data_3rto_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 3rto _Structure_validation_residue.Date_analyzed 2016-10-12 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 ecloud orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.39 0 CA-C-O 119.958 -0.357 . . . . 43.409999999999997 113.112 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' ILE . . . . . 0.415 ' CG2' ' N ' ' A' ' 3' ' ' VAL . 8.1 tp -55.27 -49.75 70.04 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.098 0 O-C-N 126.196 1.762 . . . . 43.369999999999997 111.117 -173.914 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' VAL . . . . . 0.415 ' N ' ' CG2' ' A' ' 2' ' ' ILE . 63.5 t -58.64 -45.54 90.65 Favored 'Isoleucine or valine' 0 C--O 1.256 1.405 0 C-N-CA 118.153 -1.419 . . . . 46.32 107.717 -175.973 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 12.0 mp0 -67.3 -57.17 7.14 Favored 'General case' 0 N--CA 1.48 1.07 0 CA-C-N 114.117 -1.401 . . . . 49.829999999999998 111.242 -174.376 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -45.64 -50.84 13.03 Favored 'General case' 0 CA--C 1.556 1.209 0 N-CA-C 119.277 3.066 . . . . 57.969999999999999 119.277 170.288 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 92.7 m -64.94 -31.57 72.86 Favored 'General case' 0 N--CA 1.482 1.172 0 CA-C-N 119.299 0.954 . . . . 37.219999999999999 110.71 -177.578 -70.057 -70.519 99.269 105.749 2.043 104.549 -155.53 72.429 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 20.2 t -88.81 -48.9 7.16 Favored 'General case' 0 N--CA 1.423 -1.811 0 N-CA-C 114.376 1.25 . . . . 46.509999999999998 114.376 178.802 -168.486 51.734 97.834 109.26 2.066 104.957 -79.472 -68.7 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 10.6 p -82.21 -27.22 32.68 Favored 'General case' 0 C--O 1.251 1.166 0 C-N-CA 116.101 -2.239 . . . . 49.909999999999997 111.459 -176.849 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 16.5 t -114.16 -121.6 0.3 Allowed 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 119.612 -0.835 . . . . 44.799999999999997 113.152 170.93 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -146.62 151.84 13.89 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.426 0 N-CA-C 106.485 -1.672 . . . . 46.130000000000003 106.485 178.77 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 17.0 p -145.01 167.37 22.82 Favored 'General case' 0 C--N 1.35 0.624 0 C-N-CA 120.048 -0.661 . . . . 35.32 112.225 176.215 72.429 -155.53 99.269 104.549 2.043 105.749 -70.519 -70.057 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 96.2 p -113.51 160.72 18.19 Favored 'General case' 0 CA--C 1.493 -1.238 0 CA-C-O 121.156 0.503 . . . . 31.710000000000001 110.715 -174.632 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 41.9 mt -63.06 -29.8 71.1 Favored 'General case' 0 N--CA 1.483 1.216 0 N-CA-C 107.537 -1.283 . . . . 35.68 107.537 179.609 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 99.6 m-85 -68.47 -33.75 74.72 Favored 'General case' 0 C--O 1.248 1.003 0 C-N-CA 117.806 -1.558 . . . . 41.390000000000001 112.685 178.181 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 95.4 mt-30 -64.19 -36.46 84.13 Favored 'General case' 0 N--CA 1.484 1.238 0 O-C-N 121.773 -0.58 . . . . 45.460000000000001 111.369 172.786 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 32.2 mt -67.03 -29.17 68.91 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 116.388 -0.369 . . . . 36.509999999999998 110.284 -179.243 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -61.93 -18.11 59.15 Favored 'General case' 0 CA--C 1.49 -1.345 0 C-N-CA 118.447 -1.301 . . . . 52.68 112.245 -179.988 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 70.0 m-20 -66.17 -13.15 59.74 Favored 'General case' 0 C--O 1.26 1.635 0 C-N-CA 120.074 -0.651 . . . . 48.439999999999998 111.873 -179.279 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 96.8 m-85 -104.87 -0.03 27.51 Favored 'General case' 0 CA--C 1.505 -0.754 0 N-CA-C 114.805 1.409 . . . . 53.380000000000003 114.805 -173.991 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 19.9 m -72.38 157.88 36.82 Favored 'General case' 0 N--CA 1.477 0.909 0 O-C-N 123.795 0.684 . . . . 36.380000000000003 109.953 175.188 -47.837 -50.305 -76.428 104.309 2.063 100.721 -65.776 -55.329 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' ASN . . . . . 0.53 ' CG ' ' O ' ' A' ' 44' ' ' HOH . 0.7 OUTLIER . . . . . 0 C--O 1.252 1.204 0 CA-C-O 125.99 2.805 . . . . 54.609999999999999 116.8 172.471 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 16.5 m-85 . . . . . 0 N--CA 1.495 1.812 0 CA-C-O 121.182 0.515 . . . . 60.119999999999997 112.34 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 35.6 m -113.37 157.52 14.03 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.359 0 C-N-CA 125.025 1.33 . . . . 50.759999999999998 109.165 -175.917 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 4.1 m120 -63.34 153.12 36.01 Favored 'General case' 0 CA--C 1.481 -1.701 0 C-N-CA 124.156 0.982 . . . . 53.549999999999997 112.683 171.297 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . 0.288 10.2 mm100 -141.71 145.4 34.83 Favored 'General case' 0 N--CA 1.478 0.957 0 CA-C-O 116.63 -1.652 . . . . 36.619999999999997 111.278 -164.378 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 17.9 t-80 -100.41 108.05 19.95 Favored 'General case' 0 N--CA 1.421 -1.876 0 CA-C-N 120.104 1.32 . . . . 48.439999999999998 108.521 166.774 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 21.8 mt -128.2 114.27 16.76 Favored 'General case' 0 C--O 1.254 1.329 0 CA-C-N 119.818 1.19 . . . . 31.640000000000001 112.323 -169.055 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 94.0 m -119.64 144.74 46.99 Favored 'General case' 0 N--CA 1.424 -1.734 0 CA-C-N 115.25 -0.886 . . . . 40.700000000000003 110.08 -176.857 -68.7 -79.472 97.834 104.957 2.066 109.26 51.734 -168.486 1 1 . 1 . 001 ecloud orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 66.12 -138.35 36.77 Favored Glycine 0 C--O 1.252 1.257 0 CA-C-O 122.184 0.88 . . . . 31.57 113.886 169.797 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 58.0 p -60.13 -21.25 61.35 Favored 'General case' 0 C--O 1.205 -1.284 0 N-CA-C 115.045 1.498 . . . . 35.200000000000003 115.045 177.887 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 98.8 m-70 -66.8 -33.4 75.53 Favored 'General case' 0 C--O 1.242 0.691 0 C-N-CA 124.059 0.944 . . . . 27.940000000000001 111.346 178.055 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 21.4 tp -70.05 -39.96 75.4 Favored 'General case' 0 C--O 1.217 -0.627 0 N-CA-C 108.504 -0.925 . . . . 28.219999999999999 108.504 176.381 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 12' ' ' VAL . . . . . 1.048 ' CG1' ' CG1' ' D' ' 12' ' ' VAL . 12.3 t -66.53 -35.06 73.95 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.936 0 C-N-CA 118.675 -1.21 . . . . 30.460000000000001 112.261 -179.75 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 13' ' ' GLU . . . . . 1.103 ' OE2' ' O ' ' B' ' 38' ' ' HOH . 50.7 mt-10 -64.47 -36.98 85.96 Favored 'General case' 0 N--CA 1.486 1.338 0 O-C-N 121.293 -0.879 . . . . 34.619999999999997 109.014 176.119 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.34 -40.07 81.68 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 119.215 -0.994 . . . . 23.350000000000001 112.843 -179.928 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 57.7 mt -59.24 -46.39 88.6 Favored 'General case' 0 CA--C 1.547 0.852 0 CA-C-N 116.154 -0.476 . . . . 24.760000000000002 111.677 174.344 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 88.1 t80 -55.97 -45.42 78.93 Favored 'General case' 0 N--CA 1.434 -1.248 0 CA-C-O 118.211 -0.9 . . . . 37.719999999999999 109.843 176.782 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 52.7 mt -63.94 -46.91 82.59 Favored 'General case' 0 C--O 1.264 1.845 0 O-C-N 124.128 0.892 . . . . 26.960000000000001 111.34 -178.745 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 73.8 t -65.96 -41.43 89.81 Favored 'Isoleucine or valine' 0 C--O 1.252 1.216 0 N-CA-C 115.436 1.643 . . . . 30.039999999999999 115.436 179.485 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 59.6 m -96.83 -37.14 10.37 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 123.623 0.577 . . . . 35.390000000000001 112.183 -169.289 -55.329 -65.776 -76.428 100.721 2.063 104.309 -50.305 -47.837 1 1 . 1 . 001 ecloud orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 56.09 -134.71 50.18 Favored Glycine 0 CA--C 1.536 1.379 0 C-N-CA 120.051 -1.071 . . . . 38.310000000000002 113.174 179.892 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 26.7 mp0 -69.57 -11.24 60.68 Favored 'General case' 0 C--O 1.207 -1.142 0 C-N-CA 126.558 1.943 . . . . 41.829999999999998 111.709 -175.983 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 1.2 ttt-85 -64.16 -26.7 68.65 Favored 'General case' 0 N--CA 1.428 -1.553 0 CA-C-N 115.479 -0.782 . . . . 65.230000000000004 110.436 179.696 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.14 -179.97 41.41 Favored Glycine 0 C--N 1.351 1.371 0 C-N-CA 124.443 1.021 . . . . 34.789999999999999 113.703 -171.694 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 33.5 p90 -164.08 160.71 21.91 Favored 'General case' 0 C--O 1.24 0.594 0 CA-C-O 121.787 0.803 . . . . 29.57 112.383 -174.569 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 15.1 m-85 -109.58 136.6 48.7 Favored 'General case' 0 C--O 1.257 1.449 0 N-CA-C 107.499 -1.297 . . . . 46.009999999999998 107.499 173.098 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 75.2 t80 -110.56 109.11 19.3 Favored 'General case' 0 N--CA 1.495 1.784 0 N-CA-C 106.772 -1.566 . . . . 34.979999999999997 106.772 173.266 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 26.3 p -132.52 86.82 43.9 Favored Pre-proline 0 CA--C 1.544 0.712 0 C-N-CA 118.799 -1.161 . . . . 44.609999999999999 111.273 -170.328 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 5.0 Cg_exo -69.31 138.9 40.41 Favored 'Trans proline' 0 N--CA 1.452 -0.916 0 O-C-N 123.714 1.376 . . . . 48.159999999999997 108.69 177.959 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 29' ' ' LYS . . . . . 0.835 ' O ' ' O ' ' B' ' 30' ' ' ALA . 56.1 tttt -38.55 149.54 0.04 OUTLIER 'General case' 0 C--O 1.256 1.431 0 N-CA-C 108.995 -0.742 . . . . 63.25 108.995 155.58 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 30' ' ' ALA . . . . . 0.835 ' O ' ' O ' ' B' ' 29' ' ' LYS . . . . . . . . 0 CA--C 1.577 2.019 0 O-C-N 117.762 -3.086 . . . . 57.32 117.769 160.569 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 1' ' ' GLY . . . . . 0.669 ' N ' ' OE2' ' C' ' 4' ' ' GLU . . . . . . . . 0 N--CA 1.496 2.674 0 N-CA-C 110.679 -0.968 . . . . 41.789999999999999 110.679 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 2' ' ' ILE . . . . . . . . . . . . . 15.5 tt -50.36 -44.25 23.56 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 N-CA-C 115.05 1.5 . . . . 39.149999999999999 115.05 -177.295 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 3' ' ' VAL . . . . . . . . . . . . . 72.4 t -62.26 -48.8 86.71 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.823 0 CA-C-O 121.406 0.622 . . . . 40.920000000000002 109.413 -178.408 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 4' ' ' GLU . . . . . 0.669 ' OE2' ' N ' ' C' ' 1' ' ' GLY . 32.1 mp0 -60.89 -44.93 96.44 Favored 'General case' 0 C--O 1.21 -1.007 0 CA-C-N 115.332 -0.849 . . . . 55.359999999999999 111.737 178.352 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 5' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -68.34 -38.84 81.89 Favored 'General case' 0 C--N 1.311 -1.078 0 N-CA-C 117.032 2.234 . . . . 59.659999999999997 117.032 176.757 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 6' ' ' CYS . . . . . . . . . . . . . 66.1 m -110.03 -23.18 11.45 Favored 'General case' 0 CA--C 1.506 -0.747 0 N-CA-C 113.301 0.852 . . . . 42.659999999999997 113.301 -163.542 -72.687 -70.951 107.978 101.388 2.079 100.676 -158.686 72.903 1 1 . 1 . 001 ecloud orig full ' C' C ' 7' ' ' CYS . . . . . . . . . . . . . 43.7 t -104.57 -52.37 2.9 Favored 'General case' 0 CA--C 1.562 1.428 0 N-CA-C 114.201 1.186 . . . . 43.090000000000003 114.201 176.306 -176.784 64.646 98.641 107.459 2.043 103.598 -84.027 -59.257 1 1 . 1 . 001 ecloud orig full ' C' C ' 8' ' ' THR . . . . . . . . . . . . . 6.8 t -68.31 -52.24 35.72 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 117.722 -1.591 . . . . 54.579999999999998 110.742 176.332 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 9' ' ' SER . . . . . . . . . . . . . 22.7 t -88.79 -156.67 0.4 Allowed 'General case' 0 N--CA 1.414 -2.253 0 CA-C-N 114.088 -1.415 . . . . 45.950000000000003 108.762 172.818 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 10' ' ' ILE . . . . . 0.625 ' CD1' ' CD2' ' D' ' 5' ' ' HIS . 0.9 OUTLIER -127.3 145.25 35.11 Favored 'Isoleucine or valine' 0 N--CA 1.415 -2.212 0 N-CA-C 106.142 -1.799 . . . . 43.990000000000002 106.142 -174.681 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' C' C ' 11' ' ' CYS . . . . . . . . . . . . . 16.4 p -140.0 157.8 45.09 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 117.343 -1.743 . . . . 44.869999999999997 111.508 179.563 72.903 -158.686 107.978 100.676 2.079 101.388 -70.951 -72.687 1 1 . 1 . 001 ecloud orig full ' C' C ' 12' ' ' SER . . . . . . . . . . . . . 78.5 p -93.61 164.0 13.34 Favored 'General case' 0 N--CA 1.464 0.228 0 O-C-N 123.423 0.452 . . . . 41.049999999999997 110.704 -178.647 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 13' ' ' LEU . . . . . . . . . . . . . 23.4 mt -61.17 -33.34 73.28 Favored 'General case' 0 C--O 1.266 1.969 0 CA-C-O 122.124 0.964 . . . . 44.130000000000003 111.256 175.326 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 14' ' ' TYR . . . . . . . . . . . . . 77.3 m-85 -60.03 -40.54 89.68 Favored 'General case' 0 N--CA 1.444 -0.759 0 N-CA-C 115.125 1.528 . . . . 56.210000000000001 115.125 172.696 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 15' ' ' GLN . . . . . . . . . . . . . 37.0 mt-30 -64.56 -37.87 89.05 Favored 'General case' 0 C--O 1.213 -0.854 0 CA-C-O 117.56 -1.21 . . . . 53.979999999999997 107.949 176.353 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 16' ' ' LEU . . . . . . . . . . . . . 61.8 mt -59.74 -32.78 70.87 Favored 'General case' 0 C--O 1.249 1.034 0 N-CA-C 114.945 1.461 . . . . 36.960000000000001 114.945 -179.148 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 17' ' ' GLU . . . . . . . . . . . . . 27.5 mt-10 -57.63 -16.52 10.74 Favored 'General case' 0 C--O 1.207 -1.138 0 N-CA-C 113.7 1.0 . . . . 51.399999999999999 113.7 174.588 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 18' ' ' ASN . . . . . . . . . . . . . 95.9 m-20 -68.68 -16.26 63.77 Favored 'General case' 0 CA--C 1.504 -0.797 0 O-C-N 120.877 -1.139 . . . . 39.25 111.853 178.79 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 19' ' ' TYR . . . . . . . . . . . . . 68.5 m-85 -104.02 9.35 36.55 Favored 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 113.382 0.882 . . . . 38.219999999999999 113.382 -177.148 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 20' ' ' CYS . . . . . . . . . . . . . 56.6 m -76.83 148.71 36.38 Favored 'General case' 0 C--N 1.322 -0.59 0 C-N-CA 120.319 -0.552 . . . . 38.479999999999997 110.425 171.942 -53.964 -46.801 -79.004 108.288 2.015 105.266 -68.111 -57.137 1 1 . 1 . 001 ecloud orig full ' C' C ' 21' ' ' ASN . . . . . . . . . . . . . 8.2 m120 . . . . . 0 CA--C 1.478 -1.814 0 N-CA-C 105.636 -1.986 . . . . 53.090000000000003 105.636 -178.41 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 1' ' ' PHE . . . . . . . . . . . . . 36.7 m-85 . . . . . 0 N--CA 1.502 2.175 0 CA-C-O 121.392 0.615 . . . . 57.490000000000002 109.422 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 2' ' ' VAL . . . . . . . . . . . . . 1.1 t -122.84 156.68 28.29 Favored 'Isoleucine or valine' 0 C--O 1.258 1.516 0 N-CA-C 108.065 -1.087 . . . . 56.130000000000003 108.065 -174.518 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 3' ' ' ASN . . . . . . . . . . . . . 41.3 m-20 -78.4 123.48 27.05 Favored 'General case' 0 C--O 1.215 -0.726 0 N-CA-C 114.802 1.408 . . . . 56.340000000000003 114.802 170.552 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 4' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -115.47 146.86 41.27 Favored 'General case' 0 N--CA 1.49 1.549 0 CA-C-N 120.488 1.495 . . . . 46.740000000000002 113.928 178.945 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 5' ' ' HIS . . . . . 0.625 ' CD2' ' CD1' ' C' ' 10' ' ' ILE . 32.0 m-70 -81.15 119.81 24.06 Favored 'General case' 0 N--CA 1.49 1.552 0 N-CA-C 103.22 -2.882 . . . . 43.140000000000001 103.22 169.534 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 6' ' ' LEU . . . . . . . . . . . . . 37.2 mt -128.61 115.99 18.92 Favored 'General case' 0 N--CA 1.487 1.415 0 CA-C-O 121.804 0.811 . . . . 33.579999999999998 111.31 -177.551 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 7' ' ' CYS . . . . . . . . . . . . . 82.5 m -130.68 151.64 50.91 Favored 'General case' 0 N--CA 1.412 -2.34 0 CA-C-N 114.62 -1.173 . . . . 45.490000000000002 112.525 -171.905 -59.257 -84.027 98.641 103.598 2.043 107.459 64.646 -176.784 1 1 . 1 . 001 ecloud orig full ' D' D ' 8' ' ' GLY . . . . . . . . . . . . . . . 54.91 -129.13 44.82 Favored Glycine 0 C--O 1.264 1.999 0 O-C-N 125.771 1.919 . . . . 33.729999999999997 111.358 173.009 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 9' ' ' SER . . . . . . . . . . . . . 71.6 p -65.88 -26.15 67.5 Favored 'General case' 0 C--O 1.199 -1.588 0 C-N-CA 116.55 -2.06 . . . . 33.859999999999999 112.941 -178.554 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 10' ' ' HIS . . . . . . . . . . . . . 91.5 m-70 -60.78 -34.43 74.46 Favored 'General case' 0 C--O 1.252 1.217 0 N-CA-C 114.326 1.232 . . . . 27.399999999999999 114.326 176.385 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 11' ' ' LEU . . . . . . . . . . . . . 17.6 tp -66.63 -45.15 79.98 Favored 'General case' 0 C--O 1.214 -0.784 0 O-C-N 124.732 1.27 . . . . 27.93 109.14 178.288 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 12' ' ' VAL . . . . . 1.048 ' CG1' ' CG1' ' B' ' 12' ' ' VAL . 53.2 t -64.13 -37.13 79.07 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.31 0 N-CA-C 114.503 1.297 . . . . 31.620000000000001 114.503 176.503 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 13' ' ' GLU . . . . . . . . . . . . . 17.8 mm-40 -61.38 -39.56 91.11 Favored 'General case' 0 N--CA 1.51 2.544 0 CA-C-N 119.393 0.997 . . . . 56.68 110.807 173.134 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.71 -44.28 94.09 Favored 'General case' 0 C--O 1.222 -0.345 0 O-C-N 121.619 -0.676 . . . . 25.27 110.972 179.889 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 15' ' ' LEU . . . . . . . . . . . . . 62.4 mt -60.64 -41.01 94.08 Favored 'General case' 0 C--O 1.248 1.026 0 CA-C-O 119.335 -0.364 . . . . 28.75 111.767 174.829 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 16' ' ' TYR . . . . . . . . . . . . . 80.1 t80 -60.76 -44.68 96.41 Favored 'General case' 0 C--O 1.264 1.86 0 C-N-CA 119.749 -0.78 . . . . 36.149999999999999 111.226 176.482 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 17' ' ' LEU . . . . . . . . . . . . . 6.6 mt -62.72 -45.66 91.72 Favored 'General case' 0 C--O 1.259 1.589 0 C-N-CA 120.808 -0.357 . . . . 29.41 111.71 -177.973 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 18' ' ' VAL . . . . . . . . . . . . . 23.2 t -73.06 -41.06 59.38 Favored 'Isoleucine or valine' 0 C--O 1.264 1.816 0 O-C-N 123.786 0.679 . . . . 32.539999999999999 110.696 -175.524 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 19' ' ' CYS . . . . . . . . . . . . . 63.6 m -94.84 -40.36 9.77 Favored 'General case' 0 N--CA 1.486 1.363 0 N-CA-C 113.419 0.896 . . . . 32.829999999999998 113.419 -170.551 -57.137 -68.111 -79.004 105.266 2.015 108.288 -46.801 -53.964 1 1 . 1 . 001 ecloud orig full ' D' D ' 20' ' ' GLY . . . . . . . . . . . . . . . 47.81 -119.51 5.19 Favored Glycine 0 C--O 1.269 2.342 0 O-C-N 124.463 1.102 . . . . 37.450000000000003 112.596 179.294 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 21' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -61.7 -28.42 69.4 Favored 'General case' 0 C--O 1.25 1.105 0 CA-C-N 113.255 -1.473 . . . . 63.240000000000002 111.98 -170.273 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 22' ' ' ARG . . . . . . . . . . . . . 47.7 mtm180 -67.43 -26.12 66.26 Favored 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 113.053 0.76 . . . . 40.079999999999998 113.053 176.022 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 23' ' ' GLY . . . . . . . . . . . . . . . 79.68 177.12 50.05 Favored Glycine 0 C--O 1.212 -1.244 0 N-CA-C 107.573 -2.211 . . . . 32.780000000000001 107.573 -176.91 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 24' ' ' PHE . . . . . . . . . . . . . 33.2 p90 -158.38 166.0 33.32 Favored 'General case' 0 N--CA 1.485 1.298 0 O-C-N 124.378 0.693 . . . . 26.629999999999999 111.301 -173.403 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 25' ' ' PHE . . . . . . . . . . . . . 6.1 p90 -121.39 140.58 51.95 Favored 'General case' 0 C--N 1.35 0.599 0 N-CA-C 108.484 -0.932 . . . . 33.490000000000002 108.484 166.902 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 26' ' ' TYR . . . . . . . . . . . . . 56.5 t80 -113.49 108.02 16.62 Favored 'General case' 0 N--CA 1.428 -1.558 0 O-C-N 125.697 1.873 . . . . 36.090000000000003 108.473 173.305 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 27' ' ' THR . . . . . . . . . . . . . 17.6 p -132.81 82.74 54.91 Favored Pre-proline 0 N--CA 1.483 1.22 0 CA-C-O 118.004 -0.998 . . . . 32.079999999999998 110.668 -172.562 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 28' ' ' PRO . . . . . . . . . . . . . 22.3 Cg_endo -73.35 -11.82 24.91 Favored 'Trans proline' 0 C--N 1.356 0.93 0 O-C-N 123.681 1.359 . . . . 39.0 112.01 -169.838 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 29' ' ' LYS . . . . . . . . . . . . . 40.7 mttm -71.77 -31.91 67.11 Favored 'General case' 0 N--CA 1.485 1.309 0 CA-C-O 122.438 1.113 . . . . 56.460000000000001 111.342 175.673 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 30' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.109 0 CA-C-N 115.223 -0.899 . . . . 51.899999999999999 109.162 -171.236 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' HOH . . . . . 0.53 ' O ' ' CG ' ' A' ' 21' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 32' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 33' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 34' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 35' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 36' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 37' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 38' ' ' HOH . . . . . 1.103 ' O ' ' OE2' ' B' ' 13' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 39' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 40' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 41' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 42' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 43' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 44' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 45' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 22' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 24' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 32' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 39' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 45' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 32' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 33' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 34' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 35' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 36' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 37' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 38' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 39' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 40' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 41' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 42' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 43' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 44' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 45' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 46' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 47' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 48' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 49' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 50' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.39 0 CA-C-O 119.958 -0.357 . . . . 43.41 113.112 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 2' ' ' ILE . . . . . 0.57 HG23 ' N ' ' A' ' 3' ' ' VAL . 8.1 tp -55.27 -49.75 70.04 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.098 0 O-C-N 126.196 1.762 . . . . 43.82 111.117 -173.914 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 3' ' ' VAL . . . . . 0.57 ' N ' HG23 ' A' ' 2' ' ' ILE . 63.5 t -58.64 -45.54 90.65 Favored 'Isoleucine or valine' 0 C--O 1.256 1.405 0 C-N-CA 118.153 -1.419 . . . . 46.32 107.717 -175.973 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 12.0 mp0 -67.3 -57.17 7.14 Favored 'General case' 0 N--CA 1.48 1.07 0 CA-C-N 114.117 -1.401 . . . . 49.83 111.242 -174.376 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -45.64 -50.84 13.03 Favored 'General case' 0 CA--C 1.556 1.209 0 N-CA-C 119.277 3.066 . . . . 57.97 119.277 170.288 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 92.7 m -64.94 -31.57 72.86 Favored 'General case' 0 N--CA 1.482 1.172 0 CA-C-N 119.299 0.954 . . . . 37.22 110.71 -177.578 -70.057 -70.519 99.269 105.749 2.043 104.549 -155.53 72.429 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 20.2 t -88.81 -48.9 7.16 Favored 'General case' 0 N--CA 1.423 -1.811 0 N-CA-C 114.376 1.25 . . . . 46.51 114.376 178.802 -168.486 51.734 97.834 109.26 2.066 104.957 -79.472 -68.7 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 10.6 p -82.21 -27.22 32.68 Favored 'General case' 0 C--O 1.251 1.166 0 C-N-CA 116.101 -2.239 . . . . 49.91 111.459 -176.849 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 16.5 t -114.16 -121.6 0.3 Allowed 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 119.612 -0.835 . . . . 44.8 113.152 170.93 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -146.62 151.84 13.89 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.426 0 N-CA-C 106.485 -1.672 . . . . 46.13 106.485 178.77 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 17.0 p -145.01 167.37 22.82 Favored 'General case' 0 C--N 1.35 0.624 0 C-N-CA 120.048 -0.661 . . . . 35.32 112.225 176.215 72.429 -155.53 99.269 104.549 2.043 105.749 -70.519 -70.057 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 96.2 p -113.51 160.72 18.19 Favored 'General case' 0 CA--C 1.493 -1.238 0 CA-C-O 121.156 0.503 . . . . 31.71 110.715 -174.632 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 41.9 mt -63.06 -29.8 71.1 Favored 'General case' 0 N--CA 1.483 1.216 0 N-CA-C 107.537 -1.283 . . . . 35.68 107.537 179.609 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 99.6 m-85 -68.47 -33.75 74.72 Favored 'General case' 0 C--O 1.248 1.003 0 C-N-CA 117.806 -1.558 . . . . 41.39 112.685 178.181 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 95.4 mt-30 -64.19 -36.46 84.13 Favored 'General case' 0 N--CA 1.484 1.238 0 O-C-N 121.773 -0.58 . . . . 45.46 111.369 172.786 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 32.2 mt -67.03 -29.17 68.91 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 116.388 -0.369 . . . . 36.51 110.284 -179.243 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -61.93 -18.11 59.15 Favored 'General case' 0 CA--C 1.49 -1.345 0 C-N-CA 118.447 -1.301 . . . . 52.68 112.245 -179.988 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 70.0 m-20 -66.17 -13.15 59.74 Favored 'General case' 0 C--O 1.26 1.635 0 C-N-CA 120.074 -0.651 . . . . 48.44 111.873 -179.279 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' TYR . . . . . 0.49 ' CZ ' ' HB ' ' A' ' 2' ' ' ILE . 96.8 m-85 -104.87 -0.03 27.51 Favored 'General case' 0 CA--C 1.505 -0.754 0 N-CA-C 114.805 1.409 . . . . 53.38 114.805 -173.991 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 19.9 m -72.38 157.88 36.82 Favored 'General case' 0 N--CA 1.477 0.909 0 O-C-N 123.795 0.684 . . . . 36.38 109.953 175.188 -47.837 -50.305 -76.428 104.309 2.063 100.721 -65.776 -55.329 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' ASN . . . . . 0.569 ' HB2' ' O ' ' A' ' 44' ' ' HOH . 0.7 OUTLIER . . . . . 0 C--O 1.252 1.204 0 CA-C-O 125.99 2.805 . . . . 54.61 116.8 172.471 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 16.5 m-85 . . . . . 0 N--CA 1.495 1.812 0 CA-C-O 121.182 0.515 . . . . 60.12 112.34 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 35.6 m -113.37 157.52 14.03 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.359 0 C-N-CA 125.025 1.33 . . . . 50.76 109.165 -175.917 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 73.4 m-20 -63.34 153.12 36.01 Favored 'General case' 0 CA--C 1.481 -1.701 0 C-N-CA 124.156 0.982 . . . . 53.55 112.683 171.297 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . 0.288 64.0 mm-40 -141.71 145.4 34.83 Favored 'General case' 0 N--CA 1.478 0.957 0 CA-C-O 116.63 -1.652 . . . . 36.62 111.278 -164.378 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 17.9 t-80 -100.41 108.05 19.95 Favored 'General case' 0 N--CA 1.421 -1.876 0 CA-C-N 120.104 1.32 . . . . 48.44 108.521 166.774 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 21.8 mt -128.2 114.27 16.76 Favored 'General case' 0 C--O 1.254 1.329 0 CA-C-N 119.818 1.19 . . . . 31.64 112.323 -169.055 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 94.0 m -119.64 144.74 46.99 Favored 'General case' 0 N--CA 1.424 -1.734 0 CA-C-N 115.25 -0.886 . . . . 40.7 110.08 -176.857 -68.7 -79.472 97.834 104.957 2.066 109.26 51.734 -168.486 1 1 . 1 . 001 ecloud build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 66.12 -138.35 36.77 Favored Glycine 0 C--O 1.252 1.257 0 CA-C-O 122.184 0.88 . . . . 31.57 113.886 169.797 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 58.0 p -60.13 -21.25 61.35 Favored 'General case' 0 C--O 1.205 -1.284 0 N-CA-C 115.045 1.498 . . . . 35.2 115.045 177.887 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 98.8 m-70 -66.8 -33.4 75.53 Favored 'General case' 0 C--O 1.242 0.691 0 C-N-CA 124.059 0.944 . . . . 27.94 111.346 178.055 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 11' ' ' LEU . . . . . 0.434 HD22 ' O ' ' B' ' 43' ' ' HOH . 21.4 tp -70.05 -39.96 75.4 Favored 'General case' 0 C--O 1.217 -0.627 0 N-CA-C 108.504 -0.925 . . . . 28.22 108.504 176.381 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 12' ' ' VAL . . . . . 1.048 ' CG1' ' CG1' ' D' ' 12' ' ' VAL . 12.3 t -66.53 -35.06 73.95 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.936 0 C-N-CA 118.675 -1.21 . . . . 30.46 112.261 -179.75 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 13' ' ' GLU . . . . . 1.103 ' OE2' ' O ' ' B' ' 38' ' ' HOH . 50.7 mt-10 -64.47 -36.98 85.96 Favored 'General case' 0 N--CA 1.486 1.338 0 O-C-N 121.293 -0.879 . . . . 34.62 109.014 176.119 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.34 -40.07 81.68 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 119.215 -0.994 . . . . 23.35 112.843 -179.928 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 57.7 mt -59.24 -46.39 88.6 Favored 'General case' 0 CA--C 1.547 0.852 0 CA-C-N 116.154 -0.476 . . . . 24.76 111.677 174.344 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 88.1 t80 -55.97 -45.42 78.93 Favored 'General case' 0 N--CA 1.434 -1.248 0 CA-C-O 118.211 -0.9 . . . . 37.72 109.843 176.782 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 52.7 mt -63.94 -46.91 82.59 Favored 'General case' 0 C--O 1.264 1.845 0 O-C-N 124.128 0.892 . . . . 27.56 111.34 -178.745 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 73.8 t -65.96 -41.43 89.81 Favored 'Isoleucine or valine' 0 C--O 1.252 1.216 0 N-CA-C 115.436 1.643 . . . . 30.04 115.436 179.485 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 19' ' ' CYS . . . . . 0.417 ' O ' ' HB2' ' B' ' 22' ' ' ARG . 59.6 m -96.83 -37.14 10.37 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 123.623 0.577 . . . . 35.39 112.183 -169.289 -55.329 -65.776 -76.428 100.721 2.063 104.309 -50.305 -47.837 2 2 . 1 . 001 ecloud build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 56.09 -134.71 50.18 Favored Glycine 0 CA--C 1.536 1.379 0 C-N-CA 120.051 -1.071 . . . . 38.31 113.174 179.892 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 26.7 mp0 -69.57 -11.24 60.68 Favored 'General case' 0 C--O 1.207 -1.142 0 C-N-CA 126.558 1.943 . . . . 42.53 111.709 -175.983 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 22' ' ' ARG . . . . . 0.417 ' HB2' ' O ' ' B' ' 19' ' ' CYS . 1.2 ttt-85 -64.16 -26.7 68.65 Favored 'General case' 0 N--CA 1.428 -1.553 0 CA-C-N 115.479 -0.782 . . . . 65.23 110.436 179.696 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.14 -179.97 41.41 Favored Glycine 0 C--N 1.351 1.371 0 C-N-CA 124.443 1.021 . . . . 34.79 113.703 -171.694 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 33.5 p90 -164.08 160.71 21.91 Favored 'General case' 0 C--O 1.24 0.594 0 CA-C-O 121.787 0.803 . . . . 29.57 112.383 -174.569 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 15.1 m-85 -109.58 136.6 48.7 Favored 'General case' 0 C--O 1.257 1.449 0 N-CA-C 107.499 -1.297 . . . . 46.01 107.499 173.098 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 75.2 t80 -110.56 109.11 19.3 Favored 'General case' 0 N--CA 1.495 1.784 0 N-CA-C 106.772 -1.566 . . . . 34.98 106.772 173.266 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 26.3 p -132.52 86.82 43.9 Favored Pre-proline 0 CA--C 1.544 0.712 0 C-N-CA 118.799 -1.161 . . . . 44.61 111.273 -170.328 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 5.0 Cg_exo -69.31 138.9 40.41 Favored 'Trans proline' 0 N--CA 1.452 -0.916 0 O-C-N 123.714 1.376 . . . . 48.16 108.69 177.959 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 29' ' ' LYS . . . . . 0.835 ' O ' ' O ' ' B' ' 30' ' ' ALA . 56.1 tttt -38.55 149.54 0.04 OUTLIER 'General case' 0 C--O 1.256 1.431 0 N-CA-C 108.995 -0.742 . . . . 63.25 108.995 155.58 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 30' ' ' ALA . . . . . 0.835 ' O ' ' O ' ' B' ' 29' ' ' LYS . . . . . . . . 0 CA--C 1.577 2.019 0 O-C-N 117.762 -3.086 . . . . 58.21 117.769 160.569 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.496 2.674 0 N-CA-C 110.679 -0.968 . . . . 41.79 110.679 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 2' ' ' ILE . . . . . . . . . . . . . 15.5 tt -50.36 -44.25 23.56 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 N-CA-C 115.05 1.5 . . . . 39.15 115.05 -177.295 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 3' ' ' VAL . . . . . . . . . . . . . 72.4 t -62.26 -48.8 86.71 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.823 0 CA-C-O 121.406 0.622 . . . . 40.92 109.413 -178.408 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 4' ' ' GLU . . . . . 0.721 ' HA ' HG22 ' C' ' 8' ' ' THR . 32.1 mp0 -60.89 -44.93 96.44 Favored 'General case' 0 C--O 1.21 -1.007 0 CA-C-N 115.332 -0.849 . . . . 55.36 111.737 178.352 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 5' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -68.34 -38.84 81.89 Favored 'General case' 0 C--N 1.311 -1.078 0 N-CA-C 117.032 2.234 . . . . 59.66 117.032 176.757 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 6' ' ' CYS . . . . . . . . . . . . . 66.1 m -110.03 -23.18 11.45 Favored 'General case' 0 CA--C 1.506 -0.747 0 N-CA-C 113.301 0.852 . . . . 42.66 113.301 -163.542 -72.687 -70.951 107.978 101.388 2.079 100.676 -158.686 72.903 1 1 . 1 . 001 ecloud build full ' C' C ' 7' ' ' CYS . . . . . . . . . . . . . 43.7 t -104.57 -52.37 2.9 Favored 'General case' 0 CA--C 1.562 1.428 0 N-CA-C 114.201 1.186 . . . . 43.09 114.201 176.306 -176.784 64.646 98.641 107.459 2.043 103.598 -84.027 -59.257 1 1 . 1 . 001 ecloud build full ' C' C ' 8' ' ' THR . . . . . 0.721 HG22 ' HA ' ' C' ' 4' ' ' GLU . 6.8 t -68.31 -52.24 35.72 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 117.722 -1.591 . . . . 54.58 110.742 176.332 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 9' ' ' SER . . . . . . . . . . . . . 22.7 t -88.79 -156.67 0.4 Allowed 'General case' 0 N--CA 1.414 -2.253 0 CA-C-N 114.088 -1.415 . . . . 45.95 108.762 172.818 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 10' ' ' ILE . . . . . 0.625 ' CD1' ' CD2' ' D' ' 5' ' ' HIS . 0.9 OUTLIER -127.3 145.25 35.11 Favored 'Isoleucine or valine' 0 N--CA 1.415 -2.212 0 N-CA-C 106.142 -1.799 . . . . 43.99 106.142 -174.681 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' C' C ' 11' ' ' CYS . . . . . . . . . . . . . 16.4 p -140.0 157.8 45.09 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 117.343 -1.743 . . . . 44.87 111.508 179.563 72.903 -158.686 107.978 100.676 2.079 101.388 -70.951 -72.687 1 1 . 1 . 001 ecloud build full ' C' C ' 12' ' ' SER . . . . . . . . . . . . . 78.5 p -93.61 164.0 13.34 Favored 'General case' 0 N--CA 1.464 0.228 0 O-C-N 123.423 0.452 . . . . 41.05 110.704 -178.647 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 13' ' ' LEU . . . . . . . . . . . . . 23.4 mt -61.17 -33.34 73.28 Favored 'General case' 0 C--O 1.266 1.969 0 CA-C-O 122.124 0.964 . . . . 44.13 111.256 175.326 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 14' ' ' TYR . . . . . . . . . . . . . 77.3 m-85 -60.03 -40.54 89.68 Favored 'General case' 0 N--CA 1.444 -0.759 0 N-CA-C 115.125 1.528 . . . . 56.21 115.125 172.696 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 15' ' ' GLN . . . . . . . . . . . . . 34.5 mt-30 -64.56 -37.87 89.05 Favored 'General case' 0 C--O 1.213 -0.854 0 CA-C-O 117.56 -1.21 . . . . 53.98 107.949 176.353 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 16' ' ' LEU . . . . . . . . . . . . . 61.8 mt -59.74 -32.78 70.87 Favored 'General case' 0 C--O 1.249 1.034 0 N-CA-C 114.945 1.461 . . . . 36.96 114.945 -179.148 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 17' ' ' GLU . . . . . . . . . . . . . 27.5 mt-10 -57.63 -16.52 10.74 Favored 'General case' 0 C--O 1.207 -1.138 0 N-CA-C 113.7 1.0 . . . . 51.4 113.7 174.588 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 18' ' ' ASN . . . . . . . . . . . . . 95.9 m-20 -68.68 -16.26 63.77 Favored 'General case' 0 CA--C 1.504 -0.797 0 O-C-N 120.877 -1.139 . . . . 39.25 111.853 178.79 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 19' ' ' TYR . . . . . . . . . . . . . 68.5 m-85 -104.02 9.35 36.55 Favored 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 113.382 0.882 . . . . 38.22 113.382 -177.148 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 20' ' ' CYS . . . . . . . . . . . . . 56.6 m -76.83 148.71 36.38 Favored 'General case' 0 C--N 1.322 -0.59 0 C-N-CA 120.319 -0.552 . . . . 38.48 110.425 171.942 -53.964 -46.801 -79.004 108.288 2.015 105.266 -68.111 -57.137 1 1 . 1 . 001 ecloud build full ' C' C ' 21' ' ' ASN . . . . . . . . . . . . . 87.2 m-20 . . . . . 0 CA--C 1.478 -1.814 0 N-CA-C 105.636 -1.986 . . . . 53.09 105.636 -178.41 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 1' ' ' PHE . . . . . . . . . . . . . 36.7 m-85 . . . . . 0 N--CA 1.502 2.175 0 CA-C-O 121.392 0.615 . . . . 57.49 109.422 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 2' ' ' VAL . . . . . . . . . . . . . 1.1 t -122.84 156.68 28.29 Favored 'Isoleucine or valine' 0 C--O 1.258 1.516 0 N-CA-C 108.065 -1.087 . . . . 56.13 108.065 -174.518 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 3' ' ' ASN . . . . . 0.493 ' HB3' HG23 ' C' ' 10' ' ' ILE . 41.3 m-20 -78.4 123.48 27.05 Favored 'General case' 0 C--O 1.215 -0.726 0 N-CA-C 114.802 1.408 . . . . 56.34 114.802 170.552 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 4' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -115.47 146.86 41.27 Favored 'General case' 0 N--CA 1.49 1.549 0 CA-C-N 120.488 1.495 . . . . 46.74 113.928 178.945 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 5' ' ' HIS . . . . . 0.625 ' CD2' ' CD1' ' C' ' 10' ' ' ILE . 32.0 m-70 -81.15 119.81 24.06 Favored 'General case' 0 N--CA 1.49 1.552 0 N-CA-C 103.22 -2.882 . . . . 43.14 103.22 169.534 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 6' ' ' LEU . . . . . . . . . . . . . 37.2 mt -128.61 115.99 18.92 Favored 'General case' 0 N--CA 1.487 1.415 0 CA-C-O 121.804 0.811 . . . . 33.58 111.31 -177.551 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 7' ' ' CYS . . . . . . . . . . . . . 82.5 m -130.68 151.64 50.91 Favored 'General case' 0 N--CA 1.412 -2.34 0 CA-C-N 114.62 -1.173 . . . . 45.49 112.525 -171.905 -59.257 -84.027 98.641 103.598 2.043 107.459 64.646 -176.784 1 1 . 1 . 001 ecloud build full ' D' D ' 8' ' ' GLY . . . . . . . . . . . . . . . 54.91 -129.13 44.82 Favored Glycine 0 C--O 1.264 1.999 0 O-C-N 125.771 1.919 . . . . 33.73 111.358 173.009 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 9' ' ' SER . . . . . . . . . . . . . 71.6 p -65.88 -26.15 67.5 Favored 'General case' 0 C--O 1.199 -1.588 0 C-N-CA 116.55 -2.06 . . . . 33.86 112.941 -178.554 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 10' ' ' HIS . . . . . . . . . . . . . 91.5 m-70 -60.78 -34.43 74.46 Favored 'General case' 0 C--O 1.252 1.217 0 N-CA-C 114.326 1.232 . . . . 27.4 114.326 176.385 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 11' ' ' LEU . . . . . . . . . . . . . 17.6 tp -66.63 -45.15 79.98 Favored 'General case' 0 C--O 1.214 -0.784 0 O-C-N 124.732 1.27 . . . . 27.93 109.14 178.288 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 12' ' ' VAL . . . . . 1.048 ' CG1' ' CG1' ' B' ' 12' ' ' VAL . 53.2 t -64.13 -37.13 79.07 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.31 0 N-CA-C 114.503 1.297 . . . . 31.62 114.503 176.503 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 13' ' ' GLU . . . . . . . . . . . . . 17.8 mm-40 -61.38 -39.56 91.11 Favored 'General case' 0 N--CA 1.51 2.544 0 CA-C-N 119.393 0.997 . . . . 56.68 110.807 173.134 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.71 -44.28 94.09 Favored 'General case' 0 C--O 1.222 -0.345 0 O-C-N 121.619 -0.676 . . . . 25.27 110.972 179.889 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 15' ' ' LEU . . . . . . . . . . . . . 62.4 mt -60.64 -41.01 94.08 Favored 'General case' 0 C--O 1.248 1.026 0 CA-C-O 119.335 -0.364 . . . . 28.75 111.767 174.829 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 16' ' ' TYR . . . . . . . . . . . . . 80.1 t80 -60.76 -44.68 96.41 Favored 'General case' 0 C--O 1.264 1.86 0 C-N-CA 119.749 -0.78 . . . . 36.15 111.226 176.482 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 17' ' ' LEU . . . . . 0.447 ' HA ' HD23 ' D' ' 17' ' ' LEU . 6.6 mt -62.72 -45.66 91.72 Favored 'General case' 0 C--O 1.259 1.589 0 C-N-CA 120.808 -0.357 . . . . 29.68 111.71 -177.973 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 18' ' ' VAL . . . . . . . . . . . . . 23.2 t -73.06 -41.06 59.38 Favored 'Isoleucine or valine' 0 C--O 1.264 1.816 0 O-C-N 123.786 0.679 . . . . 32.54 110.696 -175.524 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 19' ' ' CYS . . . . . . . . . . . . . 63.6 m -94.84 -40.36 9.77 Favored 'General case' 0 N--CA 1.486 1.363 0 N-CA-C 113.419 0.896 . . . . 32.83 113.419 -170.551 -57.137 -68.111 -79.004 105.266 2.015 108.288 -46.801 -53.964 1 1 . 1 . 001 ecloud build full ' D' D ' 20' ' ' GLY . . . . . . . . . . . . . . . 47.81 -119.51 5.19 Favored Glycine 0 C--O 1.269 2.342 0 O-C-N 124.463 1.102 . . . . 37.45 112.596 179.294 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 21' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -61.7 -28.42 69.4 Favored 'General case' 0 C--O 1.25 1.105 0 CA-C-N 113.255 -1.473 . . . . 63.24 111.98 -170.273 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 22' ' ' ARG . . . . . . . . . . . . . 47.7 mtm180 -67.43 -26.12 66.26 Favored 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 113.053 0.76 . . . . 40.08 113.053 176.022 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 23' ' ' GLY . . . . . . . . . . . . . . . 79.68 177.12 50.05 Favored Glycine 0 C--O 1.212 -1.244 0 N-CA-C 107.573 -2.211 . . . . 32.78 107.573 -176.91 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 24' ' ' PHE . . . . . . . . . . . . . 33.2 p90 -158.38 166.0 33.32 Favored 'General case' 0 N--CA 1.485 1.298 0 O-C-N 124.378 0.693 . . . . 26.63 111.301 -173.403 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 25' ' ' PHE . . . . . . . . . . . . . 6.1 p90 -121.39 140.58 51.95 Favored 'General case' 0 C--N 1.35 0.599 0 N-CA-C 108.484 -0.932 . . . . 33.49 108.484 166.902 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 26' ' ' TYR . . . . . . . . . . . . . 56.5 t80 -113.49 108.02 16.62 Favored 'General case' 0 N--CA 1.428 -1.558 0 O-C-N 125.697 1.873 . . . . 36.09 108.473 173.305 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 27' ' ' THR . . . . . 0.719 HG22 ' O ' ' A' ' 44' ' ' HOH . 17.6 p -132.81 82.74 54.91 Favored Pre-proline 0 N--CA 1.483 1.22 0 CA-C-O 118.004 -0.998 . . . . 32.08 110.668 -172.562 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 28' ' ' PRO . . . . . . . . . . . . . 22.3 Cg_endo -73.35 -11.82 24.91 Favored 'Trans proline' 0 C--N 1.356 0.93 0 O-C-N 123.681 1.359 . . . . 39.0 112.01 -169.838 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 29' ' ' LYS . . . . . . . . . . . . . 40.7 mttm -71.77 -31.91 67.11 Favored 'General case' 0 N--CA 1.485 1.309 0 CA-C-O 122.438 1.113 . . . . 56.46 111.342 175.673 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 30' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.109 0 CA-C-N 115.223 -0.899 . . . . 51.9 109.162 -171.236 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 22' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 23' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 26' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 31' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 34' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 42' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 43' ' ' HOH . . . . . 0.423 ' O ' ' HA ' ' A' ' 2' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' HOH . . . . . 0.719 ' O ' HG22 ' D' ' 27' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 32' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 33' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 34' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 35' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 36' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 37' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 38' ' ' HOH . . . . . 1.103 ' O ' ' OE2' ' B' ' 13' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 39' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 40' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 41' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 42' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 43' ' ' HOH . . . . . 0.434 ' O ' HD22 ' B' ' 11' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 44' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 45' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 22' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 24' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 32' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 39' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 45' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 32' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 33' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 34' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 35' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 36' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 37' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 38' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 39' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 40' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 41' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 42' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 43' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 44' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 45' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 46' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 47' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 48' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 49' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 50' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.39 0 CA-C-O 119.958 -0.357 . . . . 43.41 113.112 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' ILE . . . . . 0.57 HG23 ' N ' ' A' ' 3' ' ' VAL . 8.1 tp -55.27 -49.75 70.04 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.098 0 O-C-N 126.196 1.762 . . . . 43.82 111.117 -173.914 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' VAL . . . . . 0.57 ' N ' HG23 ' A' ' 2' ' ' ILE . 63.5 t -58.64 -45.54 90.65 Favored 'Isoleucine or valine' 0 C--O 1.256 1.405 0 C-N-CA 118.153 -1.419 . . . . 46.32 107.717 -175.973 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 12.0 mp0 -67.3 -57.17 7.14 Favored 'General case' 0 N--CA 1.48 1.07 0 CA-C-N 114.117 -1.401 . . . . 49.83 111.242 -174.376 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -45.64 -50.84 13.03 Favored 'General case' 0 CA--C 1.556 1.209 0 N-CA-C 119.277 3.066 . . . . 57.97 119.277 170.288 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 92.7 m -64.94 -31.57 72.86 Favored 'General case' 0 N--CA 1.482 1.172 0 CA-C-N 119.299 0.954 . . . . 37.22 110.71 -177.578 -70.057 -70.519 99.269 105.749 2.043 104.549 -155.53 72.429 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 20.2 t -88.81 -48.9 7.16 Favored 'General case' 0 N--CA 1.423 -1.811 0 N-CA-C 114.376 1.25 . . . . 46.51 114.376 178.802 -168.486 51.734 97.834 109.26 2.066 104.957 -79.472 -68.7 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 10.6 p -82.21 -27.22 32.68 Favored 'General case' 0 C--O 1.251 1.166 0 C-N-CA 116.101 -2.239 . . . . 49.91 111.459 -176.849 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 16.5 t -114.16 -121.6 0.3 Allowed 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 119.612 -0.835 . . . . 44.8 113.152 170.93 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -146.62 151.84 13.89 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.426 0 N-CA-C 106.485 -1.672 . . . . 46.13 106.485 178.77 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 17.0 p -145.01 167.37 22.82 Favored 'General case' 0 C--N 1.35 0.624 0 C-N-CA 120.048 -0.661 . . . . 35.32 112.225 176.215 72.429 -155.53 99.269 104.549 2.043 105.749 -70.519 -70.057 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 96.2 p -113.51 160.72 18.19 Favored 'General case' 0 CA--C 1.493 -1.238 0 CA-C-O 121.156 0.503 . . . . 31.71 110.715 -174.632 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 41.9 mt -63.06 -29.8 71.1 Favored 'General case' 0 N--CA 1.483 1.216 0 N-CA-C 107.537 -1.283 . . . . 35.68 107.537 179.609 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 99.6 m-85 -68.47 -33.75 74.72 Favored 'General case' 0 C--O 1.248 1.003 0 C-N-CA 117.806 -1.558 . . . . 41.39 112.685 178.181 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 95.4 mt-30 -64.19 -36.46 84.13 Favored 'General case' 0 N--CA 1.484 1.238 0 O-C-N 121.773 -0.58 . . . . 45.46 111.369 172.786 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 32.2 mt -67.03 -29.17 68.91 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 116.388 -0.369 . . . . 36.51 110.284 -179.243 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -61.93 -18.11 59.15 Favored 'General case' 0 CA--C 1.49 -1.345 0 C-N-CA 118.447 -1.301 . . . . 52.68 112.245 -179.988 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 70.0 m-20 -66.17 -13.15 59.74 Favored 'General case' 0 C--O 1.26 1.635 0 C-N-CA 120.074 -0.651 . . . . 48.44 111.873 -179.279 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.49 ' CZ ' ' HB ' ' A' ' 2' ' ' ILE . 96.8 m-85 -104.87 -0.03 27.51 Favored 'General case' 0 CA--C 1.505 -0.754 0 N-CA-C 114.805 1.409 . . . . 53.38 114.805 -173.991 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 19.9 m -72.38 157.88 36.82 Favored 'General case' 0 N--CA 1.477 0.909 0 O-C-N 123.795 0.684 . . . . 36.38 109.953 175.188 -47.837 -50.305 -76.428 104.309 2.063 100.721 -65.776 -55.329 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.569 ' HB2' ' O ' ' A' ' 44' ' ' HOH . 0.7 OUTLIER . . . . . 0 C--O 1.252 1.204 0 CA-C-O 125.99 2.805 . . . . 54.61 116.8 172.471 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 16.5 m-85 . . . . . 0 N--CA 1.495 1.812 0 CA-C-O 121.182 0.515 . . . . 60.12 112.34 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 35.6 m -113.37 157.52 14.03 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.359 0 C-N-CA 125.025 1.33 . . . . 50.76 109.165 -175.917 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 4.1 m120 -63.34 153.12 36.01 Favored 'General case' 0 CA--C 1.481 -1.701 0 C-N-CA 124.156 0.982 . . . . 53.55 112.683 171.297 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . 0.288 10.2 mm100 -141.71 145.4 34.83 Favored 'General case' 0 N--CA 1.478 0.957 0 CA-C-O 116.63 -1.652 . . . . 36.62 111.278 -164.378 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 17.9 t-80 -100.41 108.05 19.95 Favored 'General case' 0 N--CA 1.421 -1.876 0 CA-C-N 120.104 1.32 . . . . 48.44 108.521 166.774 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 21.8 mt -128.2 114.27 16.76 Favored 'General case' 0 C--O 1.254 1.329 0 CA-C-N 119.818 1.19 . . . . 31.64 112.323 -169.055 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 94.0 m -119.64 144.74 46.99 Favored 'General case' 0 N--CA 1.424 -1.734 0 CA-C-N 115.25 -0.886 . . . . 40.7 110.08 -176.857 -68.7 -79.472 97.834 104.957 2.066 109.26 51.734 -168.486 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 66.12 -138.35 36.77 Favored Glycine 0 C--O 1.252 1.257 0 CA-C-O 122.184 0.88 . . . . 31.57 113.886 169.797 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 58.0 p -60.13 -21.25 61.35 Favored 'General case' 0 C--O 1.205 -1.284 0 N-CA-C 115.045 1.498 . . . . 35.2 115.045 177.887 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 98.8 m-70 -66.8 -33.4 75.53 Favored 'General case' 0 C--O 1.242 0.691 0 C-N-CA 124.059 0.944 . . . . 27.94 111.346 178.055 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 11' ' ' LEU . . . . . 0.434 HD22 ' O ' ' B' ' 43' ' ' HOH . 21.4 tp -70.05 -39.96 75.4 Favored 'General case' 0 C--O 1.217 -0.627 0 N-CA-C 108.504 -0.925 . . . . 28.22 108.504 176.381 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 12' ' ' VAL . . . . . 1.048 ' CG1' ' CG1' ' D' ' 12' ' ' VAL . 12.3 t -66.53 -35.06 73.95 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.936 0 C-N-CA 118.675 -1.21 . . . . 30.46 112.261 -179.75 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 13' ' ' GLU . . . . . 1.103 ' OE2' ' O ' ' B' ' 38' ' ' HOH . 50.7 mt-10 -64.47 -36.98 85.96 Favored 'General case' 0 N--CA 1.486 1.338 0 O-C-N 121.293 -0.879 . . . . 34.62 109.014 176.119 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.34 -40.07 81.68 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 119.215 -0.994 . . . . 23.35 112.843 -179.928 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 57.7 mt -59.24 -46.39 88.6 Favored 'General case' 0 CA--C 1.547 0.852 0 CA-C-N 116.154 -0.476 . . . . 24.76 111.677 174.344 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 88.1 t80 -55.97 -45.42 78.93 Favored 'General case' 0 N--CA 1.434 -1.248 0 CA-C-O 118.211 -0.9 . . . . 37.72 109.843 176.782 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 52.7 mt -63.94 -46.91 82.59 Favored 'General case' 0 C--O 1.264 1.845 0 O-C-N 124.128 0.892 . . . . 27.56 111.34 -178.745 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 73.8 t -65.96 -41.43 89.81 Favored 'Isoleucine or valine' 0 C--O 1.252 1.216 0 N-CA-C 115.436 1.643 . . . . 30.04 115.436 179.485 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 19' ' ' CYS . . . . . 0.417 ' O ' ' HB2' ' B' ' 22' ' ' ARG . 59.6 m -96.83 -37.14 10.37 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 123.623 0.577 . . . . 35.39 112.183 -169.289 -55.329 -65.776 -76.428 100.721 2.063 104.309 -50.305 -47.837 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 56.09 -134.71 50.18 Favored Glycine 0 CA--C 1.536 1.379 0 C-N-CA 120.051 -1.071 . . . . 38.31 113.174 179.892 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 26.7 mp0 -69.57 -11.24 60.68 Favored 'General case' 0 C--O 1.207 -1.142 0 C-N-CA 126.558 1.943 . . . . 42.53 111.709 -175.983 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 22' ' ' ARG . . . . . 0.417 ' HB2' ' O ' ' B' ' 19' ' ' CYS . 1.2 ttt-85 -64.16 -26.7 68.65 Favored 'General case' 0 N--CA 1.428 -1.553 0 CA-C-N 115.479 -0.782 . . . . 65.23 110.436 179.696 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.14 -179.97 41.41 Favored Glycine 0 C--N 1.351 1.371 0 C-N-CA 124.443 1.021 . . . . 34.79 113.703 -171.694 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 33.5 p90 -164.08 160.71 21.91 Favored 'General case' 0 C--O 1.24 0.594 0 CA-C-O 121.787 0.803 . . . . 29.57 112.383 -174.569 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 15.1 m-85 -109.58 136.6 48.7 Favored 'General case' 0 C--O 1.257 1.449 0 N-CA-C 107.499 -1.297 . . . . 46.01 107.499 173.098 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 75.2 t80 -110.56 109.11 19.3 Favored 'General case' 0 N--CA 1.495 1.784 0 N-CA-C 106.772 -1.566 . . . . 34.98 106.772 173.266 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 26.3 p -132.52 86.82 43.9 Favored Pre-proline 0 CA--C 1.544 0.712 0 C-N-CA 118.799 -1.161 . . . . 44.61 111.273 -170.328 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 5.0 Cg_exo -69.31 138.9 40.41 Favored 'Trans proline' 0 N--CA 1.452 -0.916 0 O-C-N 123.714 1.376 . . . . 48.16 108.69 177.959 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 29' ' ' LYS . . . . . 0.835 ' O ' ' O ' ' B' ' 30' ' ' ALA . 56.1 tttt -38.55 149.54 0.04 OUTLIER 'General case' 0 C--O 1.256 1.431 0 N-CA-C 108.995 -0.742 . . . . 63.25 108.995 155.58 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 30' ' ' ALA . . . . . 0.835 ' O ' ' O ' ' B' ' 29' ' ' LYS . . . . . . . . 0 CA--C 1.577 2.019 0 O-C-N 117.762 -3.086 . . . . 58.21 117.769 160.569 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.496 2.674 0 N-CA-C 110.679 -0.968 . . . . 41.79 110.679 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 2' ' ' ILE . . . . . . . . . . . . . 15.5 tt -50.36 -44.25 23.56 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 N-CA-C 115.05 1.5 . . . . 39.15 115.05 -177.295 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 3' ' ' VAL . . . . . . . . . . . . . 72.4 t -62.26 -48.8 86.71 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.823 0 CA-C-O 121.406 0.622 . . . . 40.92 109.413 -178.408 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 4' ' ' GLU . . . . . 0.721 ' HA ' HG22 ' C' ' 8' ' ' THR . 32.1 mp0 -60.89 -44.93 96.44 Favored 'General case' 0 C--O 1.21 -1.007 0 CA-C-N 115.332 -0.849 . . . . 55.36 111.737 178.352 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 5' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -68.34 -38.84 81.89 Favored 'General case' 0 C--N 1.311 -1.078 0 N-CA-C 117.032 2.234 . . . . 59.66 117.032 176.757 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 6' ' ' CYS . . . . . . . . . . . . . 66.1 m -110.03 -23.18 11.45 Favored 'General case' 0 CA--C 1.506 -0.747 0 N-CA-C 113.301 0.852 . . . . 42.66 113.301 -163.542 -72.687 -70.951 107.978 101.388 2.079 100.676 -158.686 72.903 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 7' ' ' CYS . . . . . . . . . . . . . 43.7 t -104.57 -52.37 2.9 Favored 'General case' 0 CA--C 1.562 1.428 0 N-CA-C 114.201 1.186 . . . . 43.09 114.201 176.306 -176.784 64.646 98.641 107.459 2.043 103.598 -84.027 -59.257 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 8' ' ' THR . . . . . 0.721 HG22 ' HA ' ' C' ' 4' ' ' GLU . 6.8 t -68.31 -52.24 35.72 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 117.722 -1.591 . . . . 54.58 110.742 176.332 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 9' ' ' SER . . . . . . . . . . . . . 22.7 t -88.79 -156.67 0.4 Allowed 'General case' 0 N--CA 1.414 -2.253 0 CA-C-N 114.088 -1.415 . . . . 45.95 108.762 172.818 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 10' ' ' ILE . . . . . 0.625 ' CD1' ' CD2' ' D' ' 5' ' ' HIS . 0.9 OUTLIER -127.3 145.25 35.11 Favored 'Isoleucine or valine' 0 N--CA 1.415 -2.212 0 N-CA-C 106.142 -1.799 . . . . 43.99 106.142 -174.681 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' C' C ' 11' ' ' CYS . . . . . . . . . . . . . 16.4 p -140.0 157.8 45.09 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 117.343 -1.743 . . . . 44.87 111.508 179.563 72.903 -158.686 107.978 100.676 2.079 101.388 -70.951 -72.687 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 12' ' ' SER . . . . . 0.421 ' H ' ' NE2' ' C' ' 15' ' ' GLN . 78.5 p -93.61 164.0 13.34 Favored 'General case' 0 N--CA 1.464 0.228 0 O-C-N 123.423 0.452 . . . . 41.05 110.704 -178.647 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 13' ' ' LEU . . . . . . . . . . . . . 23.4 mt -61.17 -33.34 73.28 Favored 'General case' 0 C--O 1.266 1.969 0 CA-C-O 122.124 0.964 . . . . 44.13 111.256 175.326 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 14' ' ' TYR . . . . . . . . . . . . . 77.3 m-85 -60.03 -40.54 89.68 Favored 'General case' 0 N--CA 1.444 -0.759 0 N-CA-C 115.125 1.528 . . . . 56.21 115.125 172.696 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 15' ' ' GLN . . . . . 0.421 ' NE2' ' H ' ' C' ' 12' ' ' SER . 37.0 mt-30 -64.56 -37.87 89.05 Favored 'General case' 0 C--O 1.213 -0.854 0 CA-C-O 117.56 -1.21 . . . . 53.98 107.949 176.353 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 16' ' ' LEU . . . . . . . . . . . . . 61.8 mt -59.74 -32.78 70.87 Favored 'General case' 0 C--O 1.249 1.034 0 N-CA-C 114.945 1.461 . . . . 36.96 114.945 -179.148 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 17' ' ' GLU . . . . . . . . . . . . . 27.5 mt-10 -57.63 -16.52 10.74 Favored 'General case' 0 C--O 1.207 -1.138 0 N-CA-C 113.7 1.0 . . . . 51.4 113.7 174.588 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 18' ' ' ASN . . . . . . . . . . . . . 95.9 m-20 -68.68 -16.26 63.77 Favored 'General case' 0 CA--C 1.504 -0.797 0 O-C-N 120.877 -1.139 . . . . 39.25 111.853 178.79 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 19' ' ' TYR . . . . . . . . . . . . . 68.5 m-85 -104.02 9.35 36.55 Favored 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 113.382 0.882 . . . . 38.22 113.382 -177.148 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 20' ' ' CYS . . . . . . . . . . . . . 56.6 m -76.83 148.71 36.38 Favored 'General case' 0 C--N 1.322 -0.59 0 C-N-CA 120.319 -0.552 . . . . 38.48 110.425 171.942 -53.964 -46.801 -79.004 108.288 2.015 105.266 -68.111 -57.137 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 21' ' ' ASN . . . . . . . . . . . . . 8.2 m120 . . . . . 0 CA--C 1.478 -1.814 0 N-CA-C 105.636 -1.986 . . . . 53.09 105.636 -178.41 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 1' ' ' PHE . . . . . . . . . . . . . 36.7 m-85 . . . . . 0 N--CA 1.502 2.175 0 CA-C-O 121.392 0.615 . . . . 57.49 109.422 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 2' ' ' VAL . . . . . . . . . . . . . 1.1 t -122.84 156.68 28.29 Favored 'Isoleucine or valine' 0 C--O 1.258 1.516 0 N-CA-C 108.065 -1.087 . . . . 56.13 108.065 -174.518 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 3' ' ' ASN . . . . . 0.493 ' HB3' HG23 ' C' ' 10' ' ' ILE . 41.3 m-20 -78.4 123.48 27.05 Favored 'General case' 0 C--O 1.215 -0.726 0 N-CA-C 114.802 1.408 . . . . 56.34 114.802 170.552 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 4' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -115.47 146.86 41.27 Favored 'General case' 0 N--CA 1.49 1.549 0 CA-C-N 120.488 1.495 . . . . 46.74 113.928 178.945 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 5' ' ' HIS . . . . . 0.625 ' CD2' ' CD1' ' C' ' 10' ' ' ILE . 32.0 m-70 -81.15 119.81 24.06 Favored 'General case' 0 N--CA 1.49 1.552 0 N-CA-C 103.22 -2.882 . . . . 43.14 103.22 169.534 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 6' ' ' LEU . . . . . . . . . . . . . 37.2 mt -128.61 115.99 18.92 Favored 'General case' 0 N--CA 1.487 1.415 0 CA-C-O 121.804 0.811 . . . . 33.58 111.31 -177.551 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 7' ' ' CYS . . . . . . . . . . . . . 82.5 m -130.68 151.64 50.91 Favored 'General case' 0 N--CA 1.412 -2.34 0 CA-C-N 114.62 -1.173 . . . . 45.49 112.525 -171.905 -59.257 -84.027 98.641 103.598 2.043 107.459 64.646 -176.784 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 8' ' ' GLY . . . . . . . . . . . . . . . 54.91 -129.13 44.82 Favored Glycine 0 C--O 1.264 1.999 0 O-C-N 125.771 1.919 . . . . 33.73 111.358 173.009 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 9' ' ' SER . . . . . . . . . . . . . 71.6 p -65.88 -26.15 67.5 Favored 'General case' 0 C--O 1.199 -1.588 0 C-N-CA 116.55 -2.06 . . . . 33.86 112.941 -178.554 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 10' ' ' HIS . . . . . . . . . . . . . 91.5 m-70 -60.78 -34.43 74.46 Favored 'General case' 0 C--O 1.252 1.217 0 N-CA-C 114.326 1.232 . . . . 27.4 114.326 176.385 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 11' ' ' LEU . . . . . . . . . . . . . 17.6 tp -66.63 -45.15 79.98 Favored 'General case' 0 C--O 1.214 -0.784 0 O-C-N 124.732 1.27 . . . . 27.93 109.14 178.288 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 12' ' ' VAL . . . . . 1.048 ' CG1' ' CG1' ' B' ' 12' ' ' VAL . 53.2 t -64.13 -37.13 79.07 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.31 0 N-CA-C 114.503 1.297 . . . . 31.62 114.503 176.503 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 13' ' ' GLU . . . . . . . . . . . . . 17.8 mm-40 -61.38 -39.56 91.11 Favored 'General case' 0 N--CA 1.51 2.544 0 CA-C-N 119.393 0.997 . . . . 56.68 110.807 173.134 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.71 -44.28 94.09 Favored 'General case' 0 C--O 1.222 -0.345 0 O-C-N 121.619 -0.676 . . . . 25.27 110.972 179.889 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 15' ' ' LEU . . . . . . . . . . . . . 62.4 mt -60.64 -41.01 94.08 Favored 'General case' 0 C--O 1.248 1.026 0 CA-C-O 119.335 -0.364 . . . . 28.75 111.767 174.829 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 16' ' ' TYR . . . . . . . . . . . . . 80.1 t80 -60.76 -44.68 96.41 Favored 'General case' 0 C--O 1.264 1.86 0 C-N-CA 119.749 -0.78 . . . . 36.15 111.226 176.482 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 17' ' ' LEU . . . . . 0.447 ' HA ' HD23 ' D' ' 17' ' ' LEU . 6.6 mt -62.72 -45.66 91.72 Favored 'General case' 0 C--O 1.259 1.589 0 C-N-CA 120.808 -0.357 . . . . 29.68 111.71 -177.973 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 18' ' ' VAL . . . . . . . . . . . . . 23.2 t -73.06 -41.06 59.38 Favored 'Isoleucine or valine' 0 C--O 1.264 1.816 0 O-C-N 123.786 0.679 . . . . 32.54 110.696 -175.524 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 19' ' ' CYS . . . . . . . . . . . . . 63.6 m -94.84 -40.36 9.77 Favored 'General case' 0 N--CA 1.486 1.363 0 N-CA-C 113.419 0.896 . . . . 32.83 113.419 -170.551 -57.137 -68.111 -79.004 105.266 2.015 108.288 -46.801 -53.964 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 20' ' ' GLY . . . . . . . . . . . . . . . 47.81 -119.51 5.19 Favored Glycine 0 C--O 1.269 2.342 0 O-C-N 124.463 1.102 . . . . 37.45 112.596 179.294 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 21' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -61.7 -28.42 69.4 Favored 'General case' 0 C--O 1.25 1.105 0 CA-C-N 113.255 -1.473 . . . . 63.24 111.98 -170.273 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 22' ' ' ARG . . . . . . . . . . . . . 47.7 mtm180 -67.43 -26.12 66.26 Favored 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 113.053 0.76 . . . . 40.08 113.053 176.022 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 23' ' ' GLY . . . . . . . . . . . . . . . 79.68 177.12 50.05 Favored Glycine 0 C--O 1.212 -1.244 0 N-CA-C 107.573 -2.211 . . . . 32.78 107.573 -176.91 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 24' ' ' PHE . . . . . . . . . . . . . 33.2 p90 -158.38 166.0 33.32 Favored 'General case' 0 N--CA 1.485 1.298 0 O-C-N 124.378 0.693 . . . . 26.63 111.301 -173.403 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 25' ' ' PHE . . . . . . . . . . . . . 6.1 p90 -121.39 140.58 51.95 Favored 'General case' 0 C--N 1.35 0.599 0 N-CA-C 108.484 -0.932 . . . . 33.49 108.484 166.902 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 26' ' ' TYR . . . . . . . . . . . . . 56.5 t80 -113.49 108.02 16.62 Favored 'General case' 0 N--CA 1.428 -1.558 0 O-C-N 125.697 1.873 . . . . 36.09 108.473 173.305 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 27' ' ' THR . . . . . 0.719 HG22 ' O ' ' A' ' 44' ' ' HOH . 17.6 p -132.81 82.74 54.91 Favored Pre-proline 0 N--CA 1.483 1.22 0 CA-C-O 118.004 -0.998 . . . . 32.08 110.668 -172.562 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 28' ' ' PRO . . . . . . . . . . . . . 22.3 Cg_endo -73.35 -11.82 24.91 Favored 'Trans proline' 0 C--N 1.356 0.93 0 O-C-N 123.681 1.359 . . . . 39.0 112.01 -169.838 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 29' ' ' LYS . . . . . . . . . . . . . 40.7 mttm -71.77 -31.91 67.11 Favored 'General case' 0 N--CA 1.485 1.309 0 CA-C-O 122.438 1.113 . . . . 56.46 111.342 175.673 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 30' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.109 0 CA-C-N 115.223 -0.899 . . . . 51.9 109.162 -171.236 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' HOH . . . . . 0.423 ' O ' ' HA ' ' A' ' 2' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' HOH . . . . . 0.719 ' O ' HG22 ' D' ' 27' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 32' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 33' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 34' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 35' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 36' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 37' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 38' ' ' HOH . . . . . 1.103 ' O ' ' OE2' ' B' ' 13' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 39' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 40' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 41' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 42' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 43' ' ' HOH . . . . . 0.434 ' O ' HD22 ' B' ' 11' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 44' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 45' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 22' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 24' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 32' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 39' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 45' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 32' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 33' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 34' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 35' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 36' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 37' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 38' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 39' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 40' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 41' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 42' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 43' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 44' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 45' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 46' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 47' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 48' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 49' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 50' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_