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2026 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2027 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2028 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2029 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2030 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2031 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2032 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2033 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2034 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2035 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2036 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2037 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2038 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2039 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2040 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2041 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2042 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2043 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2044 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2045 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2046 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2047 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2048 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2049 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2050 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2051 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2052 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2053 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2054 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2055 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2056 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2057 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2058 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2059 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2060 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2061 ' ' HOH . . . . . 0.829 ' O ' ' OD2' ' A' ' 95' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 2062 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2063 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2064 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2065 ' ' HOH . . . . . 0.649 ' O ' ' OE2' ' A' ' 103' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 2066 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2067 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2068 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2069 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2070 ' ' HOH . . . . . 0.47 ' O ' ' NH2' ' A' ' 113' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 2071 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2072 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2073 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2074 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2075 ' ' HOH . . . . . 0.402 ' O ' ' ND2' ' A' ' 123' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 2076 ' ' HOH . . . . . 0.484 ' O ' ' N ' ' A' ' 124' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 2077 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 6' ' ' ASN . . . . . 0.533 ' HA ' ' O ' ' A' 2002 ' ' HOH . 0.9 OUTLIER . . . . . 0 N--CA 1.506 2.371 0 N-CA-C 109.176 -0.676 . . . . 38.609999999999999 109.176 . . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -61.85 140.02 95.57 Favored Pre-proline 0 C--O 1.247 0.95 0 O-C-N 123.799 0.687 . . . . 30.77 109.851 -174.947 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_exo -58.33 -25.59 73.48 Favored 'Trans proline' 0 C--O 1.203 -1.242 0 C-N-CA 121.488 1.459 . . . . 27.350000000000001 113.767 178.425 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 48.7 t80 -57.59 -36.63 71.98 Favored 'General case' 0 N--CA 1.443 -0.785 0 O-C-N 121.867 -0.521 . . . . 28.5 110.877 174.085 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -63.15 -24.48 67.91 Favored 'General case' 0 C--O 1.218 -0.554 0 C-N-CA 120.301 -0.56 . . . . 36.829999999999998 111.85 -179.083 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -74.8 -6.14 47.34 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 115.495 1.665 . . . . 24.449999999999999 115.495 175.31 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -120.87 -49.61 3.16 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.39 0 O-C-N 121.104 -0.997 . . . . 23.59 110.608 177.012 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 80.26 164.18 29.81 Favored Glycine 0 N--CA 1.448 -0.561 0 N-CA-C 117.274 1.67 . . . . 22.449999999999999 117.274 178.851 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -59.12 -45.53 90.68 Favored 'General case' 0 C--O 1.207 -1.173 0 CA-C-N 113.999 -1.1 . . . . 35.719999999999999 112.739 -169.752 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' GLU . . . . . 0.569 ' OE2' ' O ' ' A' 2011 ' ' HOH . 9.6 mp0 -68.4 -53.37 24.26 Favored 'General case' 0 C--N 1.322 -0.612 0 C-N-CA 123.133 0.573 . . . . 23.210000000000001 111.933 -174.715 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 56.9 tp -65.51 -34.65 78.77 Favored 'General case' 0 C--O 1.214 -0.788 0 O-C-N 123.87 0.731 . . . . 21.68 112.165 178.107 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 35.5 tp -65.69 -48.16 73.0 Favored 'General case' 0 C--N 1.318 -0.794 0 C-N-CA 119.412 -0.915 . . . . 20.489999999999998 109.976 176.361 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 27.7 t -54.0 -38.06 64.69 Favored 'General case' 0 C--O 1.204 -1.307 0 CA-C-O 119.253 -0.403 . . . . 21.789999999999999 112.069 175.23 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 60.1 tt0 -73.84 -39.88 63.69 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 123.17 0.588 . . . . 31.699999999999999 110.586 -178.397 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' LEU . . . . . 0.641 HD11 ' HE3' ' A' ' 93' ' ' MET . 66.0 tp -55.74 -44.47 77.6 Favored 'General case' 0 N--CA 1.483 1.203 0 CA-C-O 121.386 0.613 . . . . 18.699999999999999 111.806 174.443 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 11.3 t -79.76 -30.12 13.25 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.38 0 CA-C-N 115.597 -0.729 . . . . 19.780000000000001 111.592 -172.303 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 69.1 m-20 -75.94 -43.96 42.42 Favored 'General case' 0 CA--C 1.49 -1.342 0 N-CA-C 106.533 -1.654 . . . . 22.300000000000001 106.533 -179.27 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 90.1 m -54.5 -46.12 73.41 Favored 'General case' 0 N--CA 1.442 -0.858 0 C-N-CA 120.11 -0.636 . . . . 19.57 109.307 175.485 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 41.5 t80 -55.72 -47.87 76.14 Favored 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 109.595 -0.52 . . . . 17.460000000000001 109.595 -176.285 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 58.8 m-85 -75.32 -17.76 60.18 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 115.262 1.578 . . . . 21.690000000000001 115.262 -178.045 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 -66.55 -39.63 88.63 Favored 'General case' 0 C--O 1.199 -1.604 0 N-CA-C 109.484 -0.562 . . . . 33.329999999999998 109.484 166.21 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 69.7 mmt-85 -72.22 -45.26 60.98 Favored 'General case' 0 C--O 1.246 0.875 0 N-CA-C 113.816 1.043 . . . . 38.399999999999999 113.816 178.089 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 24.3 t -52.38 -42.45 38.19 Favored 'Isoleucine or valine' 0 CA--C 1.565 1.53 0 N-CA-C 109.745 -0.465 . . . . 22.25 109.745 171.114 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.58 -25.91 64.21 Favored 'General case' 0 CA--C 1.541 0.611 0 O-C-N 121.806 -0.559 . . . . 26.32 111.114 -174.16 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 12.0 m -89.01 -11.3 44.63 Favored 'General case' 0 C--O 1.237 0.424 0 N-CA-C 113.511 0.93 . . . . 25.07 113.511 172.202 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 49.0 t-80 -86.39 109.63 25.07 Favored Pre-proline 0 C--O 1.246 0.902 0 C-N-CA 118.702 -1.199 . . . . 27.82 112.152 -174.69 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -54.49 -28.55 55.2 Favored 'Trans proline' 0 CA--C 1.545 1.054 0 C-N-CA 122.699 2.266 . . . . 24.940000000000001 116.075 -173.356 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 15.4 tp -77.99 -30.15 49.99 Favored 'General case' 0 CA--C 1.561 1.367 0 N-CA-C 113.131 0.789 . . . . 22.539999999999999 113.131 176.282 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 62.3 mt -96.85 -41.89 8.22 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 115.856 1.799 . . . . 22.879999999999999 115.856 -176.837 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' LYS . . . . . 0.405 ' HB3' ' HD3' ' A' ' 36' ' ' PRO . 10.5 tttp -44.36 -46.21 23.61 Favored Pre-proline 0 CA--C 1.569 1.681 0 N-CA-C 112.857 0.688 . . . . 33.799999999999997 112.857 -176.737 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 36' ' ' PRO . . . . . 0.405 ' HD3' ' HB3' ' A' ' 35' ' ' LYS . 52.3 Cg_exo -55.72 -37.98 94.86 Favored 'Trans proline' 0 N--CA 1.485 1.019 0 C-N-CA 122.554 2.17 . . . . 27.210000000000001 117.446 178.101 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 35.3 pt -90.25 -12.29 9.66 Favored 'Isoleucine or valine' 0 C--O 1.274 2.382 0 N-CA-C 114.781 1.4 . . . . 23.59 114.781 -177.006 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 30.8 m-85 -86.33 162.64 45.21 Favored Pre-proline 0 C--O 1.21 -0.974 0 CA-C-N 115.716 -0.675 . . . . 26.23 110.578 171.011 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_exo -52.46 149.49 23.41 Favored 'Trans proline' 0 CA--C 1.543 0.933 0 C-N-CA 121.15 1.233 . . . . 24.190000000000001 113.853 162.28 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 31.3 m -65.24 -45.37 84.92 Favored 'General case' 0 C--O 1.243 0.742 0 CA-C-N 115.249 -0.887 . . . . 26.940000000000001 111.048 175.211 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 4.8 t0 -91.37 116.56 28.94 Favored 'General case' 0 C--O 1.235 0.315 0 C-N-CA 124.33 1.052 . . . . 31.390000000000001 109.284 166.773 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 12.5 mt -95.2 8.51 42.83 Favored 'General case' 0 CA--C 1.545 0.769 0 N-CA-C 113.779 1.029 . . . . 24.199999999999999 113.779 178.232 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 98.6 m -51.98 -46.57 64.89 Favored 'General case' 0 CA--C 1.549 0.911 0 N-CA-C 112.246 0.461 . . . . 25.77 112.246 -178.634 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 60.2 mm-40 -76.51 -42.08 44.63 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 112.468 0.544 . . . . 34.649999999999999 112.468 -176.944 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 35.9 m -53.39 -51.64 61.89 Favored 'General case' 0 N--CA 1.479 1.015 0 CA-C-O 121.447 0.642 . . . . 21.960000000000001 111.767 176.416 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -57.31 -36.32 70.95 Favored 'General case' 0 CA--C 1.555 1.143 0 N-CA-C 113.652 0.982 . . . . 20.84 113.652 176.893 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 61.1 ttp85 -65.43 -41.28 93.69 Favored 'General case' 0 N--CA 1.464 0.232 0 N-CA-C 110.196 -0.298 . . . . 39.109999999999999 110.196 179.456 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' LYS . . . . . 0.636 ' NZ ' ' O1D' ' A' ' 700' ' ' HEM . 17.8 mtmt -74.26 -30.44 62.13 Favored 'General case' 0 C--O 1.21 -0.991 0 N-CA-C 115.295 1.591 . . . . 27.649999999999999 115.295 178.485 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 19.7 tp60 -72.27 -28.46 63.14 Favored 'General case' 0 C--O 1.213 -0.849 0 N-CA-C 109.602 -0.518 . . . . 25.079999999999998 109.602 175.151 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 61.2 mttt -73.09 -51.23 18.81 Favored 'General case' 0 CA--C 1.512 -0.517 0 N-CA-C 107.049 -1.463 . . . . 24.43 107.049 -178.592 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' GLN . . . . . 0.712 ' OE1' ' NE2' ' A' ' 67' ' ' HIS . 90.9 mt-30 -49.99 -50.85 45.72 Favored 'General case' 0 C--O 1.252 1.209 0 CA-C-O 121.863 0.839 . . . . 27.449999999999999 110.273 169.438 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 90.8 t80 -63.95 -47.24 81.21 Favored 'General case' 0 CA--C 1.508 -0.663 0 C-N-CA 117.193 -1.803 . . . . 22.109999999999999 110.517 -175.024 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 88.6 mt -65.71 -27.8 68.59 Favored 'General case' 0 CA--C 1.557 1.241 0 C-N-CA 118.849 -1.14 . . . . 20.699999999999999 112.927 -176.361 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 66.4 m -59.28 -51.67 68.95 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.154 -0.475 . . . . 20.190000000000001 109.929 173.202 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 32.1 tt0 -60.31 -40.49 90.73 Favored 'General case' 0 CA--C 1.545 0.77 0 CA-C-O 121.895 0.855 . . . . 25.25 113.087 177.368 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' TYR . . . . . 0.591 ' CE1' HD13 ' A' ' 114' ' ' LEU . 47.6 t80 -69.53 -23.62 63.62 Favored 'General case' 0 C--O 1.254 1.306 0 C-N-CA 125.536 1.534 . . . . 23.399999999999999 110.79 -173.453 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 47.7 mt -99.82 18.91 17.07 Favored 'General case' 0 C--O 1.216 -0.66 0 O-C-N 124.622 1.201 . . . . 24.0 110.96 -179.53 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 76.5 6.21 83.85 Favored Glycine 0 CA--C 1.525 0.677 0 N-CA-C 117.073 1.589 . . . . 24.539999999999999 117.073 179.156 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -77.12 -164.79 22.13 Favored Glycine 0 C--O 1.205 -1.656 0 N-CA-C 109.412 -1.475 . . . . 24.579999999999998 109.412 176.498 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -59.96 146.41 95.97 Favored 'Trans proline' 0 C--O 1.217 -0.566 0 CA-C-N 118.894 1.347 . . . . 25.550000000000001 110.271 178.685 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' PRO . . . . . 0.41 ' O ' ' HB2' ' A' ' 65' ' ' GLU . 76.0 Cg_endo -76.87 68.67 7.16 Favored 'Trans proline' 0 C--N 1.327 -0.598 0 C-N-CA 121.429 1.419 . . . . 25.629999999999999 113.043 174.583 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.21 -36.5 82.14 Favored 'General case' 0 CA--C 1.51 -0.576 0 O-C-N 124.23 0.957 . . . . 31.859999999999999 111.131 -176.962 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 58.2 t80 -70.16 -56.01 7.92 Favored 'General case' 0 CA--C 1.545 0.773 0 O-C-N 124.347 1.03 . . . . 32.840000000000003 113.719 -174.084 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 100.0 m -53.86 -56.19 19.93 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 122.679 1.228 . . . . 30.039999999999999 110.863 173.859 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' GLU . . . . . 0.41 ' HB2' ' O ' ' A' ' 61' ' ' PRO . 0.2 OUTLIER -34.34 -35.33 0.03 OUTLIER 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 116.383 1.994 . . . . 34.159999999999997 116.383 168.255 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -111.19 -39.65 4.67 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 115.762 1.764 . . . . 41.359999999999999 115.762 -174.8 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' HIS . . . . . 0.712 ' NE2' ' OE1' ' A' ' 51' ' ' GLN . 29.8 m-70 -110.15 -20.87 12.53 Favored 'General case' 0 CA--C 1.499 -0.994 0 CA-C-N 116.459 -0.337 . . . . 36.670000000000002 111.556 -170.647 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 103.31 178.78 26.2 Favored Glycine 0 N--CA 1.432 -1.594 0 CA-C-O 123.661 1.701 . . . . 35.049999999999997 110.883 -175.548 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' HIS . . . . . 0.483 ' HA ' ' HD3' ' A' ' 70' ' ' PRO . 11.4 t-80 -50.04 129.92 22.68 Favored Pre-proline 0 C--O 1.253 1.247 0 CA-C-N 112.524 -1.838 . . . . 34.25 109.398 -178.954 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 70' ' ' PRO . . . . . 0.535 ' O ' ' HD2' ' A' ' 75' ' ' ARG . 1.3 Cg_endo -78.39 -38.02 0.63 Allowed 'Trans proline' 0 C--O 1.208 -1.003 0 C-N-CA 122.515 2.144 . . . . 34.149999999999999 116.328 -161.636 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 71' ' ' MET . . . . . 0.461 ' C ' ' O ' ' A' ' 70' ' ' PRO . 13.8 ptt? 29.09 66.76 0.1 Allowed 'General case' 0 N--CA 1.466 0.352 0 O-C-N 124.663 1.227 . . . . 38.259999999999998 110.329 171.459 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 11.9 mt -68.51 -37.88 80.45 Favored 'General case' 0 CA--C 1.507 -0.684 0 N-CA-C 112.12 0.415 . . . . 33.619999999999997 112.12 -164.254 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 6.4 ttt85 -57.79 -36.89 72.81 Favored 'General case' 0 N--CA 1.446 -0.626 0 O-C-N 123.61 0.569 . . . . 36.060000000000002 110.731 178.816 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -68.48 -41.04 80.68 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.841 0.829 . . . . 26.600000000000001 111.341 176.916 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' ARG . . . . . 0.535 ' HD2' ' O ' ' A' ' 70' ' ' PRO . 13.1 mtp85 -71.07 -19.47 62.47 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.549 -0.75 . . . . 33.560000000000002 109.61 -171.888 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 8.1 m80 -98.94 -15.65 19.06 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 125.575 1.55 . . . . 32.310000000000002 111.702 -174.398 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' LEU . . . . . 0.435 ' N ' ' CD ' ' A' ' 78' ' ' PRO . 9.5 mt -59.52 -33.95 19.48 Favored Pre-proline 0 CA--C 1.548 0.881 0 N-CA-C 117.09 2.255 . . . . 29.899999999999999 117.09 -174.185 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 78' ' ' PRO . . . . . 0.435 ' CD ' ' N ' ' A' ' 77' ' ' LEU . 84.1 Cg_exo -57.12 -21.93 45.13 Favored 'Trans proline' 0 CA--C 1.537 0.638 0 C-N-CA 122.408 2.072 . . . . 26.649999999999999 115.319 173.14 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 72.4 m-85 -104.13 153.36 38.98 Favored Pre-proline 0 CA--C 1.515 -0.375 0 N-CA-C 108.326 -0.99 . . . . 27.43 108.326 -169.39 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_endo -87.31 71.55 3.28 Favored 'Trans proline' 0 C--O 1.208 -0.996 0 C-N-CA 122.453 2.102 . . . . 28.489999999999998 113.449 -175.985 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' ILE . . . . . 0.537 HG22 ' HA ' ' A' ' 122' ' ' VAL . 1.8 mp -81.12 101.42 6.01 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-N 115.788 -0.642 . . . . 28.629999999999999 109.367 -174.514 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 11.3 p -88.08 165.55 15.06 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-N 114.947 -1.024 . . . . 27.859999999999999 110.554 175.66 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 58.9 m-20 -57.2 -36.74 71.22 Favored 'General case' 0 C--O 1.217 -0.623 0 N-CA-C 109.521 -0.548 . . . . 31.18 109.521 170.71 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' GLU . . . . . 0.405 ' HB3' ' O ' ' A' 2052 ' ' HOH 0.329 0.0 OUTLIER -78.5 -25.36 45.64 Favored 'General case' 0 CA--C 1.545 0.751 0 N-CA-C 109.741 -0.466 . . . . 33.799999999999997 109.741 -173.332 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 15.6 mtt85 -78.93 -38.22 37.82 Favored 'General case' 0 C--O 1.238 0.499 0 C-N-CA 122.939 0.496 . . . . 26.370000000000001 110.46 173.957 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' ALA . . . . . 0.536 ' HA ' HBB1 ' A' ' 700' ' ' HEM . . . -60.52 -31.75 70.81 Favored 'General case' 0 C--O 1.249 1.03 0 CA-C-O 120.858 0.361 . . . . 21.52 110.255 174.343 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -76.56 -42.94 40.99 Favored 'General case' 0 N--CA 1.44 -0.961 0 CA-C-N 115.209 -0.905 . . . . 25.48 110.628 -178.587 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -57.13 -43.56 82.49 Favored 'General case' 0 CA--C 1.574 1.901 0 N-CA-C 113.466 0.913 . . . . 17.219999999999999 113.466 174.139 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' TRP . . . . . . . . . . . . . 8.8 t90 -58.33 -49.31 77.65 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 124.291 1.036 . . . . 19.629999999999999 109.476 176.855 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.49 -49.72 76.68 Favored 'General case' 0 C--O 1.211 -0.957 0 CA-C-N 114.982 -1.008 . . . . 17.640000000000001 111.439 176.27 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 61.0 m -55.84 -44.82 78.33 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-N 117.705 0.229 . . . . 19.91 111.081 174.04 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 58.2 m -60.42 -38.43 84.04 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 119.167 -1.013 . . . . 17.98 109.642 -179.758 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' MET . . . . . 0.641 ' HE3' HD11 ' A' ' 20' ' ' LEU . 10.1 tpt -73.73 -38.35 64.82 Favored 'General case' 0 C--O 1.218 -0.577 0 CA-C-N 115.613 -0.722 . . . . 27.289999999999999 110.075 -174.147 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 5.3 ttpt -60.49 -45.22 94.56 Favored 'General case' 0 C--O 1.244 0.775 0 CA-C-O 121.848 0.833 . . . . 32.390000000000001 110.933 174.961 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' ASP . . . . . 0.829 ' OD2' ' O ' ' A' 2061 ' ' HOH . 17.0 t70 -60.4 -40.79 92.18 Favored 'General case' 0 C--O 1.242 0.684 0 CA-C-N 114.93 -1.032 . . . . 21.920000000000002 110.97 178.826 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -65.62 -32.94 74.79 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 123.559 0.537 . . . . 18.93 111.579 -177.464 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' MET . . . . . 0.618 ' HE3' ' NE ' ' A' ' 107' ' ' ARG . 4.4 mtm -71.44 -45.92 61.41 Favored 'General case' 0 C--O 1.212 -0.892 0 N-CA-C 108.392 -0.966 . . . . 19.59 108.392 178.927 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 85.3 m-20 -50.97 -45.81 61.01 Favored 'General case' 0 C--O 1.211 -0.959 0 CA-C-O 121.299 0.571 . . . . 23.760000000000002 110.541 174.881 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 13.9 t-80 -63.37 -41.05 98.79 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.885 -0.598 . . . . 28.059999999999999 112.591 -173.321 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 18.4 m -87.06 -6.11 10.48 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.475 0 N-CA-C 109.11 -0.7 . . . . 20.129999999999999 109.11 -177.212 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 76.45 23.52 70.37 Favored Glycine 0 N--CA 1.434 -1.44 0 CA-C-N 115.303 -0.862 . . . . 21.899999999999999 112.355 178.861 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -56.23 130.96 46.55 Favored 'General case' 0 C--O 1.212 -0.894 0 CA-C-N 117.53 0.665 . . . . 28.760000000000002 110.969 171.381 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 103' ' ' GLU . . . . . 0.649 ' OE2' ' O ' ' A' 2065 ' ' HOH . 11.2 pt-20 -153.35 173.2 15.92 Favored 'General case' 0 C--O 1.204 -1.33 0 C-N-CA 122.219 0.208 . . . . 34.340000000000003 110.494 -178.141 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 77.27 -156.68 45.51 Favored Glycine 0 CA--C 1.523 0.532 0 CA-C-O 122.306 0.948 . . . . 25.949999999999999 115.102 173.99 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -76.31 -28.97 57.14 Favored 'General case' 0 C--O 1.208 -1.088 0 O-C-N 121.72 -0.87 . . . . 35.719999999999999 111.965 -164.16 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 7.9 tp -68.92 -33.86 61.29 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.207 0 CA-C-N 116.074 -0.512 . . . . 25.199999999999999 112.036 173.44 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' ARG . . . . . 0.618 ' NE ' ' HE3' ' A' ' 97' ' ' MET . 50.3 ttt180 -67.92 -43.53 78.98 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 112.319 0.489 . . . . 25.98 112.319 171.622 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 85.7 mt-10 -60.85 -35.19 75.92 Favored 'General case' 0 C--O 1.216 -0.706 0 N-CA-C 114.029 1.122 . . . . 25.699999999999999 114.029 174.117 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 44.2 t80 -80.96 -48.52 12.16 Favored 'General case' 0 C--O 1.206 -1.225 0 N-CA-C 107.703 -1.221 . . . . 24.09 107.703 -173.425 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 24.0 tp -57.85 -53.68 55.42 Favored 'General case' 0 N--CA 1.481 1.095 0 CA-C-O 122.991 1.377 . . . . 23.059999999999999 113.635 178.968 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 31.1 t80 -66.32 -38.58 88.03 Favored 'General case' 0 N--CA 1.44 -0.94 0 CA-C-N 114.274 -1.33 . . . . 20.73 112.423 -176.481 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -64.83 -36.24 92.87 Favored Glycine 0 C--O 1.208 -1.522 0 C-N-CA 120.649 -0.786 . . . . 21.32 111.499 178.046 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 113' ' ' ARG . . . . . 0.472 HH21 ' CG ' ' A' ' 113' ' ' ARG . 0.0 OUTLIER -71.51 -36.49 71.08 Favored 'General case' 0 C--N 1.319 -0.718 0 O-C-N 122.595 -0.356 . . . . 33.609999999999999 110.962 175.889 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 114' ' ' LEU . . . . . 0.591 HD13 ' CE1' ' A' ' 56' ' ' TYR . 0.0 OUTLIER -68.75 -37.98 79.79 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-O 121.628 0.728 . . . . 23.469999999999999 109.947 -177.17 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 57.2 mt-10 -58.56 -45.43 89.02 Favored 'General case' 0 C--O 1.212 -0.889 0 CA-C-N 115.278 -0.874 . . . . 23.739999999999998 110.411 174.678 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 116' ' ' LEU . . . . . 0.412 ' O ' ' HG3' ' A' ' 119' ' ' ARG . 0.0 OUTLIER -69.68 -30.94 68.73 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-O 121.408 0.623 . . . . 22.719999999999999 110.269 -179.531 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 51.9 m -78.29 -39.13 40.81 Favored 'General case' 0 C--N 1.318 -0.792 0 O-C-N 121.189 -0.944 . . . . 24.370000000000001 111.225 -175.643 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -69.59 -35.83 75.67 Favored 'General case' 0 C--O 1.218 -0.561 0 N-CA-C 108.13 -1.063 . . . . 29.039999999999999 108.13 -174.393 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 119' ' ' ARG . . . . . 0.412 ' HG3' ' O ' ' A' ' 116' ' ' LEU . 1.4 ptp85 -68.75 -36.19 78.05 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 120.118 -0.633 . . . . 48.200000000000003 110.063 177.208 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 15.2 t60 -66.88 -17.56 64.95 Favored 'General case' 0 CA--C 1.554 1.126 0 CA-C-O 119.702 -0.189 . . . . 34.240000000000002 111.286 175.331 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 121' ' ' MET . . . . . . . . . . . . . 25.0 mmt -77.64 -31.16 52.57 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 113.928 1.085 . . . . 30.059999999999999 113.928 175.208 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 122' ' ' VAL . . . . . 0.537 ' HA ' HG22 ' A' ' 81' ' ' ILE . 94.0 t -43.47 121.39 0.47 Allowed 'Isoleucine or valine' 0 CA--C 1.55 0.97 0 C-N-CA 124.141 0.976 . . . . 27.640000000000001 113.07 175.691 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 27.0 p30 -135.1 -163.08 1.33 Allowed 'General case' 0 CA--C 1.518 -0.271 0 CA-C-O 119.133 -0.46 . . . . 29.719999999999999 112.105 -176.934 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 124' ' ' GLN . . . . . 0.484 ' N ' ' O ' ' A' 2076 ' ' HOH . . . . . . . . 1 C--N 1.239 -4.22 0 CA-C-N 118.498 0.59 . . . . 30.300000000000001 . . . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 700' ' ' HEM . . . . . 0.636 ' O1D' ' NZ ' ' A' ' 48' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1124 ' ' CYN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1125 ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2001 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2002 ' ' HOH . . . . . 0.533 ' O ' ' HA ' ' A' ' 6' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 2003 ' ' HOH . . . . . 0.481 ' O ' ' N ' ' A' ' 6' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 2004 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2005 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2006 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2007 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2008 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2009 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2010 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2011 ' ' HOH . . . . . 0.569 ' O ' ' OE2' ' A' ' 15' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 2012 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2013 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2014 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2015 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2016 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2017 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2018 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2019 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2020 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2021 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2022 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2023 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2024 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2025 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2026 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2027 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2028 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2029 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2030 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2031 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2032 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2033 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2034 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2035 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2036 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2037 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2038 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2039 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2040 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2041 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2042 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2043 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2044 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2045 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2046 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2047 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2048 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2049 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2050 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2051 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2052 ' ' HOH . . . . . 0.405 ' O ' ' HB3' ' A' ' 84' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 2053 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2054 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2055 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2056 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2057 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2058 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2059 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2060 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2061 ' ' HOH . . . . . 0.829 ' O ' ' OD2' ' A' ' 95' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 2062 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2063 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2064 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2065 ' ' HOH . . . . . 0.649 ' O ' ' OE2' ' A' ' 103' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 2066 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2067 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2068 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2069 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2070 ' ' HOH . . . . . 0.47 ' O ' ' NH2' ' A' ' 113' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 2071 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2072 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2073 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2074 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2075 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2076 ' ' HOH . . . . . 0.484 ' O ' ' N ' ' A' ' 124' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 2077 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' ASN . . . . . 0.533 ' HA ' ' O ' ' A' 2002 ' ' HOH . 0.9 OUTLIER . . . . . 0 N--CA 1.506 2.371 0 N-CA-C 109.176 -0.676 . . . . 38.609999999999999 109.176 . . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -61.85 140.02 95.57 Favored Pre-proline 0 C--O 1.247 0.95 0 O-C-N 123.799 0.687 . . . . 30.77 109.851 -174.947 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_exo -58.33 -25.59 73.48 Favored 'Trans proline' 0 C--O 1.203 -1.242 0 C-N-CA 121.488 1.459 . . . . 27.350000000000001 113.767 178.425 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 48.7 t80 -57.59 -36.63 71.98 Favored 'General case' 0 N--CA 1.443 -0.785 0 O-C-N 121.867 -0.521 . . . . 28.5 110.877 174.085 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -63.15 -24.48 67.91 Favored 'General case' 0 C--O 1.218 -0.554 0 C-N-CA 120.301 -0.56 . . . . 36.829999999999998 111.85 -179.083 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -74.8 -6.14 47.34 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 115.495 1.665 . . . . 24.449999999999999 115.495 175.31 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -120.87 -49.61 3.16 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.39 0 O-C-N 121.104 -0.997 . . . . 23.59 110.608 177.012 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 80.26 164.18 29.81 Favored Glycine 0 N--CA 1.448 -0.561 0 N-CA-C 117.274 1.67 . . . . 22.449999999999999 117.274 178.851 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -59.12 -45.53 90.68 Favored 'General case' 0 C--O 1.207 -1.173 0 CA-C-N 113.999 -1.1 . . . . 35.719999999999999 112.739 -169.752 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.569 ' OE2' ' O ' ' A' 2011 ' ' HOH . 9.6 mp0 -68.4 -53.37 24.26 Favored 'General case' 0 C--N 1.322 -0.612 0 C-N-CA 123.133 0.573 . . . . 23.210000000000001 111.933 -174.715 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 56.9 tp -65.51 -34.65 78.77 Favored 'General case' 0 C--O 1.214 -0.788 0 O-C-N 123.87 0.731 . . . . 21.68 112.165 178.107 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 35.5 tp -65.69 -48.16 73.0 Favored 'General case' 0 C--N 1.318 -0.794 0 C-N-CA 119.412 -0.915 . . . . 20.489999999999998 109.976 176.361 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 27.7 t -54.0 -38.06 64.69 Favored 'General case' 0 C--O 1.204 -1.307 0 CA-C-O 119.253 -0.403 . . . . 21.789999999999999 112.069 175.23 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 60.1 tt0 -73.84 -39.88 63.69 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 123.17 0.588 . . . . 31.699999999999999 110.586 -178.397 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.641 HD11 ' HE3' ' A' ' 93' ' ' MET . 66.0 tp -55.74 -44.47 77.6 Favored 'General case' 0 N--CA 1.483 1.203 0 CA-C-O 121.386 0.613 . . . . 18.699999999999999 111.806 174.443 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 11.3 t -79.76 -30.12 13.25 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.38 0 CA-C-N 115.597 -0.729 . . . . 19.780000000000001 111.592 -172.303 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 69.1 m-20 -75.94 -43.96 42.42 Favored 'General case' 0 CA--C 1.49 -1.342 0 N-CA-C 106.533 -1.654 . . . . 22.300000000000001 106.533 -179.27 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 90.1 m -54.5 -46.12 73.41 Favored 'General case' 0 N--CA 1.442 -0.858 0 C-N-CA 120.11 -0.636 . . . . 19.57 109.307 175.485 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 41.5 t80 -55.72 -47.87 76.14 Favored 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 109.595 -0.52 . . . . 17.460000000000001 109.595 -176.285 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 58.8 m-85 -75.32 -17.76 60.18 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 115.262 1.578 . . . . 21.690000000000001 115.262 -178.045 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 -66.55 -39.63 88.63 Favored 'General case' 0 C--O 1.199 -1.604 0 N-CA-C 109.484 -0.562 . . . . 33.329999999999998 109.484 166.21 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 69.7 mmt-85 -72.22 -45.26 60.98 Favored 'General case' 0 C--O 1.246 0.875 0 N-CA-C 113.816 1.043 . . . . 38.399999999999999 113.816 178.089 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 24.3 t -52.38 -42.45 38.19 Favored 'Isoleucine or valine' 0 CA--C 1.565 1.53 0 N-CA-C 109.745 -0.465 . . . . 22.25 109.745 171.114 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.58 -25.91 64.21 Favored 'General case' 0 CA--C 1.541 0.611 0 O-C-N 121.806 -0.559 . . . . 26.32 111.114 -174.16 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 12.0 m -89.01 -11.3 44.63 Favored 'General case' 0 C--O 1.237 0.424 0 N-CA-C 113.511 0.93 . . . . 25.07 113.511 172.202 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 49.0 t-80 -86.39 109.63 25.07 Favored Pre-proline 0 C--O 1.246 0.902 0 C-N-CA 118.702 -1.199 . . . . 27.82 112.152 -174.69 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -54.49 -28.55 55.2 Favored 'Trans proline' 0 CA--C 1.545 1.054 0 C-N-CA 122.699 2.266 . . . . 24.940000000000001 116.075 -173.356 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 15.4 tp -77.99 -30.15 49.99 Favored 'General case' 0 CA--C 1.561 1.367 0 N-CA-C 113.131 0.789 . . . . 22.539999999999999 113.131 176.282 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 62.3 mt -96.85 -41.89 8.22 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 115.856 1.799 . . . . 22.879999999999999 115.856 -176.837 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.405 ' HB3' ' HD3' ' A' ' 36' ' ' PRO . 10.5 tttp -44.36 -46.21 23.61 Favored Pre-proline 0 CA--C 1.569 1.681 0 N-CA-C 112.857 0.688 . . . . 33.799999999999997 112.857 -176.737 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.405 ' HD3' ' HB3' ' A' ' 35' ' ' LYS . 52.3 Cg_exo -55.72 -37.98 94.86 Favored 'Trans proline' 0 N--CA 1.485 1.019 0 C-N-CA 122.554 2.17 . . . . 27.210000000000001 117.446 178.101 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 35.3 pt -90.25 -12.29 9.66 Favored 'Isoleucine or valine' 0 C--O 1.274 2.382 0 N-CA-C 114.781 1.4 . . . . 23.59 114.781 -177.006 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 30.8 m-85 -86.33 162.64 45.21 Favored Pre-proline 0 C--O 1.21 -0.974 0 CA-C-N 115.716 -0.675 . . . . 26.23 110.578 171.011 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_exo -52.46 149.49 23.41 Favored 'Trans proline' 0 CA--C 1.543 0.933 0 C-N-CA 121.15 1.233 . . . . 24.190000000000001 113.853 162.28 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 31.3 m -65.24 -45.37 84.92 Favored 'General case' 0 C--O 1.243 0.742 0 CA-C-N 115.249 -0.887 . . . . 26.940000000000001 111.048 175.211 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 4.8 t0 -91.37 116.56 28.94 Favored 'General case' 0 C--O 1.235 0.315 0 C-N-CA 124.33 1.052 . . . . 31.390000000000001 109.284 166.773 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 12.5 mt -95.2 8.51 42.83 Favored 'General case' 0 CA--C 1.545 0.769 0 N-CA-C 113.779 1.029 . . . . 24.199999999999999 113.779 178.232 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 98.6 m -51.98 -46.57 64.89 Favored 'General case' 0 CA--C 1.549 0.911 0 N-CA-C 112.246 0.461 . . . . 25.77 112.246 -178.634 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 60.2 mm-40 -76.51 -42.08 44.63 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 112.468 0.544 . . . . 34.649999999999999 112.468 -176.944 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 35.9 m -53.39 -51.64 61.89 Favored 'General case' 0 N--CA 1.479 1.015 0 CA-C-O 121.447 0.642 . . . . 21.960000000000001 111.767 176.416 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -57.31 -36.32 70.95 Favored 'General case' 0 CA--C 1.555 1.143 0 N-CA-C 113.652 0.982 . . . . 20.84 113.652 176.893 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 61.1 ttp85 -65.43 -41.28 93.69 Favored 'General case' 0 N--CA 1.464 0.232 0 N-CA-C 110.196 -0.298 . . . . 39.109999999999999 110.196 179.456 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.636 ' NZ ' ' O1D' ' A' ' 700' ' ' HEM . 17.8 mtmt -74.26 -30.44 62.13 Favored 'General case' 0 C--O 1.21 -0.991 0 N-CA-C 115.295 1.591 . . . . 27.649999999999999 115.295 178.485 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 19.7 tp60 -72.27 -28.46 63.14 Favored 'General case' 0 C--O 1.213 -0.849 0 N-CA-C 109.602 -0.518 . . . . 25.079999999999998 109.602 175.151 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 61.2 mttt -73.09 -51.23 18.81 Favored 'General case' 0 CA--C 1.512 -0.517 0 N-CA-C 107.049 -1.463 . . . . 24.43 107.049 -178.592 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.712 ' OE1' ' NE2' ' A' ' 67' ' ' HIS . 90.9 mt-30 -49.99 -50.85 45.72 Favored 'General case' 0 C--O 1.252 1.209 0 CA-C-O 121.863 0.839 . . . . 27.449999999999999 110.273 169.438 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 90.8 t80 -63.95 -47.24 81.21 Favored 'General case' 0 CA--C 1.508 -0.663 0 C-N-CA 117.193 -1.803 . . . . 22.109999999999999 110.517 -175.024 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 88.6 mt -65.71 -27.8 68.59 Favored 'General case' 0 CA--C 1.557 1.241 0 C-N-CA 118.849 -1.14 . . . . 20.699999999999999 112.927 -176.361 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 66.4 m -59.28 -51.67 68.95 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.154 -0.475 . . . . 20.190000000000001 109.929 173.202 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 32.1 tt0 -60.31 -40.49 90.73 Favored 'General case' 0 CA--C 1.545 0.77 0 CA-C-O 121.895 0.855 . . . . 25.25 113.087 177.368 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' TYR . . . . . 0.591 ' CE1' HD13 ' A' ' 114' ' ' LEU . 47.6 t80 -69.53 -23.62 63.62 Favored 'General case' 0 C--O 1.254 1.306 0 C-N-CA 125.536 1.534 . . . . 23.399999999999999 110.79 -173.453 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 47.7 mt -99.82 18.91 17.07 Favored 'General case' 0 C--O 1.216 -0.66 0 O-C-N 124.622 1.201 . . . . 24.0 110.96 -179.53 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 76.5 6.21 83.85 Favored Glycine 0 CA--C 1.525 0.677 0 N-CA-C 117.073 1.589 . . . . 24.539999999999999 117.073 179.156 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -77.12 -164.79 22.13 Favored Glycine 0 C--O 1.205 -1.656 0 N-CA-C 109.412 -1.475 . . . . 24.579999999999998 109.412 176.498 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -59.96 146.41 95.97 Favored 'Trans proline' 0 C--O 1.217 -0.566 0 CA-C-N 118.894 1.347 . . . . 25.550000000000001 110.271 178.685 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' PRO . . . . . 0.41 ' O ' ' HB2' ' A' ' 65' ' ' GLU . 76.0 Cg_endo -76.87 68.67 7.16 Favored 'Trans proline' 0 C--N 1.327 -0.598 0 C-N-CA 121.429 1.419 . . . . 25.629999999999999 113.043 174.583 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.21 -36.5 82.14 Favored 'General case' 0 CA--C 1.51 -0.576 0 O-C-N 124.23 0.957 . . . . 31.859999999999999 111.131 -176.962 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 58.2 t80 -70.16 -56.01 7.92 Favored 'General case' 0 CA--C 1.545 0.773 0 O-C-N 124.347 1.03 . . . . 32.840000000000003 113.719 -174.084 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 100.0 m -53.86 -56.19 19.93 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 122.679 1.228 . . . . 30.039999999999999 110.863 173.859 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.41 ' HB2' ' O ' ' A' ' 61' ' ' PRO . 0.2 OUTLIER -34.34 -35.33 0.03 OUTLIER 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 116.383 1.994 . . . . 34.159999999999997 116.383 168.255 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -111.19 -39.65 4.67 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 115.762 1.764 . . . . 41.359999999999999 115.762 -174.8 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' HIS . . . . . 0.712 ' NE2' ' OE1' ' A' ' 51' ' ' GLN . 29.8 m-70 -110.15 -20.87 12.53 Favored 'General case' 0 CA--C 1.499 -0.994 0 CA-C-N 116.459 -0.337 . . . . 36.670000000000002 111.556 -170.647 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 103.31 178.78 26.2 Favored Glycine 0 N--CA 1.432 -1.594 0 CA-C-O 123.661 1.701 . . . . 35.049999999999997 110.883 -175.548 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' HIS . . . . . 0.483 ' HA ' ' HD3' ' A' ' 70' ' ' PRO . 11.4 t-80 -50.04 129.92 22.68 Favored Pre-proline 0 C--O 1.253 1.247 0 CA-C-N 112.524 -1.838 . . . . 34.25 109.398 -178.954 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' PRO . . . . . 0.535 ' O ' ' HD2' ' A' ' 75' ' ' ARG . 1.3 Cg_endo -78.39 -38.02 0.63 Allowed 'Trans proline' 0 C--O 1.208 -1.003 0 C-N-CA 122.515 2.144 . . . . 34.149999999999999 116.328 -161.636 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' MET . . . . . 0.461 ' C ' ' O ' ' A' ' 70' ' ' PRO . 13.8 ptt? 29.09 66.76 0.1 Allowed 'General case' 0 N--CA 1.466 0.352 0 O-C-N 124.663 1.227 . . . . 38.259999999999998 110.329 171.459 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 11.9 mt -68.51 -37.88 80.45 Favored 'General case' 0 CA--C 1.507 -0.684 0 N-CA-C 112.12 0.415 . . . . 33.619999999999997 112.12 -164.254 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 6.4 ttt85 -57.79 -36.89 72.81 Favored 'General case' 0 N--CA 1.446 -0.626 0 O-C-N 123.61 0.569 . . . . 36.060000000000002 110.731 178.816 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -68.48 -41.04 80.68 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.841 0.829 . . . . 26.600000000000001 111.341 176.916 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' ARG . . . . . 0.535 ' HD2' ' O ' ' A' ' 70' ' ' PRO . 13.1 mtp85 -71.07 -19.47 62.47 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.549 -0.75 . . . . 33.560000000000002 109.61 -171.888 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 8.1 m80 -98.94 -15.65 19.06 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 125.575 1.55 . . . . 32.310000000000002 111.702 -174.398 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.435 ' N ' ' CD ' ' A' ' 78' ' ' PRO . 9.5 mt -59.52 -33.95 19.48 Favored Pre-proline 0 CA--C 1.548 0.881 0 N-CA-C 117.09 2.255 . . . . 29.899999999999999 117.09 -174.185 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' PRO . . . . . 0.435 ' CD ' ' N ' ' A' ' 77' ' ' LEU . 84.1 Cg_exo -57.12 -21.93 45.13 Favored 'Trans proline' 0 CA--C 1.537 0.638 0 C-N-CA 122.408 2.072 . . . . 26.649999999999999 115.319 173.14 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 72.4 m-85 -104.13 153.36 38.98 Favored Pre-proline 0 CA--C 1.515 -0.375 0 N-CA-C 108.326 -0.99 . . . . 27.43 108.326 -169.39 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_endo -87.31 71.55 3.28 Favored 'Trans proline' 0 C--O 1.208 -0.996 0 C-N-CA 122.453 2.102 . . . . 28.489999999999998 113.449 -175.985 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.537 HG22 ' HA ' ' A' ' 122' ' ' VAL . 1.8 mp -81.12 101.42 6.01 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-N 115.788 -0.642 . . . . 28.629999999999999 109.367 -174.514 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 11.3 p -88.08 165.55 15.06 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-N 114.947 -1.024 . . . . 27.859999999999999 110.554 175.66 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 58.9 m-20 -57.2 -36.74 71.22 Favored 'General case' 0 C--O 1.217 -0.623 0 N-CA-C 109.521 -0.548 . . . . 31.18 109.521 170.71 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.405 ' HB3' ' O ' ' A' 2052 ' ' HOH 0.329 0.0 OUTLIER -78.5 -25.36 45.64 Favored 'General case' 0 CA--C 1.545 0.751 0 N-CA-C 109.741 -0.466 . . . . 33.799999999999997 109.741 -173.332 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 15.6 mtt85 -78.93 -38.22 37.82 Favored 'General case' 0 C--O 1.238 0.499 0 C-N-CA 122.939 0.496 . . . . 26.370000000000001 110.46 173.957 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.536 ' HA ' HBB1 ' A' ' 700' ' ' HEM . . . -60.52 -31.75 70.81 Favored 'General case' 0 C--O 1.249 1.03 0 CA-C-O 120.858 0.361 . . . . 21.52 110.255 174.343 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -76.56 -42.94 40.99 Favored 'General case' 0 N--CA 1.44 -0.961 0 CA-C-N 115.209 -0.905 . . . . 25.48 110.628 -178.587 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -57.13 -43.56 82.49 Favored 'General case' 0 CA--C 1.574 1.901 0 N-CA-C 113.466 0.913 . . . . 17.219999999999999 113.466 174.139 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' TRP . . . . . . . . . . . . . 8.8 t90 -58.33 -49.31 77.65 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 124.291 1.036 . . . . 19.629999999999999 109.476 176.855 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.49 -49.72 76.68 Favored 'General case' 0 C--O 1.211 -0.957 0 CA-C-N 114.982 -1.008 . . . . 17.640000000000001 111.439 176.27 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 61.0 m -55.84 -44.82 78.33 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-N 117.705 0.229 . . . . 19.91 111.081 174.04 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 58.2 m -60.42 -38.43 84.04 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 119.167 -1.013 . . . . 17.98 109.642 -179.758 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' MET . . . . . 0.641 ' HE3' HD11 ' A' ' 20' ' ' LEU . 10.1 tpt -73.73 -38.35 64.82 Favored 'General case' 0 C--O 1.218 -0.577 0 CA-C-N 115.613 -0.722 . . . . 27.289999999999999 110.075 -174.147 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 5.3 ttpt -60.49 -45.22 94.56 Favored 'General case' 0 C--O 1.244 0.775 0 CA-C-O 121.848 0.833 . . . . 32.390000000000001 110.933 174.961 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' ASP . . . . . 0.829 ' OD2' ' O ' ' A' 2061 ' ' HOH . 17.0 t70 -60.4 -40.79 92.18 Favored 'General case' 0 C--O 1.242 0.684 0 CA-C-N 114.93 -1.032 . . . . 21.920000000000002 110.97 178.826 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -65.62 -32.94 74.79 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 123.559 0.537 . . . . 18.93 111.579 -177.464 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' MET . . . . . 0.618 ' HE3' ' NE ' ' A' ' 107' ' ' ARG . 4.4 mtm -71.44 -45.92 61.41 Favored 'General case' 0 C--O 1.212 -0.892 0 N-CA-C 108.392 -0.966 . . . . 19.59 108.392 178.927 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 85.3 m-20 -50.97 -45.81 61.01 Favored 'General case' 0 C--O 1.211 -0.959 0 CA-C-O 121.299 0.571 . . . . 23.760000000000002 110.541 174.881 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 13.9 t-80 -63.37 -41.05 98.79 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.885 -0.598 . . . . 28.059999999999999 112.591 -173.321 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 18.4 m -87.06 -6.11 10.48 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.475 0 N-CA-C 109.11 -0.7 . . . . 20.129999999999999 109.11 -177.212 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 76.45 23.52 70.37 Favored Glycine 0 N--CA 1.434 -1.44 0 CA-C-N 115.303 -0.862 . . . . 21.899999999999999 112.355 178.861 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -56.23 130.96 46.55 Favored 'General case' 0 C--O 1.212 -0.894 0 CA-C-N 117.53 0.665 . . . . 28.760000000000002 110.969 171.381 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' GLU . . . . . 0.649 ' OE2' ' O ' ' A' 2065 ' ' HOH . 11.2 pt-20 -153.35 173.2 15.92 Favored 'General case' 0 C--O 1.204 -1.33 0 C-N-CA 122.219 0.208 . . . . 34.340000000000003 110.494 -178.141 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 77.27 -156.68 45.51 Favored Glycine 0 CA--C 1.523 0.532 0 CA-C-O 122.306 0.948 . . . . 25.949999999999999 115.102 173.99 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -76.31 -28.97 57.14 Favored 'General case' 0 C--O 1.208 -1.088 0 O-C-N 121.72 -0.87 . . . . 35.719999999999999 111.965 -164.16 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 7.9 tp -68.92 -33.86 61.29 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.207 0 CA-C-N 116.074 -0.512 . . . . 25.199999999999999 112.036 173.44 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' ARG . . . . . 0.618 ' NE ' ' HE3' ' A' ' 97' ' ' MET . 50.3 ttt180 -67.92 -43.53 78.98 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 112.319 0.489 . . . . 25.98 112.319 171.622 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 85.7 mt-10 -60.85 -35.19 75.92 Favored 'General case' 0 C--O 1.216 -0.706 0 N-CA-C 114.029 1.122 . . . . 25.699999999999999 114.029 174.117 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 44.2 t80 -80.96 -48.52 12.16 Favored 'General case' 0 C--O 1.206 -1.225 0 N-CA-C 107.703 -1.221 . . . . 24.09 107.703 -173.425 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 24.0 tp -57.85 -53.68 55.42 Favored 'General case' 0 N--CA 1.481 1.095 0 CA-C-O 122.991 1.377 . . . . 23.059999999999999 113.635 178.968 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 31.1 t80 -66.32 -38.58 88.03 Favored 'General case' 0 N--CA 1.44 -0.94 0 CA-C-N 114.274 -1.33 . . . . 20.73 112.423 -176.481 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -64.83 -36.24 92.87 Favored Glycine 0 C--O 1.208 -1.522 0 C-N-CA 120.649 -0.786 . . . . 21.32 111.499 178.046 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' ARG . . . . . 0.472 HH21 ' CG ' ' A' ' 113' ' ' ARG . 0.0 OUTLIER -71.51 -36.49 71.08 Favored 'General case' 0 C--N 1.319 -0.718 0 O-C-N 122.595 -0.356 . . . . 33.609999999999999 110.962 175.889 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.591 HD13 ' CE1' ' A' ' 56' ' ' TYR . 0.0 OUTLIER -68.75 -37.98 79.79 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-O 121.628 0.728 . . . . 23.469999999999999 109.947 -177.17 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 57.2 mt-10 -58.56 -45.43 89.02 Favored 'General case' 0 C--O 1.212 -0.889 0 CA-C-N 115.278 -0.874 . . . . 23.739999999999998 110.411 174.678 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.412 ' O ' ' HG3' ' A' ' 119' ' ' ARG . 0.0 OUTLIER -69.68 -30.94 68.73 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-O 121.408 0.623 . . . . 22.719999999999999 110.269 -179.531 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 51.9 m -78.29 -39.13 40.81 Favored 'General case' 0 C--N 1.318 -0.792 0 O-C-N 121.189 -0.944 . . . . 24.370000000000001 111.225 -175.643 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -69.59 -35.83 75.67 Favored 'General case' 0 C--O 1.218 -0.561 0 N-CA-C 108.13 -1.063 . . . . 29.039999999999999 108.13 -174.393 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' ARG . . . . . 0.412 ' HG3' ' O ' ' A' ' 116' ' ' LEU . 1.4 ptp85 -68.75 -36.19 78.05 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 120.118 -0.633 . . . . 48.200000000000003 110.063 177.208 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 15.2 t60 -66.88 -17.56 64.95 Favored 'General case' 0 CA--C 1.554 1.126 0 CA-C-O 119.702 -0.189 . . . . 34.240000000000002 111.286 175.331 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' MET . . . . . . . . . . . . . 25.0 mmt -77.64 -31.16 52.57 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 113.928 1.085 . . . . 30.059999999999999 113.928 175.208 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' VAL . . . . . 0.537 ' HA ' HG22 ' A' ' 81' ' ' ILE . 94.0 t -43.47 121.39 0.47 Allowed 'Isoleucine or valine' 0 CA--C 1.55 0.97 0 C-N-CA 124.141 0.976 . . . . 27.640000000000001 113.07 175.691 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 27.0 p30 -135.1 -163.08 1.33 Allowed 'General case' 0 CA--C 1.518 -0.271 0 CA-C-O 119.133 -0.46 . . . . 29.719999999999999 112.105 -176.934 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' GLN . . . . . 0.484 ' N ' ' O ' ' A' 2076 ' ' HOH . . . . . . . . 1 C--N 1.239 -4.22 0 CA-C-N 118.498 0.59 . . . . 30.300000000000001 . . . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 700' ' ' HEM . . . . . 0.636 ' O1D' ' NZ ' ' A' ' 48' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1124 ' ' CYN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1125 ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2001 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2002 ' ' HOH . . . . . 0.533 ' O ' ' HA ' ' A' ' 6' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 2003 ' ' HOH . . . . . 0.481 ' O ' ' N ' ' A' ' 6' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 2004 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2005 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2006 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2007 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2008 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2009 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2010 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2011 ' ' HOH . . . . . 0.569 ' O ' ' OE2' ' A' ' 15' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 2012 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2013 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2014 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2015 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2016 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2017 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2018 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2019 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2020 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2021 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2022 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2023 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2024 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2025 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2026 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2027 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2028 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2029 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2030 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2031 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2032 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2033 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2034 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2035 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2036 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2037 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2038 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2039 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2040 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2041 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2042 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2043 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2044 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2045 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2046 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2047 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2048 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2049 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2050 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2051 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2052 ' ' HOH . . . . . 0.405 ' O ' ' HB3' ' A' ' 84' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 2053 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2054 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2055 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2056 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2057 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2058 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2059 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2060 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2061 ' ' HOH . . . . . 0.829 ' O ' ' OD2' ' A' ' 95' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 2062 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2063 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2064 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2065 ' ' HOH . . . . . 0.649 ' O ' ' OE2' ' A' ' 103' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 2066 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2067 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2068 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2069 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2070 ' ' HOH . . . . . 0.47 ' O ' ' NH2' ' A' ' 113' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 2071 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2072 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2073 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2074 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2075 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2076 ' ' HOH . . . . . 0.484 ' O ' ' N ' ' A' ' 124' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 2077 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_