data_6a6j_residue ############################ # Computer software used # ############################ save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 6a6j _Structure_validation_residue.Date_analyzed 2019-06-14 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 ' 33' ' ' LYS . . . . . 0.657 ' N ' ' O ' ' A' ' 303' ' ' HOH . 5.8 mtpm? . . . . . 0 C--O 1.232 0.149 0 CA-C-O 121.007 0.432 . . . . 63.99 110.203 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 72.3 t -99.36 127.09 52.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 N-CA-C 114.848 1.425 . . . . 29.2 114.848 -165.042 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 12.1 mt -89.09 -42.89 14.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 115.984 -0.553 . . . . 37.41 110.82 175.156 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -146.08 151.06 37.09 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 115.969 -0.559 . . . . 33.37 110.216 177.797 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 39.8 p -118.71 152.93 35.22 Favored 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 113.604 0.964 . . . . 44.06 113.604 -176.689 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 1.7 pttp 32.01 49.1 0.12 Allowed 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 125.171 1.388 . . . . 69.61 113.991 -179.23 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -85.01 143.33 11.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.92 -0.582 . . . . 31.77 110.224 176.09 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 24.3 mt -94.91 137.64 33.7 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.219 -0.446 . . . . 37.1 111.263 179.401 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -140.55 161.16 26.59 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.837 -0.696 . . . . 33.84 113.988 -178.59 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 25.7 m -114.09 112.75 23.73 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 108.7 -0.852 . . . . 37.84 108.7 176.798 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 46.7 t -55.67 122.73 5.35 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.358 -0.383 . . . . 28.99 111.56 -177.968 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 18.9 tptt -78.78 -56.46 4.39 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.032 -0.531 . . . . 45.84 111.233 -176.879 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' TRP . . . . . . . . . . . . . 64.4 p-90 -160.71 149.56 16.72 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.091 -0.707 . . . . 37.96 109.091 176.005 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 45.5 t80 -146.93 113.14 5.86 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.259 0.552 . . . . 28.27 110.691 178.259 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 22.6 t-20 -84.0 109.34 17.56 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.558 -0.746 . . . . 38.19 110.026 177.225 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 7.5 p -63.09 -25.59 38.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.341 -0.391 . . . . 35.98 111.461 -175.499 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' ARG . . . . . 0.766 ' NH2' ' O ' ' A' ' 301' ' ' HOH . 1.8 mmm180 -73.61 -57.97 3.63 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 110.103 -0.332 . . . . 71.58 110.103 -179.986 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 92.2 m-20 -61.15 -29.07 69.57 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 113.549 0.944 . . . . 45.17 113.549 -179.585 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 86.92 18.64 57.69 Favored Glycine 0 N--CA 1.452 -0.283 0 N-CA-C 114.457 0.543 . . . . 34.74 114.457 177.309 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 39.1 p90 -150.4 176.66 10.71 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.045 0.45 . . . . 45.14 112.184 176.448 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -179.0 -157.48 19.58 Favored Glycine 0 N--CA 1.45 -0.37 0 N-CA-C 110.944 -0.862 . . . . 25.74 110.944 179.743 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 39.5 m-85 -135.92 140.66 44.21 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 113.239 0.829 . . . . 33.8 113.239 -179.982 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 56.4 mt -108.95 125.72 65.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.358 -0.837 . . . . 30.99 109.993 173.227 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' ASN . . . . . 0.652 ' ND2' ' OD1' ' A' ' 63' ' ' ASP . 13.2 t-20 -89.13 117.26 27.99 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.95 0.405 . . . . 36.65 111.228 175.878 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' ARG . . . . . 0.603 ' NH2' ' OD2' ' A' ' 59' ' ' ASP . 64.1 mtp180 -66.46 120.67 13.76 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.101 -0.5 . . . . 36.71 112.203 -177.306 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 10.3 m-20 -61.7 -30.4 70.73 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 106.815 -1.55 . . . . 35.83 106.815 169.608 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' ASP . . . . . 0.603 ' OD2' ' NH2' ' A' ' 57' ' ' ARG . 2.3 t70 -48.9 -67.89 0.23 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 113.998 -1.455 . . . . 57.97 113.162 172.859 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 71.7 p -121.06 -4.92 9.53 Favored 'General case' 0 C--O 1.235 0.314 0 N-CA-C 114.687 1.366 . . . . 35.06 114.687 -166.221 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 14.4 mmmt 66.11 12.39 8.47 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 123.743 0.817 . . . . 60.71 111.803 -174.895 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 58.9 mt-10 -85.12 146.83 26.94 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.457 -0.338 . . . . 34.85 110.298 174.51 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' ASP . . . . . 0.652 ' OD1' ' ND2' ' A' ' 56' ' ' ASN . 90.7 m-20 -87.59 136.55 32.9 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.845 0.355 . . . . 40.26 110.136 174.896 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 60.8 t -125.91 131.37 71.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 116.139 -0.482 . . . . 27.06 110.798 -177.949 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 60.8 t80 -64.72 136.3 56.79 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.828 -0.623 . . . . 36.72 111.83 -178.046 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 3.3 p -135.15 127.86 48.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 121.117 0.484 . . . . 29.82 111.584 177.968 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 51.7 t-80 -109.06 154.27 22.48 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.856 -0.611 . . . . 47.07 109.361 -179.523 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -52.97 -37.78 61.57 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 113.264 0.838 . . . . 57.04 113.264 -176.008 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 61.6 p -73.05 -13.93 61.31 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 113.415 0.895 . . . . 47.21 113.415 -176.09 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -83.82 -8.7 59.16 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 120.465 -0.494 . . . . 31.43 110.755 -179.195 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 66.5 mt -74.82 102.19 2.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 N-CA-C 109.651 -0.5 . . . . 30.23 109.651 179.526 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 9.5 tttm -74.18 -44.16 54.52 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.068 -0.515 . . . . 67.84 111.797 -175.428 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 6.0 mmtt -118.62 89.1 3.06 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.148 0.499 . . . . 52.11 112.125 -178.239 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 60.7 t30 -79.1 155.0 28.94 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.694 -0.684 . . . . 35.22 112.503 -178.43 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 59.8 t-20 -60.68 116.89 20.36 Favored Pre-proline 0 C--N 1.331 -0.234 0 N-CA-C 109.304 -0.628 . . . . 31.48 109.304 171.954 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -65.3 -15.59 50.67 Favored 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 121.06 1.174 . . . . 45.14 113.417 -176.634 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 32.6 mtt180 -96.82 2.57 51.99 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 112.488 0.551 . . . . 64.31 112.488 -176.066 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 35.3 mmtp -112.64 139.58 48.12 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.586 -0.279 . . . . 38.48 110.525 176.229 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 57.0 m-85 -64.06 -52.9 57.14 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.128 0.49 . . . . 42.56 111.96 -178.729 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 20.2 mt -89.65 166.93 13.3 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.596 -0.729 . . . . 36.95 111.692 -175.64 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' ARG . . . . . 0.457 ' N ' ' O ' ' A' ' 302' ' ' HOH . 24.9 mtt180 -99.47 119.76 38.54 Favored 'General case' 0 CA--C 1.513 -0.443 0 CA-C-N 115.68 -0.691 . . . . 65.42 110.263 175.834 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 83.7 p -156.51 168.5 27.18 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 115.399 -0.819 . . . . 43.08 111.47 -173.38 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 16.1 m -128.69 151.79 35.96 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.433 0 N-CA-C 107.472 -1.307 . . . . 35.68 107.472 168.565 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -98.85 153.1 19.79 Favored Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 121.128 -0.558 . . . . 33.52 112.679 -178.004 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -59.35 139.38 57.08 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.742 0.306 . . . . 54.18 110.459 176.998 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 79.26 -2.59 70.25 Favored Glycine 0 N--CA 1.453 -0.228 0 CA-C-N 116.285 -0.416 . . . . 36.89 113.916 177.572 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' GLU . . . . . 0.512 ' OE2' ' N ' ' A' ' 114' ' ' GLN . 43.0 tt0 -75.9 141.14 42.42 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 112.099 0.407 . . . . 50.16 112.099 -178.61 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 57.8 m -94.53 119.25 32.93 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.018 -0.537 . . . . 27.57 111.398 178.937 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 4.3 m -120.17 158.37 22.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 N-CA-C 112.746 0.646 . . . . 28.23 112.746 -176.123 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 44.3 tt0 -117.38 123.45 46.49 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 108.958 -0.756 . . . . 45.94 108.958 174.638 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 21.7 p90 -148.84 172.6 14.4 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 113.391 0.886 . . . . 32.0 113.391 -170.47 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 74.2 m-20 -107.67 141.47 39.12 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.274 -0.875 . . . . 48.71 109.315 170.519 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 41.5 t -94.01 111.28 24.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 N-CA-C 107.838 -1.171 . . . . 30.67 107.838 171.057 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 10.6 m -114.77 160.61 14.05 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 C-N-CA 120.929 -0.309 . . . . 34.76 110.928 -179.002 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 22.0 tt0 -75.16 127.54 33.44 Favored 'General case' 0 C--O 1.235 0.324 0 N-CA-C 108.847 -0.798 . . . . 57.19 108.847 171.941 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -112.59 -168.68 17.6 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 121.294 -0.479 . . . . 43.42 113.135 -179.538 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 59.3 mp0 -59.14 -40.31 85.1 Favored 'General case' 0 C--N 1.331 -0.196 0 N-CA-C 112.565 0.58 . . . . 47.86 112.565 -177.277 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -126.33 53.82 1.61 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.16 -0.473 . . . . 58.32 110.925 179.05 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 95.85 -172.26 29.55 Favored Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.968 -0.634 . . . . 39.82 111.958 -178.691 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -61.38 143.1 56.38 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 113.555 0.946 . . . . 36.73 113.555 -170.544 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 84.6 tt0 -141.91 161.02 39.01 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 108.625 -0.88 . . . . 65.06 108.625 177.838 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -84.56 147.95 26.74 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.912 -0.315 . . . . 30.94 110.16 175.23 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -139.73 160.27 40.27 Favored 'General case' 0 C--O 1.234 0.279 0 C-N-CA 121.269 -0.172 . . . . 29.01 110.721 177.123 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 6.8 m-80 38.38 54.04 1.8 Allowed 'General case' 0 N--CA 1.463 0.18 0 O-C-N 123.989 0.806 . . . . 57.32 113.167 -174.149 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 18.2 t -66.9 129.12 31.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 115.824 -0.625 . . . . 31.74 109.926 174.552 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 65.5 p -140.83 -178.19 5.43 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 107.166 -1.42 . . . . 34.75 107.166 174.731 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -79.04 175.9 54.92 Favored Glycine 0 N--CA 1.449 -0.477 0 N-CA-C 107.048 -2.421 . . . . 32.58 107.048 168.604 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -57.34 136.09 74.05 Favored 'Trans proline' 0 C--O 1.232 0.205 0 O-C-N 122.785 0.887 . . . . 39.95 111.431 174.375 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 82.63 -10.92 54.62 Favored Glycine 0 CA--C 1.518 0.26 0 O-C-N 123.142 0.277 . . . . 33.8 113.601 179.131 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 102.65 11.14 36.12 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 121.415 -0.422 . . . . 43.98 113.108 -179.759 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 16.0 m -70.99 158.76 87.48 Favored Pre-proline 0 C--N 1.328 -0.332 0 N-CA-C 108.749 -0.834 . . . . 34.28 108.749 176.737 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -57.87 145.72 89.61 Favored 'Trans proline' 0 C--N 1.346 0.403 0 O-C-N 122.624 0.802 . . . . 29.97 112.363 177.596 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 11.3 m -66.89 160.66 4.02 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 O-C-N 123.418 0.448 . . . . 31.62 109.812 175.707 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' GLN . . . . . 0.512 ' N ' ' OE2' ' A' ' 87' ' ' GLU . 1.6 tt0 -79.18 -45.25 20.27 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 111.845 0.313 . . . . 72.47 111.845 -178.148 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . 91.91 164.09 38.49 Favored Glycine 0 N--CA 1.45 -0.433 0 C-N-CA 121.426 -0.416 . . . . 39.82 113.539 177.213 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 15.2 t -72.54 153.13 41.47 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 115.206 1.558 . . . . 38.52 115.206 -172.079 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 22.7 mtpt -53.92 -32.41 53.46 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 114.92 -1.036 . . . . 58.87 111.389 171.76 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 27.7 m-85 -93.5 -11.35 32.18 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.466 -0.788 . . . . 60.36 112.819 -167.831 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -81.06 140.32 35.18 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 109.634 -0.506 . . . . 30.24 109.634 173.341 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -93.42 150.58 20.35 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 113.682 0.993 . . . . 37.91 113.682 -169.462 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 2.3 p-10 -74.5 147.05 42.2 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.604 -0.725 . . . . 70.06 111.948 178.36 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' ARG . . . . . 0.57 ' NH1' ' O ' ' A' ' 304' ' ' HOH . 90.0 mtt-85 . . . . . 0 C--N 1.33 -0.28 0 CA-C-N 116.338 -0.392 . . . . 48.07 110.735 175.212 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 2' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.425 -0.961 0 O5'-C5'-C4' 112.02 1.3 . 0.0 '__' . 58.38 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 3' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.424 -0.978 0 C2'-C3'-O3' 107.716 -1.173 . 0.768 4b . 55.39 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 4' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.425 -0.968 0 P-O3'-C3' 121.599 1.583 . 0.0 OUTLIER alpha 48.98 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 5' ' ' 5MC . . . . . 0.426 ' OP2' ' O ' ' B' ' 101' ' ' HOH . . . . . . . . 0 P--OP2 1.516 1.845 0 C4'-C3'-O3' 114.778 1.607 . 0.118 0a . 57.16 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 6' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.422 -1.128 3 OP2-P-O3' 79.611 -8.965 . 0.0 OUTLIER . 93.96 . . . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 33' ' ' LYS . . . . . . . . . . . . . 2.0 mmtp . . . . . 0 CA--C 1.531 0.247 0 N-CA-C 109.464 -0.569 . . . . 60.86 109.464 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 34' ' ' VAL . . . . . . . . . . . . . 24.9 t -95.84 140.84 16.3 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.499 0 N-CA-C 114.878 1.436 . . . . 40.52 114.878 -162.793 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 35' ' ' ILE . . . . . . . . . . . . . 65.6 mt -112.29 -32.07 2.16 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 C-N-CA 123.475 0.71 . . . . 35.23 112.612 -177.628 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 36' ' ' ALA . . . . . . . . . . . . . . . -164.98 149.43 9.05 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 110.117 -0.327 . . . . 36.76 110.117 176.363 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 37' ' ' THR . . . . . . . . . . . . . 80.9 p -127.54 152.48 47.55 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 113.056 0.762 . . . . 51.45 113.056 -177.163 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 38' ' ' LYS . . . . . . . . . . . . . 99.6 mttt 48.91 47.42 21.54 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.157 -0.928 . . . . 68.4 111.542 -179.186 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 39' ' ' VAL . . . . . . . . . . . . . 22.0 t -84.67 133.42 29.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 115.512 -0.767 . . . . 34.29 110.065 177.475 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 40' ' ' LEU . . . . . . . . . . . . . 12.9 mt -101.74 140.74 35.61 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.589 -0.522 . . . . 37.56 109.589 174.208 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 41' ' ' GLY . . . . . . . . . . . . . . . -155.75 176.43 33.27 Favored Glycine 0 N--CA 1.447 -0.583 0 CA-C-N 115.929 -0.578 . . . . 34.78 112.547 -175.699 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 42' ' ' THR . . . . . . . . . . . . . 82.7 m -122.59 132.45 54.3 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 108.805 -0.813 . . . . 38.91 108.805 177.495 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 43' ' ' VAL . . . . . . . . . . . . . 79.1 t -64.26 119.55 8.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 109.493 -0.558 . . . . 28.41 109.493 177.974 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 44' ' ' LYS . . . . . . . . . . . . . 43.8 tttm -75.76 -55.24 5.83 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.626 -0.716 . . . . 56.01 109.202 -178.859 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 45' ' ' TRP . . . . . . . . . . . . . 68.1 p-90 -160.69 160.34 31.35 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.306 -0.861 . . . . 33.01 108.89 168.863 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 46' ' ' PHE . . . . . . . . . . . . . 44.1 t80 -145.47 113.0 6.27 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.282 -0.636 . . . . 35.7 109.282 177.144 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 47' ' ' ASN . . . . . . . . . . . . . 19.1 t-20 -77.45 103.95 7.69 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.617 -0.512 . . . . 43.42 109.617 176.967 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 48' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -56.95 -42.47 78.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.289 -0.869 . . . . 38.95 112.639 -175.601 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 49' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -75.91 -29.4 58.4 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.855 0.687 . . . . 71.68 112.855 -175.323 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 50' ' ' ASN . . . . . . . . . . . . . 98.5 m-20 -87.7 -23.22 24.24 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.862 0.363 . . . . 55.96 111.733 176.977 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 51' ' ' GLY . . . . . . . . . . . . . . . 86.01 22.14 50.12 Favored Glycine 0 N--CA 1.451 -0.332 0 N-CA-C 115.786 1.074 . . . . 36.77 115.786 173.254 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 52' ' ' TYR . . . . . . . . . . . . . 27.1 p90 -152.71 170.44 20.26 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.214 0.53 . . . . 55.46 110.707 176.207 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 53' ' ' GLY . . . . . . . . . . . . . . . -174.97 -165.06 30.7 Favored Glycine 0 N--CA 1.446 -0.644 0 N-CA-C 108.277 -1.929 . . . . 24.83 108.277 178.622 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 54' ' ' PHE . . . . . . . . . . . . . 64.2 m-85 -127.41 146.17 50.57 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 112.893 0.701 . . . . 30.08 112.893 -179.299 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 55' ' ' ILE . . . . . . . . . . . . . 58.0 mt -111.16 132.36 59.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.099 -0.955 . . . . 35.04 109.832 175.423 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 56' ' ' ASN . . . . . . . . . . . . . 50.7 t30 -90.58 107.08 18.94 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.949 -0.568 . . . . 51.79 110.202 179.143 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 57' ' ' ARG . . . . . 0.443 ' NH2' ' OD2' ' C' ' 59' ' ' ASP . 53.5 mtp180 -57.16 129.86 43.62 Favored 'General case' 0 C--O 1.218 -0.596 0 CA-C-N 116.405 -0.361 . . . . 35.56 110.784 179.835 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 58' ' ' ASN . . . . . 0.611 ' O ' ' O ' ' C' ' 303' ' ' HOH . 11.1 m-20 -73.41 -25.7 60.65 Favored 'General case' 0 CA--C 1.512 -0.515 0 N-CA-C 113.714 1.005 . . . . 35.87 113.714 179.762 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 59' ' ' ASP . . . . . 0.443 ' OD2' ' NH2' ' C' ' 57' ' ' ARG . 26.3 p-10 -84.52 -29.88 25.6 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.063 -0.517 . . . . 43.48 111.842 -174.218 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 54.0 p -127.37 -13.31 5.53 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 113.173 0.805 . . . . 37.2 113.173 -174.654 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 61' ' ' LYS . . . . . . . . . . . . . 12.0 mmtt 58.28 24.19 11.24 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 124.493 1.117 . . . . 57.23 111.984 -176.867 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 62' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -81.55 142.52 32.77 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 108.59 -0.893 . . . . 42.95 108.59 170.822 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 63' ' ' ASP . . . . . 0.649 ' N ' ' O ' ' C' ' 306' ' ' HOH . 34.6 m-20 -73.06 138.78 46.1 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.486 -0.561 . . . . 40.9 109.486 172.439 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 64' ' ' VAL . . . . . . . . . . . . . 60.1 t -128.65 129.63 68.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.97 0.414 . . . . 30.64 111.005 176.502 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 65' ' ' PHE . . . . . . . . . . . . . 48.1 t80 -66.77 134.1 51.5 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.583 -0.735 . . . . 28.73 111.25 178.818 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 66' ' ' VAL . . . . . . . . . . . . . 2.4 p -135.09 126.6 46.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 121.17 0.51 . . . . 26.26 110.711 175.309 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 67' ' ' HIS . . . . . . . . . . . . . 11.0 t-80 -95.58 157.09 16.05 Favored 'General case' 0 N--CA 1.453 -0.325 0 N-CA-C 108.596 -0.891 . . . . 30.13 108.596 176.126 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 68' ' ' GLN . . . . . . . . . . . . . 9.4 pt20 -62.8 -18.94 63.53 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 111.887 0.328 . . . . 66.9 111.887 -177.455 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 69' ' ' THR . . . . . . . . . . . . . 11.9 t -81.03 -6.14 58.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.418 -0.356 . . . . 49.35 111.517 179.101 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 70' ' ' ALA . . . . . . . . . . . . . . . -88.13 -8.54 55.28 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.821 0.343 . . . . 32.2 111.3 -179.192 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 71' ' ' ILE . . . . . . . . . . . . . 64.6 mt -80.85 100.51 5.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 121.164 0.507 . . . . 37.65 111.114 -177.601 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 72' ' ' LYS . . . . . . . . . . . . . 81.4 tttt -70.97 -39.1 72.72 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.564 -0.744 . . . . 56.21 111.947 -177.254 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 73' ' ' LYS . . . . . . . . . . . . . 67.9 mttt -124.72 87.86 2.79 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.198 0.523 . . . . 58.87 111.615 -176.948 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 74' ' ' ASN . . . . . 0.755 ' OD1' ' O ' ' C' ' 301' ' ' HOH . 66.7 t30 -79.16 154.1 29.55 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.494 -0.775 . . . . 35.2 111.831 -178.677 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 75' ' ' ASN . . . . . . . . . . . . . 59.5 t-20 -61.17 112.95 6.63 Favored Pre-proline 0 C--N 1.33 -0.26 0 N-CA-C 109.508 -0.553 . . . . 38.27 109.508 172.465 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 76' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_endo -60.46 -27.91 85.73 Favored 'Trans proline' 0 C--N 1.342 0.209 0 C-N-CA 122.425 2.083 . . . . 39.07 113.079 -175.767 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 77' ' ' ARG . . . . . . . . . . . . . 8.9 mtt180 -81.47 1.14 34.62 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 112.803 0.668 . . . . 73.1 112.803 -178.215 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 78' ' ' LYS . . . . . . . . . . . . . 14.5 mmtt -108.04 151.39 25.91 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.871 0.367 . . . . 54.76 111.856 178.033 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 79' ' ' TYR . . . . . . . . . . . . . 92.3 m-85 -75.68 -32.41 60.12 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.363 0.601 . . . . 43.76 109.927 173.585 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 80' ' ' LEU . . . . . 0.463 ' O ' ' ND2' ' C' ' 74' ' ' ASN . 5.5 mp -95.17 151.9 18.82 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.181 -0.918 . . . . 47.37 112.611 -166.454 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 81' ' ' ARG . . . . . . . . . . . . . 8.9 mtm180 -93.22 101.68 13.96 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 107.869 -1.16 . . . . 62.35 107.869 167.162 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 82' ' ' SER . . . . . . . . . . . . . 26.1 p -150.32 164.2 36.38 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.323 0.582 . . . . 34.92 111.922 -174.579 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 83' ' ' VAL . . . . . . . . . . . . . 15.8 m -126.05 146.02 32.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 N-CA-C 107.17 -1.418 . . . . 32.5 107.17 168.672 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 84' ' ' GLY . . . . . . . . . . . . . . . -91.34 149.46 19.86 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 121.08 -0.581 . . . . 32.44 112.88 -178.087 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 85' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -61.41 129.58 41.88 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.735 0.303 . . . . 44.67 111.127 -179.879 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 86' ' ' GLY . . . . . . . . . . . . . . . 87.89 -2.91 86.0 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 121.328 -0.463 . . . . 34.08 112.847 179.408 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 87' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -76.0 140.91 42.24 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 119.412 -0.915 . . . . 44.71 111.461 179.846 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 88' ' ' THR . . . . . . . . . . . . . 1.5 m -81.34 123.32 28.43 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 114.419 -1.264 . . . . 41.11 110.128 176.953 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 89' ' ' VAL . . . . . . . . . . . . . 4.5 m -130.1 155.13 41.35 Favored 'Isoleucine or valine' 0 C--O 1.232 0.164 0 N-CA-C 113.249 0.833 . . . . 31.28 113.249 -176.895 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 90' ' ' GLU . . . . . . . . . . . . . 57.2 tt0 -119.32 136.38 54.28 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.014 -0.994 . . . . 51.08 108.925 174.929 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 91' ' ' PHE . . . . . . . . . . . . . 26.8 p90 -163.24 169.1 19.72 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 113.41 0.892 . . . . 28.2 113.41 -169.312 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 92' ' ' ASP . . . . . . . . . . . . . 86.2 m-20 -108.5 145.44 34.71 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.408 -0.815 . . . . 33.5 109.736 171.979 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 93' ' ' VAL . . . . . . . . . . . . . 38.2 t -97.81 124.57 50.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 N-CA-C 108.563 -0.903 . . . . 39.48 108.563 171.557 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 94' ' ' VAL . . . . . . . . . . . . . 33.3 m -125.61 165.24 23.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 N-CA-C 109.791 -0.448 . . . . 35.73 109.791 177.981 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 95' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -85.84 126.32 33.96 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 120.51 -0.476 . . . . 65.16 110.163 177.424 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 96' ' ' GLY . . . . . . . . . . . . . . . -112.13 -160.63 15.53 Favored Glycine 0 N--CA 1.45 -0.412 0 CA-C-N 115.963 -0.562 . . . . 39.38 114.013 -174.77 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 97' ' ' GLU . . . . . . . . . . . . . 52.1 mp0 -59.88 -45.98 90.76 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 112.256 0.465 . . . . 53.31 112.256 -177.291 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 98' ' ' LYS . . . . . . . . . . . . . 87.6 mttt -118.89 -8.59 10.26 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 113.043 0.757 . . . . 49.44 113.043 -172.967 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 99' ' ' GLY . . . . . . . . . . . . . . . 171.14 -152.75 19.05 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.752 -0.737 . . . . 38.31 113.484 177.918 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 100' ' ' ALA . . . . . . . . . . . . . . . -73.2 129.14 37.4 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.803 0.335 . . . . 39.06 110.55 178.91 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 101' ' ' GLU . . . . . 0.439 ' OE2' ' O ' ' C' ' 304' ' ' HOH . 62.8 mt-10 -129.94 146.3 51.64 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.916 -0.584 . . . . 46.88 110.91 178.367 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 102' ' ' ALA . . . . . . . . . . . . . . . -74.12 148.34 41.88 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.464 -0.569 . . . . 27.89 109.464 174.237 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 103' ' ' ALA . . . . . . . . . . . . . . . -146.78 156.84 43.45 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.453 -0.34 . . . . 33.41 110.651 178.459 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 104' ' ' ASN . . . . . . . . . . . . . 80.7 m-20 54.49 40.88 32.14 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.911 -0.586 . . . . 39.29 112.032 -179.972 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 105' ' ' VAL . . . . . . . . . . . . . 14.6 t -70.35 123.47 24.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.028 -0.533 . . . . 39.16 112.075 -174.94 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 106' ' ' THR . . . . . . . . . . . . . 5.2 p -133.42 174.96 9.84 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.872 -0.604 . . . . 36.47 109.836 175.323 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 107' ' ' GLY . . . . . 0.477 ' N ' ' O ' ' C' ' 111' ' ' VAL . . . -79.63 171.62 54.73 Favored Glycine 0 C--O 1.226 -0.4 0 N-CA-C 108.447 -1.861 . . . . 36.04 108.447 170.584 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 108' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_exo -50.4 115.86 2.17 Favored 'Trans proline' 0 N--CA 1.466 -0.135 0 C-N-CA 125.215 3.943 . . . . 39.25 113.209 -178.958 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 109' ' ' GLY . . . . . . . . . . . . . . . 81.17 39.19 13.2 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 121.13 -0.557 . . . . 47.87 113.454 174.487 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 110' ' ' GLY . . . . . . . . . . . . . . . 67.27 21.26 72.0 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 121.845 -0.217 . . . . 39.32 113.156 176.39 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 111' ' ' VAL . . . . . 0.477 ' O ' ' N ' ' C' ' 107' ' ' GLY . 1.6 t -89.99 147.31 36.96 Favored Pre-proline 0 C--N 1.327 -0.39 0 N-CA-C 108.425 -0.954 . . . . 43.85 108.425 177.863 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 112' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_exo -55.93 150.01 48.78 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 120.485 0.79 . . . . 39.89 113.088 176.806 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 113' ' ' VAL . . . . . . . . . . . . . 15.0 m -67.59 164.25 2.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 N-CA-C 108.663 -0.865 . . . . 36.96 108.663 172.292 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 114' ' ' GLN . . . . . . . . . . . . . 10.2 mt-30 -96.71 -25.35 15.57 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.33 -0.548 . . . . 53.21 112.005 178.015 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 115' ' ' GLY . . . . . . . . . . . . . . . 86.15 -178.25 49.37 Favored Glycine 0 CA--C 1.519 0.296 0 C-N-CA 121.509 -0.377 . . . . 27.16 113.178 175.331 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 116' ' ' SER . . . . . . . . . . . . . 1.4 t -82.56 151.18 26.52 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 112.04 0.385 . . . . 32.28 112.04 -175.263 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 117' ' ' LYS . . . . . . . . . . . . . 1.5 ttpt -62.35 -24.76 67.52 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.617 -0.719 . . . . 57.48 110.419 175.67 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 118' ' ' TYR . . . . . . . . . . . . . 50.6 m-85 -94.69 4.8 53.39 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.833 -0.621 . . . . 51.91 111.65 -175.645 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 119' ' ' ALA . . . . . . . . . . . . . . . -86.34 132.71 33.9 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.519 -0.548 . . . . 41.33 109.519 170.877 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 120' ' ' ALA . . . . . 0.643 ' O ' ' O ' ' C' ' 302' ' ' HOH . . . -84.68 138.77 32.47 Favored 'General case' 0 N--CA 1.464 0.246 0 N-CA-C 113.535 0.939 . . . . 41.98 113.535 -173.469 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 121' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -68.8 148.68 49.95 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.629 -0.714 . . . . 60.58 109.925 175.074 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 122' ' ' ARG . . . . . . . . . . . . . 71.0 mtt180 . . . . . 0 C--N 1.329 -0.31 0 CA-C-O 121.037 0.446 . . . . 54.23 111.322 177.469 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 2' ' ' ' C' . . . . . 0.68 ' OP1' ' O ' ' D' ' 101' ' ' HOH . . . . . . . . 0 O5'--C5' 1.426 -0.858 0 O5'-C5'-C4' 111.888 1.206 . 0.0 '__' . 53.07 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 3' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.424 -0.973 0 O5'-C5'-C4' 111.399 0.856 . 0.489 4b . 45.29 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 4' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.422 -1.095 0 O5'-C5'-C4' 111.751 1.108 . 0.458 4b . 46.18 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 5' ' ' 5MC . . . . . . . . . . . . . . . . . . . . 0 P--OP2 1.516 1.844 0 O4'-C4'-C3' 103.294 -1.576 . 0.01 0a . 64.22 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 6' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.425 -0.967 0 O5'-C5'-C4' 111.718 1.084 . 0.0 OUTLIER . 79.41 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 301' ' ' HOH . . . . . 0.766 ' O ' ' NH2' ' A' ' 49' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 302' ' ' HOH . . . . . 0.457 ' O ' ' N ' ' A' ' 81' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 303' ' ' HOH . . . . . 0.657 ' O ' ' N ' ' A' ' 33' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 304' ' ' HOH . . . . . 0.57 ' O ' ' NH1' ' A' ' 122' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 313' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 316' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 317' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 318' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 319' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 320' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 321' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 322' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 101' ' ' HOH . . . . . 0.426 ' O ' ' OP2' ' B' ' 5' ' ' 5MC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 301' ' ' HOH . . . . . 0.755 ' O ' ' OD1' ' C' ' 74' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 302' ' ' HOH . . . . . 0.643 ' O ' ' O ' ' C' ' 120' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 303' ' ' HOH . . . . . 0.611 ' O ' ' O ' ' C' ' 58' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 304' ' ' HOH . . . . . 0.439 ' O ' ' OE2' ' C' ' 101' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 306' ' ' HOH . . . . . 0.649 ' O ' ' N ' ' C' ' 63' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 313' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 316' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 317' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 318' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 101' ' ' HOH . . . . . 0.68 ' O ' ' OP1' ' D' ' 2' ' ' ' C' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 33' ' ' LYS . . . . . 0.657 ' N ' ' O ' ' A' ' 303' ' ' HOH . 5.8 mtpm? . . . . . 0 C--O 1.232 0.149 0 CA-C-O 121.007 0.432 . . . . 63.99 110.203 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 72.3 t -99.36 127.09 52.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 N-CA-C 114.848 1.425 . . . . 29.2 114.848 -165.042 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 12.1 mt -89.09 -42.89 14.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 115.984 -0.553 . . . . 37.41 110.82 175.156 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -146.08 151.06 37.09 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 115.969 -0.559 . . . . 33.37 110.216 177.797 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 39.8 p -118.71 152.93 35.22 Favored 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 113.604 0.964 . . . . 44.06 113.604 -176.689 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 1.7 pttp 32.01 49.1 0.12 Allowed 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 125.171 1.388 . . . . 69.61 113.991 -179.23 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -85.01 143.33 11.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.92 -0.582 . . . . 31.77 110.224 176.09 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 24.3 mt -94.91 137.64 33.7 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.219 -0.446 . . . . 37.1 111.263 179.401 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -140.55 161.16 26.59 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.837 -0.696 . . . . 33.84 113.988 -178.59 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 25.7 m -114.09 112.75 23.73 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 108.7 -0.852 . . . . 37.84 108.7 176.798 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 46.7 t -55.67 122.73 5.35 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.358 -0.383 . . . . 28.99 111.56 -177.968 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 18.9 tptt -78.78 -56.46 4.39 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.032 -0.531 . . . . 45.84 111.233 -176.879 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' TRP . . . . . . . . . . . . . 64.4 p-90 -160.71 149.56 16.72 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.091 -0.707 . . . . 37.96 109.091 176.005 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 45.5 t80 -146.93 113.14 5.86 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.259 0.552 . . . . 28.27 110.691 178.259 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 22.6 t-20 -84.0 109.34 17.56 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.558 -0.746 . . . . 38.19 110.026 177.225 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 7.5 p -63.09 -25.59 38.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.341 -0.391 . . . . 35.98 111.461 -175.499 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' ARG . . . . . 0.498 ' NH2' ' O ' ' A' ' 301' ' ' HOH . 1.8 mmm180 -73.61 -57.97 3.63 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 110.103 -0.332 . . . . 71.58 110.103 -179.986 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 92.2 m-20 -61.15 -29.07 69.57 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 113.549 0.944 . . . . 45.17 113.549 -179.585 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 86.92 18.64 57.69 Favored Glycine 0 N--CA 1.452 -0.283 0 N-CA-C 114.457 0.543 . . . . 34.74 114.457 177.309 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 39.1 p90 -150.4 176.66 10.71 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.045 0.45 . . . . 45.14 112.184 176.448 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -179.0 -157.48 19.58 Favored Glycine 0 N--CA 1.45 -0.37 0 N-CA-C 110.944 -0.862 . . . . 25.74 110.944 179.743 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 39.5 m-85 -135.92 140.66 44.21 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 113.239 0.829 . . . . 33.8 113.239 -179.982 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 56.4 mt -108.95 125.72 65.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.358 -0.837 . . . . 30.99 109.993 173.227 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' ASN . . . . . 0.652 ' ND2' ' OD1' ' A' ' 63' ' ' ASP . 13.2 t-20 -89.13 117.26 27.99 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.95 0.405 . . . . 36.65 111.228 175.878 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 57' ' ' ARG . . . . . 0.598 ' NH2' ' OD2' ' A' ' 59' ' ' ASP . 64.1 mtp180 -66.46 120.67 13.76 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.101 -0.5 . . . . 36.71 112.203 -177.306 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 10.3 m-20 -61.7 -30.4 70.73 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 106.815 -1.55 . . . . 35.83 106.815 169.608 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' ASP . . . . . 0.598 ' OD2' ' NH2' ' A' ' 57' ' ' ARG . 2.3 t70 -48.9 -67.89 0.23 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 113.998 -1.455 . . . . 57.97 113.162 172.859 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 71.7 p -121.06 -4.92 9.53 Favored 'General case' 0 C--O 1.235 0.314 0 N-CA-C 114.687 1.366 . . . . 35.06 114.687 -166.221 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' LYS . . . . . 0.437 ' HD2' ' HA ' ' A' ' 61' ' ' LYS . 14.4 mmmt 66.11 12.39 8.47 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 123.743 0.817 . . . . 60.71 111.803 -174.895 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 58.9 mt-10 -85.12 146.83 26.94 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.457 -0.338 . . . . 34.85 110.298 174.51 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' ASP . . . . . 0.652 ' OD1' ' ND2' ' A' ' 56' ' ' ASN . 90.7 m-20 -87.59 136.55 32.9 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.845 0.355 . . . . 40.26 110.136 174.896 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 60.8 t -125.91 131.37 71.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 116.139 -0.482 . . . . 27.06 110.798 -177.949 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 60.8 t80 -64.72 136.3 56.79 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.828 -0.623 . . . . 36.72 111.83 -178.046 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 3.3 p -135.15 127.86 48.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 121.117 0.484 . . . . 29.82 111.584 177.968 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 51.7 t-80 -109.06 154.27 22.48 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.856 -0.611 . . . . 47.07 109.361 -179.523 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' GLN . . . . . 0.449 ' HG3' ' HB2' ' A' ' 81' ' ' ARG . 1.8 tt0 -52.97 -37.78 61.57 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 113.264 0.838 . . . . 57.04 113.264 -176.008 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 61.6 p -73.05 -13.93 61.31 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 113.415 0.895 . . . . 47.21 113.415 -176.09 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -83.82 -8.7 59.16 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 120.465 -0.494 . . . . 31.43 110.755 -179.195 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 66.5 mt -74.82 102.19 2.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 N-CA-C 109.651 -0.5 . . . . 30.23 109.651 179.526 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' LYS . . . . . 0.591 ' HB2' ' HA ' ' A' ' 104' ' ' ASN . 9.5 tttm -74.18 -44.16 54.52 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.068 -0.515 . . . . 67.84 111.797 -175.428 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 6.0 mmtt -118.62 89.1 3.06 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.148 0.499 . . . . 52.11 112.125 -178.239 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 60.7 t30 -79.1 155.0 28.94 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.694 -0.684 . . . . 35.22 112.503 -178.43 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 59.8 t-20 -60.68 116.89 20.36 Favored Pre-proline 0 C--N 1.331 -0.234 0 N-CA-C 109.304 -0.628 . . . . 31.48 109.304 171.954 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -65.3 -15.59 50.67 Favored 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 121.06 1.174 . . . . 45.14 113.417 -176.634 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 32.6 mtt180 -96.82 2.57 51.99 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 112.488 0.551 . . . . 64.31 112.488 -176.066 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 35.3 mmtp -112.64 139.58 48.12 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.586 -0.279 . . . . 38.48 110.525 176.229 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' TYR . . . . . 0.441 ' HB2' ' O ' ' A' ' 310' ' ' HOH . 57.0 m-85 -64.06 -52.9 57.14 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.128 0.49 . . . . 42.56 111.96 -178.729 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 20.2 mt -89.65 166.93 13.3 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.596 -0.729 . . . . 36.95 111.692 -175.64 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' ARG . . . . . 0.449 ' HB2' ' HG3' ' A' ' 68' ' ' GLN . 24.9 mtt180 -99.47 119.76 38.54 Favored 'General case' 0 CA--C 1.513 -0.443 0 CA-C-N 115.68 -0.691 . . . . 65.42 110.263 175.834 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 83.7 p -156.51 168.5 27.18 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 115.399 -0.819 . . . . 43.08 111.47 -173.38 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 16.1 m -128.69 151.79 35.96 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.433 0 N-CA-C 107.472 -1.307 . . . . 35.68 107.472 168.565 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -98.85 153.1 19.79 Favored Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 121.128 -0.558 . . . . 33.52 112.679 -178.004 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -59.35 139.38 57.08 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.742 0.306 . . . . 54.18 110.459 176.998 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 79.26 -2.59 70.25 Favored Glycine 0 N--CA 1.453 -0.228 0 CA-C-N 116.285 -0.416 . . . . 36.89 113.916 177.572 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -75.9 141.14 42.42 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 112.099 0.407 . . . . 50.16 112.099 -178.61 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 57.8 m -94.53 119.25 32.93 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.018 -0.537 . . . . 27.57 111.398 178.937 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 4.3 m -120.17 158.37 22.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 N-CA-C 112.746 0.646 . . . . 28.23 112.746 -176.123 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 44.3 tt0 -117.38 123.45 46.49 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 108.958 -0.756 . . . . 45.94 108.958 174.638 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 21.7 p90 -148.84 172.6 14.4 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 113.391 0.886 . . . . 32.0 113.391 -170.47 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 74.2 m-20 -107.67 141.47 39.12 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.274 -0.875 . . . . 48.71 109.315 170.519 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 41.5 t -94.01 111.28 24.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 N-CA-C 107.838 -1.171 . . . . 30.67 107.838 171.057 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 10.6 m -114.77 160.61 14.05 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 C-N-CA 120.929 -0.309 . . . . 34.76 110.928 -179.002 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 22.0 tt0 -75.16 127.54 33.44 Favored 'General case' 0 C--O 1.235 0.324 0 N-CA-C 108.847 -0.798 . . . . 57.19 108.847 171.941 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -112.59 -168.68 17.6 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 121.294 -0.479 . . . . 43.42 113.135 -179.538 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 59.3 mp0 -59.14 -40.31 85.1 Favored 'General case' 0 C--N 1.331 -0.196 0 N-CA-C 112.565 0.58 . . . . 47.86 112.565 -177.277 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -126.33 53.82 1.61 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.16 -0.473 . . . . 58.32 110.925 179.05 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 95.85 -172.26 29.55 Favored Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.968 -0.634 . . . . 39.82 111.958 -178.691 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -61.38 143.1 56.38 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 113.555 0.946 . . . . 36.73 113.555 -170.544 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 84.6 tt0 -141.91 161.02 39.01 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 108.625 -0.88 . . . . 65.06 108.625 177.838 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -84.56 147.95 26.74 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.912 -0.315 . . . . 30.94 110.16 175.23 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -139.73 160.27 40.27 Favored 'General case' 0 C--O 1.234 0.279 0 C-N-CA 121.269 -0.172 . . . . 29.01 110.721 177.123 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' ASN . . . . . 0.591 ' HA ' ' HB2' ' A' ' 72' ' ' LYS . 6.8 m-80 38.38 54.04 1.8 Allowed 'General case' 0 N--CA 1.463 0.18 0 O-C-N 123.989 0.806 . . . . 57.32 113.167 -174.149 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 18.2 t -66.9 129.12 31.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 115.824 -0.625 . . . . 31.74 109.926 174.552 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 65.5 p -140.83 -178.19 5.43 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 107.166 -1.42 . . . . 34.75 107.166 174.731 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -79.04 175.9 54.92 Favored Glycine 0 N--CA 1.449 -0.477 0 N-CA-C 107.048 -2.421 . . . . 32.58 107.048 168.604 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -57.34 136.09 74.05 Favored 'Trans proline' 0 C--O 1.232 0.205 0 O-C-N 122.785 0.887 . . . . 39.95 111.431 174.375 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 82.63 -10.92 54.62 Favored Glycine 0 CA--C 1.518 0.26 0 O-C-N 123.142 0.277 . . . . 33.8 113.601 179.131 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 102.65 11.14 36.12 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 121.415 -0.422 . . . . 43.98 113.108 -179.759 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 16.0 m -70.99 158.76 87.48 Favored Pre-proline 0 C--N 1.328 -0.332 0 N-CA-C 108.749 -0.834 . . . . 34.28 108.749 176.737 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -57.87 145.72 89.61 Favored 'Trans proline' 0 C--N 1.346 0.403 0 O-C-N 122.624 0.802 . . . . 29.97 112.363 177.596 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 11.3 m -66.89 160.66 4.02 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 O-C-N 123.418 0.448 . . . . 31.62 109.812 175.707 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -79.18 -45.25 20.27 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 111.845 0.313 . . . . 72.47 111.845 -178.148 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . 91.91 164.09 38.49 Favored Glycine 0 N--CA 1.45 -0.433 0 C-N-CA 121.426 -0.416 . . . . 39.82 113.539 177.213 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 15.2 t -72.54 153.13 41.47 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 115.206 1.558 . . . . 38.52 115.206 -172.079 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 22.7 mtpt -53.92 -32.41 53.46 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 114.92 -1.036 . . . . 58.87 111.389 171.76 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 27.7 m-85 -93.5 -11.35 32.18 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.466 -0.788 . . . . 60.36 112.819 -167.831 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -81.06 140.32 35.18 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 109.634 -0.506 . . . . 30.24 109.634 173.341 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -93.42 150.58 20.35 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 113.682 0.993 . . . . 37.91 113.682 -169.462 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 2.3 p-10 -74.5 147.05 42.2 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.604 -0.725 . . . . 70.06 111.948 178.36 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 90.0 mtt-85 . . . . . 0 C--N 1.33 -0.28 0 CA-C-N 116.338 -0.392 . . . . 48.07 110.735 175.212 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 2' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.425 -0.961 0 O5'-C5'-C4' 112.02 1.3 . 0.0 '__' . 58.38 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 3' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.424 -0.978 0 C2'-C3'-O3' 107.716 -1.173 . 0.768 4b . 55.39 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 4' ' ' ' U' . . . . . 0.431 " H4'" " H5'" ' B' ' 5' ' ' 5MC . . . . . . . . 0 O5'--C5' 1.425 -0.968 0 P-O3'-C3' 121.599 1.583 . 0.0 OUTLIER alpha 48.98 . . . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 5' ' ' 5MC . . . . . 0.752 " H2'" " H4'" ' B' ' 6' ' ' ' U' . . . . . . . . 0 P--OP2 1.516 1.845 0 C4'-C3'-O3' 114.778 1.607 . 0.118 0a . 57.16 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 6' ' ' ' U' . . . . . 0.752 " H4'" " H2'" ' B' ' 5' ' ' 5MC . . . . . . . . 0 O5'--C5' 1.422 -1.128 3 OP2-P-O3' 79.611 -8.965 . 0.0 OUTLIER . 93.96 . . . . . . . . . . 3 3 . 1 . 001 ecloud build full ' C' C ' 33' ' ' LYS . . . . . . . . . . . . . 2.0 mmtp . . . . . 0 CA--C 1.531 0.247 0 N-CA-C 109.464 -0.569 . . . . 60.86 109.464 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 34' ' ' VAL . . . . . . . . . . . . . 24.9 t -95.84 140.84 16.3 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.499 0 N-CA-C 114.878 1.436 . . . . 40.52 114.878 -162.793 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 35' ' ' ILE . . . . . 0.685 HD11 ' HG3' ' C' ' 95' ' ' GLU . 65.6 mt -112.29 -32.07 2.16 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 C-N-CA 123.475 0.71 . . . . 35.23 112.612 -177.628 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 36' ' ' ALA . . . . . . . . . . . . . . . -164.98 149.43 9.05 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 110.117 -0.327 . . . . 36.76 110.117 176.363 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 37' ' ' THR . . . . . . . . . . . . . 80.9 p -127.54 152.48 47.55 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 113.056 0.762 . . . . 51.45 113.056 -177.163 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 38' ' ' LYS . . . . . . . . . . . . . 99.6 mttt 48.91 47.42 21.54 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.157 -0.928 . . . . 68.4 111.542 -179.186 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 39' ' ' VAL . . . . . . . . . . . . . 22.0 t -84.67 133.42 29.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 115.512 -0.767 . . . . 34.29 110.065 177.475 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 40' ' ' LEU . . . . . . . . . . . . . 12.9 mt -101.74 140.74 35.61 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.589 -0.522 . . . . 37.56 109.589 174.208 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 41' ' ' GLY . . . . . . . . . . . . . . . -155.75 176.43 33.27 Favored Glycine 0 N--CA 1.447 -0.583 0 CA-C-N 115.929 -0.578 . . . . 34.78 112.547 -175.699 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 42' ' ' THR . . . . . . . . . . . . . 82.7 m -122.59 132.45 54.3 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 108.805 -0.813 . . . . 38.91 108.805 177.495 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 43' ' ' VAL . . . . . . . . . . . . . 79.1 t -64.26 119.55 8.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 109.493 -0.558 . . . . 28.41 109.493 177.974 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 44' ' ' LYS . . . . . . . . . . . . . 43.8 tttm -75.76 -55.24 5.83 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.626 -0.716 . . . . 56.01 109.202 -178.859 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 45' ' ' TRP . . . . . . . . . . . . . 68.1 p-90 -160.69 160.34 31.35 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.306 -0.861 . . . . 33.01 108.89 168.863 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 46' ' ' PHE . . . . . 0.454 ' HA ' ' HA3' ' C' ' 53' ' ' GLY . 44.1 t80 -145.47 113.0 6.27 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.282 -0.636 . . . . 35.7 109.282 177.144 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 47' ' ' ASN . . . . . . . . . . . . . 19.1 t-20 -77.45 103.95 7.69 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.617 -0.512 . . . . 43.42 109.617 176.967 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 48' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -56.95 -42.47 78.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.289 -0.869 . . . . 38.95 112.639 -175.601 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 49' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -75.91 -29.4 58.4 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.855 0.687 . . . . 71.68 112.855 -175.323 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 50' ' ' ASN . . . . . . . . . . . . . 98.5 m-20 -87.7 -23.22 24.24 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.862 0.363 . . . . 55.96 111.733 176.977 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 51' ' ' GLY . . . . . . . . . . . . . . . 86.01 22.14 50.12 Favored Glycine 0 N--CA 1.451 -0.332 0 N-CA-C 115.786 1.074 . . . . 36.77 115.786 173.254 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 52' ' ' TYR . . . . . . . . . . . . . 27.1 p90 -152.71 170.44 20.26 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.214 0.53 . . . . 55.46 110.707 176.207 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 53' ' ' GLY . . . . . 0.454 ' HA3' ' HA ' ' C' ' 46' ' ' PHE . . . -174.97 -165.06 30.7 Favored Glycine 0 N--CA 1.446 -0.644 0 N-CA-C 108.277 -1.929 . . . . 24.83 108.277 178.622 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 54' ' ' PHE . . . . . . . . . . . . . 64.2 m-85 -127.41 146.17 50.57 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 112.893 0.701 . . . . 30.08 112.893 -179.299 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 55' ' ' ILE . . . . . . . . . . . . . 58.0 mt -111.16 132.36 59.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.099 -0.955 . . . . 35.04 109.832 175.423 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 56' ' ' ASN . . . . . . . . . . . . . 50.7 t30 -90.58 107.08 18.94 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.949 -0.568 . . . . 51.79 110.202 179.143 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 57' ' ' ARG . . . . . . . . . . . . . 53.5 mtp180 -57.16 129.86 43.62 Favored 'General case' 0 C--O 1.218 -0.596 0 CA-C-N 116.405 -0.361 . . . . 35.56 110.784 179.835 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 58' ' ' ASN . . . . . 0.611 ' O ' ' O ' ' C' ' 303' ' ' HOH . 11.1 m-20 -73.41 -25.7 60.65 Favored 'General case' 0 CA--C 1.512 -0.515 0 N-CA-C 113.714 1.005 . . . . 35.87 113.714 179.762 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 59' ' ' ASP . . . . . . . . . . . . . 26.3 p-10 -84.52 -29.88 25.6 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.063 -0.517 . . . . 43.48 111.842 -174.218 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 54.0 p -127.37 -13.31 5.53 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 113.173 0.805 . . . . 37.2 113.173 -174.654 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 61' ' ' LYS . . . . . . . . . . . . . 12.0 mmtt 58.28 24.19 11.24 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 124.493 1.117 . . . . 57.23 111.984 -176.867 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 62' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -81.55 142.52 32.77 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 108.59 -0.893 . . . . 42.95 108.59 170.822 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 63' ' ' ASP . . . . . . . . . . . . . 34.6 m-20 -73.06 138.78 46.1 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.486 -0.561 . . . . 40.9 109.486 172.439 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 64' ' ' VAL . . . . . . . . . . . . . 60.1 t -128.65 129.63 68.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.97 0.414 . . . . 30.64 111.005 176.502 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 65' ' ' PHE . . . . . . . . . . . . . 48.1 t80 -66.77 134.1 51.5 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.583 -0.735 . . . . 28.73 111.25 178.818 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 66' ' ' VAL . . . . . . . . . . . . . 2.4 p -135.09 126.6 46.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 121.17 0.51 . . . . 26.26 110.711 175.309 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 67' ' ' HIS . . . . . . . . . . . . . 11.0 t-80 -95.58 157.09 16.05 Favored 'General case' 0 N--CA 1.453 -0.325 0 N-CA-C 108.596 -0.891 . . . . 30.13 108.596 176.126 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 68' ' ' GLN . . . . . . . . . . . . . 9.4 pt20 -62.8 -18.94 63.53 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 111.887 0.328 . . . . 66.9 111.887 -177.455 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 69' ' ' THR . . . . . 0.467 ' HA ' ' NH2' ' C' ' 81' ' ' ARG . 11.9 t -81.03 -6.14 58.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.418 -0.356 . . . . 49.35 111.517 179.101 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 70' ' ' ALA . . . . . . . . . . . . . . . -88.13 -8.54 55.28 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.821 0.343 . . . . 32.2 111.3 -179.192 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 71' ' ' ILE . . . . . . . . . . . . . 64.6 mt -80.85 100.51 5.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 121.164 0.507 . . . . 37.65 111.114 -177.601 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 72' ' ' LYS . . . . . 0.436 ' HB2' ' HA ' ' C' ' 104' ' ' ASN . 81.4 tttt -70.97 -39.1 72.72 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.564 -0.744 . . . . 56.21 111.947 -177.254 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 73' ' ' LYS . . . . . . . . . . . . . 67.9 mttt -124.72 87.86 2.79 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.198 0.523 . . . . 58.87 111.615 -176.948 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 74' ' ' ASN . . . . . 0.755 ' OD1' ' O ' ' C' ' 301' ' ' HOH . 66.7 t30 -79.16 154.1 29.55 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.494 -0.775 . . . . 35.2 111.831 -178.677 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 75' ' ' ASN . . . . . . . . . . . . . 59.5 t-20 -61.17 112.95 6.63 Favored Pre-proline 0 C--N 1.33 -0.26 0 N-CA-C 109.508 -0.553 . . . . 38.27 109.508 172.465 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 76' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_endo -60.46 -27.91 85.73 Favored 'Trans proline' 0 C--N 1.342 0.209 0 C-N-CA 122.425 2.083 . . . . 39.07 113.079 -175.767 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 77' ' ' ARG . . . . . . . . . . . . . 8.9 mtt180 -81.47 1.14 34.62 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 112.803 0.668 . . . . 73.1 112.803 -178.215 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 78' ' ' LYS . . . . . . . . . . . . . 14.5 mmtt -108.04 151.39 25.91 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.871 0.367 . . . . 54.76 111.856 178.033 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 79' ' ' TYR . . . . . . . . . . . . . 92.3 m-85 -75.68 -32.41 60.12 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.363 0.601 . . . . 43.76 109.927 173.585 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 80' ' ' LEU . . . . . 0.489 HD22 ' HA ' ' C' ' 119' ' ' ALA . 5.5 mp -95.17 151.9 18.82 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.181 -0.918 . . . . 47.37 112.611 -166.454 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 81' ' ' ARG . . . . . 0.467 ' NH2' ' HA ' ' C' ' 69' ' ' THR . 8.9 mtm180 -93.22 101.68 13.96 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 107.869 -1.16 . . . . 62.35 107.869 167.162 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 82' ' ' SER . . . . . . . . . . . . . 26.1 p -150.32 164.2 36.38 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.323 0.582 . . . . 34.92 111.922 -174.579 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 83' ' ' VAL . . . . . . . . . . . . . 15.8 m -126.05 146.02 32.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 N-CA-C 107.17 -1.418 . . . . 32.5 107.17 168.672 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 84' ' ' GLY . . . . . . . . . . . . . . . -91.34 149.46 19.86 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 121.08 -0.581 . . . . 32.44 112.88 -178.087 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 85' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -61.41 129.58 41.88 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.735 0.303 . . . . 44.67 111.127 -179.879 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 86' ' ' GLY . . . . . . . . . . . . . . . 87.89 -2.91 86.0 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 121.328 -0.463 . . . . 34.08 112.847 179.408 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 87' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -76.0 140.91 42.24 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 119.412 -0.915 . . . . 44.71 111.461 179.846 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 88' ' ' THR . . . . . 0.654 HG22 ' HG3' ' C' ' 108' ' ' PRO . 1.5 m -81.34 123.32 28.43 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 114.419 -1.264 . . . . 41.11 110.128 176.953 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 89' ' ' VAL . . . . . . . . . . . . . 4.5 m -130.1 155.13 41.35 Favored 'Isoleucine or valine' 0 C--O 1.232 0.164 0 N-CA-C 113.249 0.833 . . . . 31.28 113.249 -176.895 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 90' ' ' GLU . . . . . . . . . . . . . 57.2 tt0 -119.32 136.38 54.28 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.014 -0.994 . . . . 51.08 108.925 174.929 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 91' ' ' PHE . . . . . . . . . . . . . 26.8 p90 -163.24 169.1 19.72 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 113.41 0.892 . . . . 28.2 113.41 -169.312 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 92' ' ' ASP . . . . . . . . . . . . . 86.2 m-20 -108.5 145.44 34.71 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.408 -0.815 . . . . 33.5 109.736 171.979 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 93' ' ' VAL . . . . . . . . . . . . . 38.2 t -97.81 124.57 50.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 N-CA-C 108.563 -0.903 . . . . 39.48 108.563 171.557 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 94' ' ' VAL . . . . . . . . . . . . . 33.3 m -125.61 165.24 23.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 N-CA-C 109.791 -0.448 . . . . 35.73 109.791 177.981 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 95' ' ' GLU . . . . . 0.685 ' HG3' HD11 ' C' ' 35' ' ' ILE . 2.3 mt-10 -85.84 126.32 33.96 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 120.51 -0.476 . . . . 65.16 110.163 177.424 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 96' ' ' GLY . . . . . . . . . . . . . . . -112.13 -160.63 15.53 Favored Glycine 0 N--CA 1.45 -0.412 0 CA-C-N 115.963 -0.562 . . . . 39.38 114.013 -174.77 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 97' ' ' GLU . . . . . . . . . . . . . 52.1 mp0 -59.88 -45.98 90.76 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 112.256 0.465 . . . . 53.31 112.256 -177.291 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 98' ' ' LYS . . . . . . . . . . . . . 87.6 mttt -118.89 -8.59 10.26 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 113.043 0.757 . . . . 49.44 113.043 -172.967 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 99' ' ' GLY . . . . . . . . . . . . . . . 171.14 -152.75 19.05 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.752 -0.737 . . . . 38.31 113.484 177.918 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 100' ' ' ALA . . . . . . . . . . . . . . . -73.2 129.14 37.4 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.803 0.335 . . . . 39.06 110.55 178.91 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 101' ' ' GLU . . . . . 0.439 ' OE2' ' O ' ' C' ' 304' ' ' HOH . 62.8 mt-10 -129.94 146.3 51.64 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.916 -0.584 . . . . 46.88 110.91 178.367 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 102' ' ' ALA . . . . . . . . . . . . . . . -74.12 148.34 41.88 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.464 -0.569 . . . . 27.89 109.464 174.237 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 103' ' ' ALA . . . . . . . . . . . . . . . -146.78 156.84 43.45 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.453 -0.34 . . . . 33.41 110.651 178.459 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 104' ' ' ASN . . . . . 0.436 ' HA ' ' HB2' ' C' ' 72' ' ' LYS . 80.7 m-20 54.49 40.88 32.14 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.911 -0.586 . . . . 39.29 112.032 -179.972 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 105' ' ' VAL . . . . . . . . . . . . . 14.6 t -70.35 123.47 24.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.028 -0.533 . . . . 39.16 112.075 -174.94 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 106' ' ' THR . . . . . . . . . . . . . 5.2 p -133.42 174.96 9.84 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.872 -0.604 . . . . 36.47 109.836 175.323 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 107' ' ' GLY . . . . . 0.425 ' N ' ' O ' ' C' ' 111' ' ' VAL . . . -79.63 171.62 54.73 Favored Glycine 0 C--O 1.226 -0.4 0 N-CA-C 108.447 -1.861 . . . . 36.04 108.447 170.584 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 108' ' ' PRO . . . . . 0.654 ' HG3' HG22 ' C' ' 88' ' ' THR . 58.8 Cg_exo -50.4 115.86 2.17 Favored 'Trans proline' 0 N--CA 1.466 -0.135 0 C-N-CA 125.215 3.943 . . . . 39.25 113.209 -178.958 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 109' ' ' GLY . . . . . . . . . . . . . . . 81.17 39.19 13.2 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 121.13 -0.557 . . . . 47.87 113.454 174.487 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 110' ' ' GLY . . . . . . . . . . . . . . . 67.27 21.26 72.0 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 121.845 -0.217 . . . . 39.32 113.156 176.39 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 111' ' ' VAL . . . . . 0.425 ' O ' ' N ' ' C' ' 107' ' ' GLY . 1.6 t -89.99 147.31 36.96 Favored Pre-proline 0 C--N 1.327 -0.39 0 N-CA-C 108.425 -0.954 . . . . 43.85 108.425 177.863 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 112' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_exo -55.93 150.01 48.78 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 120.485 0.79 . . . . 39.89 113.088 176.806 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 113' ' ' VAL . . . . . 0.403 HG22 ' HA ' ' C' ' 74' ' ' ASN . 15.0 m -67.59 164.25 2.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 N-CA-C 108.663 -0.865 . . . . 36.96 108.663 172.292 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 114' ' ' GLN . . . . . . . . . . . . . 10.2 mt-30 -96.71 -25.35 15.57 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.33 -0.548 . . . . 53.21 112.005 178.015 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 115' ' ' GLY . . . . . . . . . . . . . . . 86.15 -178.25 49.37 Favored Glycine 0 CA--C 1.519 0.296 0 C-N-CA 121.509 -0.377 . . . . 27.16 113.178 175.331 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 116' ' ' SER . . . . . . . . . . . . . 1.4 t -82.56 151.18 26.52 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 112.04 0.385 . . . . 32.28 112.04 -175.263 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 117' ' ' LYS . . . . . . . . . . . . . 1.5 ttpt -62.35 -24.76 67.52 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.617 -0.719 . . . . 57.48 110.419 175.67 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 118' ' ' TYR . . . . . . . . . . . . . 50.6 m-85 -94.69 4.8 53.39 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.833 -0.621 . . . . 51.91 111.65 -175.645 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 119' ' ' ALA . . . . . 0.489 ' HA ' HD22 ' C' ' 80' ' ' LEU . . . -86.34 132.71 33.9 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.519 -0.548 . . . . 41.33 109.519 170.877 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 120' ' ' ALA . . . . . 0.643 ' O ' ' O ' ' C' ' 302' ' ' HOH . . . -84.68 138.77 32.47 Favored 'General case' 0 N--CA 1.464 0.246 0 N-CA-C 113.535 0.939 . . . . 41.98 113.535 -173.469 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 121' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -68.8 148.68 49.95 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.629 -0.714 . . . . 60.58 109.925 175.074 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 122' ' ' ARG . . . . . . . . . . . . . 71.0 mtt180 . . . . . 0 C--N 1.329 -0.31 0 CA-C-O 121.037 0.446 . . . . 54.23 111.322 177.469 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 2' ' ' ' C' . . . . . 0.68 ' OP1' ' O ' ' D' ' 101' ' ' HOH . . . . . . . . 0 O5'--C5' 1.426 -0.858 0 O5'-C5'-C4' 111.888 1.206 . 0.0 '__' . 53.07 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 3' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.424 -0.973 0 O5'-C5'-C4' 111.399 0.856 . 0.489 4b . 45.29 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 4' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.422 -1.095 0 O5'-C5'-C4' 111.751 1.108 . 0.458 4b . 46.18 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 5' ' ' 5MC . . . . . 0.433 " H2'" " O4'" ' D' ' 6' ' ' ' U' . . . . . . . . 0 P--OP2 1.516 1.844 0 O4'-C4'-C3' 103.294 -1.576 . 0.01 0a . 64.22 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 6' ' ' ' U' . . . . . 0.433 " O4'" " H2'" ' D' ' 5' ' ' 5MC . . . . . . . . 0 O5'--C5' 1.425 -0.967 0 O5'-C5'-C4' 111.718 1.084 . 0.0 OUTLIER . 79.41 . . . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 301' ' ' HOH . . . . . 0.498 ' O ' ' NH2' ' A' ' 49' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 303' ' ' HOH . . . . . 0.657 ' O ' ' N ' ' A' ' 33' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 310' ' ' HOH . . . . . 0.441 ' O ' ' HB2' ' A' ' 79' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 313' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 316' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 317' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 318' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 319' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 320' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 321' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 322' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 101' ' ' HOH . . . . . 0.426 ' O ' ' OP2' ' B' ' 5' ' ' 5MC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 301' ' ' HOH . . . . . 0.755 ' O ' ' OD1' ' C' ' 74' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 302' ' ' HOH . . . . . 0.643 ' O ' ' O ' ' C' ' 120' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 303' ' ' HOH . . . . . 0.611 ' O ' ' O ' ' C' ' 58' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 304' ' ' HOH . . . . . 0.439 ' O ' ' OE2' ' C' ' 101' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 313' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 316' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 317' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 318' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 101' ' ' HOH . . . . . 0.68 ' O ' ' OP1' ' D' ' 2' ' ' ' C' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.657 ' N ' ' O ' ' A' ' 303' ' ' HOH . 5.8 mtpm? . . . . . 0 C--O 1.232 0.149 0 CA-C-O 121.007 0.432 . . . . 63.99 110.203 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 72.3 t -99.36 127.09 52.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 N-CA-C 114.848 1.425 . . . . 29.2 114.848 -165.042 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 12.1 mt -89.09 -42.89 14.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 115.984 -0.553 . . . . 37.41 110.82 175.156 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -146.08 151.06 37.09 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 115.969 -0.559 . . . . 33.37 110.216 177.797 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 39.8 p -118.71 152.93 35.22 Favored 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 113.604 0.964 . . . . 44.06 113.604 -176.689 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 1.7 pttp 32.01 49.1 0.12 Allowed 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 125.171 1.388 . . . . 69.61 113.991 -179.23 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -85.01 143.33 11.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.92 -0.582 . . . . 31.77 110.224 176.09 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 24.3 mt -94.91 137.64 33.7 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.219 -0.446 . . . . 37.1 111.263 179.401 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -140.55 161.16 26.59 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.837 -0.696 . . . . 33.84 113.988 -178.59 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 25.7 m -114.09 112.75 23.73 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 108.7 -0.852 . . . . 37.84 108.7 176.798 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 46.7 t -55.67 122.73 5.35 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.358 -0.383 . . . . 28.99 111.56 -177.968 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 18.9 tptt -78.78 -56.46 4.39 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.032 -0.531 . . . . 45.84 111.233 -176.879 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' TRP . . . . . . . . . . . . . 64.4 p-90 -160.71 149.56 16.72 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.091 -0.707 . . . . 37.96 109.091 176.005 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 45.5 t80 -146.93 113.14 5.86 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.259 0.552 . . . . 28.27 110.691 178.259 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 22.6 t-20 -84.0 109.34 17.56 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.558 -0.746 . . . . 38.19 110.026 177.225 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 7.5 p -63.09 -25.59 38.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.341 -0.391 . . . . 35.98 111.461 -175.499 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.498 ' NH2' ' O ' ' A' ' 301' ' ' HOH . 1.8 mmm180 -73.61 -57.97 3.63 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 110.103 -0.332 . . . . 71.58 110.103 -179.986 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 92.2 m-20 -61.15 -29.07 69.57 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 113.549 0.944 . . . . 45.17 113.549 -179.585 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 86.92 18.64 57.69 Favored Glycine 0 N--CA 1.452 -0.283 0 N-CA-C 114.457 0.543 . . . . 34.74 114.457 177.309 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 39.1 p90 -150.4 176.66 10.71 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.045 0.45 . . . . 45.14 112.184 176.448 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -179.0 -157.48 19.58 Favored Glycine 0 N--CA 1.45 -0.37 0 N-CA-C 110.944 -0.862 . . . . 25.74 110.944 179.743 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 39.5 m-85 -135.92 140.66 44.21 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 113.239 0.829 . . . . 33.8 113.239 -179.982 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 56.4 mt -108.95 125.72 65.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.358 -0.837 . . . . 30.99 109.993 173.227 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' ASN . . . . . 0.652 ' ND2' ' OD1' ' A' ' 63' ' ' ASP . 13.2 t-20 -89.13 117.26 27.99 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.95 0.405 . . . . 36.65 111.228 175.878 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.598 ' NH2' ' OD2' ' A' ' 59' ' ' ASP . 64.1 mtp180 -66.46 120.67 13.76 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.101 -0.5 . . . . 36.71 112.203 -177.306 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 10.3 m-20 -61.7 -30.4 70.73 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 106.815 -1.55 . . . . 35.83 106.815 169.608 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' ASP . . . . . 0.598 ' OD2' ' NH2' ' A' ' 57' ' ' ARG . 2.3 t70 -48.9 -67.89 0.23 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 113.998 -1.455 . . . . 57.97 113.162 172.859 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 71.7 p -121.06 -4.92 9.53 Favored 'General case' 0 C--O 1.235 0.314 0 N-CA-C 114.687 1.366 . . . . 35.06 114.687 -166.221 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.437 ' HD2' ' HA ' ' A' ' 61' ' ' LYS . 14.4 mmmt 66.11 12.39 8.47 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 123.743 0.817 . . . . 60.71 111.803 -174.895 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 58.9 mt-10 -85.12 146.83 26.94 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.457 -0.338 . . . . 34.85 110.298 174.51 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' ASP . . . . . 0.652 ' OD1' ' ND2' ' A' ' 56' ' ' ASN . 90.7 m-20 -87.59 136.55 32.9 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.845 0.355 . . . . 40.26 110.136 174.896 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 60.8 t -125.91 131.37 71.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 116.139 -0.482 . . . . 27.06 110.798 -177.949 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 60.8 t80 -64.72 136.3 56.79 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.828 -0.623 . . . . 36.72 111.83 -178.046 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 3.3 p -135.15 127.86 48.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 121.117 0.484 . . . . 29.82 111.584 177.968 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 51.7 t-80 -109.06 154.27 22.48 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.856 -0.611 . . . . 47.07 109.361 -179.523 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.449 ' HG3' ' HB2' ' A' ' 81' ' ' ARG . 1.8 tt0 -52.97 -37.78 61.57 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 113.264 0.838 . . . . 57.04 113.264 -176.008 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 61.6 p -73.05 -13.93 61.31 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 113.415 0.895 . . . . 47.21 113.415 -176.09 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -83.82 -8.7 59.16 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 120.465 -0.494 . . . . 31.43 110.755 -179.195 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 66.5 mt -74.82 102.19 2.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 N-CA-C 109.651 -0.5 . . . . 30.23 109.651 179.526 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.591 ' HB2' ' HA ' ' A' ' 104' ' ' ASN . 9.5 tttm -74.18 -44.16 54.52 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.068 -0.515 . . . . 67.84 111.797 -175.428 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 6.0 mmtt -118.62 89.1 3.06 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.148 0.499 . . . . 52.11 112.125 -178.239 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 60.7 t30 -79.1 155.0 28.94 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.694 -0.684 . . . . 35.22 112.503 -178.43 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 59.8 t-20 -60.68 116.89 20.36 Favored Pre-proline 0 C--N 1.331 -0.234 0 N-CA-C 109.304 -0.628 . . . . 31.48 109.304 171.954 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -65.3 -15.59 50.67 Favored 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 121.06 1.174 . . . . 45.14 113.417 -176.634 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 32.6 mtt180 -96.82 2.57 51.99 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 112.488 0.551 . . . . 64.31 112.488 -176.066 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 35.3 mmtp -112.64 139.58 48.12 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.586 -0.279 . . . . 38.48 110.525 176.229 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' TYR . . . . . 0.441 ' HB2' ' O ' ' A' ' 310' ' ' HOH . 57.0 m-85 -64.06 -52.9 57.14 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.128 0.49 . . . . 42.56 111.96 -178.729 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 20.2 mt -89.65 166.93 13.3 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.596 -0.729 . . . . 36.95 111.692 -175.64 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.449 ' HB2' ' HG3' ' A' ' 68' ' ' GLN . 24.9 mtt180 -99.47 119.76 38.54 Favored 'General case' 0 CA--C 1.513 -0.443 0 CA-C-N 115.68 -0.691 . . . . 65.42 110.263 175.834 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 83.7 p -156.51 168.5 27.18 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 115.399 -0.819 . . . . 43.08 111.47 -173.38 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 16.1 m -128.69 151.79 35.96 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.433 0 N-CA-C 107.472 -1.307 . . . . 35.68 107.472 168.565 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -98.85 153.1 19.79 Favored Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 121.128 -0.558 . . . . 33.52 112.679 -178.004 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -59.35 139.38 57.08 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.742 0.306 . . . . 54.18 110.459 176.998 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 79.26 -2.59 70.25 Favored Glycine 0 N--CA 1.453 -0.228 0 CA-C-N 116.285 -0.416 . . . . 36.89 113.916 177.572 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -75.9 141.14 42.42 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 112.099 0.407 . . . . 50.16 112.099 -178.61 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 57.8 m -94.53 119.25 32.93 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.018 -0.537 . . . . 27.57 111.398 178.937 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 4.3 m -120.17 158.37 22.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 N-CA-C 112.746 0.646 . . . . 28.23 112.746 -176.123 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 44.3 tt0 -117.38 123.45 46.49 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 108.958 -0.756 . . . . 45.94 108.958 174.638 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 21.7 p90 -148.84 172.6 14.4 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 113.391 0.886 . . . . 32.0 113.391 -170.47 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 74.2 m-20 -107.67 141.47 39.12 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.274 -0.875 . . . . 48.71 109.315 170.519 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 41.5 t -94.01 111.28 24.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 N-CA-C 107.838 -1.171 . . . . 30.67 107.838 171.057 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 10.6 m -114.77 160.61 14.05 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 C-N-CA 120.929 -0.309 . . . . 34.76 110.928 -179.002 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 22.0 tt0 -75.16 127.54 33.44 Favored 'General case' 0 C--O 1.235 0.324 0 N-CA-C 108.847 -0.798 . . . . 57.19 108.847 171.941 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -112.59 -168.68 17.6 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 121.294 -0.479 . . . . 43.42 113.135 -179.538 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 59.3 mp0 -59.14 -40.31 85.1 Favored 'General case' 0 C--N 1.331 -0.196 0 N-CA-C 112.565 0.58 . . . . 47.86 112.565 -177.277 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -126.33 53.82 1.61 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.16 -0.473 . . . . 58.32 110.925 179.05 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 95.85 -172.26 29.55 Favored Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.968 -0.634 . . . . 39.82 111.958 -178.691 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -61.38 143.1 56.38 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 113.555 0.946 . . . . 36.73 113.555 -170.544 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 84.6 tt0 -141.91 161.02 39.01 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 108.625 -0.88 . . . . 65.06 108.625 177.838 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -84.56 147.95 26.74 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.912 -0.315 . . . . 30.94 110.16 175.23 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -139.73 160.27 40.27 Favored 'General case' 0 C--O 1.234 0.279 0 C-N-CA 121.269 -0.172 . . . . 29.01 110.721 177.123 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' ASN . . . . . 0.591 ' HA ' ' HB2' ' A' ' 72' ' ' LYS . 6.8 m-80 38.38 54.04 1.8 Allowed 'General case' 0 N--CA 1.463 0.18 0 O-C-N 123.989 0.806 . . . . 57.32 113.167 -174.149 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 18.2 t -66.9 129.12 31.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 115.824 -0.625 . . . . 31.74 109.926 174.552 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 65.5 p -140.83 -178.19 5.43 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 107.166 -1.42 . . . . 34.75 107.166 174.731 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -79.04 175.9 54.92 Favored Glycine 0 N--CA 1.449 -0.477 0 N-CA-C 107.048 -2.421 . . . . 32.58 107.048 168.604 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -57.34 136.09 74.05 Favored 'Trans proline' 0 C--O 1.232 0.205 0 O-C-N 122.785 0.887 . . . . 39.95 111.431 174.375 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 82.63 -10.92 54.62 Favored Glycine 0 CA--C 1.518 0.26 0 O-C-N 123.142 0.277 . . . . 33.8 113.601 179.131 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 102.65 11.14 36.12 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 121.415 -0.422 . . . . 43.98 113.108 -179.759 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 16.0 m -70.99 158.76 87.48 Favored Pre-proline 0 C--N 1.328 -0.332 0 N-CA-C 108.749 -0.834 . . . . 34.28 108.749 176.737 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -57.87 145.72 89.61 Favored 'Trans proline' 0 C--N 1.346 0.403 0 O-C-N 122.624 0.802 . . . . 29.97 112.363 177.596 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 11.3 m -66.89 160.66 4.02 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 O-C-N 123.418 0.448 . . . . 31.62 109.812 175.707 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -79.18 -45.25 20.27 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 111.845 0.313 . . . . 72.47 111.845 -178.148 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . 91.91 164.09 38.49 Favored Glycine 0 N--CA 1.45 -0.433 0 C-N-CA 121.426 -0.416 . . . . 39.82 113.539 177.213 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 15.2 t -72.54 153.13 41.47 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 115.206 1.558 . . . . 38.52 115.206 -172.079 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 22.7 mtpt -53.92 -32.41 53.46 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 114.92 -1.036 . . . . 58.87 111.389 171.76 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 27.7 m-85 -93.5 -11.35 32.18 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.466 -0.788 . . . . 60.36 112.819 -167.831 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -81.06 140.32 35.18 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 109.634 -0.506 . . . . 30.24 109.634 173.341 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -93.42 150.58 20.35 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 113.682 0.993 . . . . 37.91 113.682 -169.462 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 2.3 p-10 -74.5 147.05 42.2 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.604 -0.725 . . . . 70.06 111.948 178.36 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 90.0 mtt-85 . . . . . 0 C--N 1.33 -0.28 0 CA-C-N 116.338 -0.392 . . . . 48.07 110.735 175.212 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 2' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.425 -0.961 0 O5'-C5'-C4' 112.02 1.3 . 0.0 '__' . 58.38 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 3' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.424 -0.978 0 C2'-C3'-O3' 107.716 -1.173 . 0.768 4b . 55.39 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 4' ' ' ' U' . . . . . 0.431 " H4'" " H5'" ' B' ' 5' ' ' 5MC . . . . . . . . 0 O5'--C5' 1.425 -0.968 0 P-O3'-C3' 121.599 1.583 . 0.0 OUTLIER alpha 48.98 . . . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 5' ' ' 5MC . . . . . 0.752 " H2'" " H4'" ' B' ' 6' ' ' ' U' . . . . . . . . 0 P--OP2 1.516 1.845 0 C4'-C3'-O3' 114.778 1.607 . 0.118 0a . 57.16 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 6' ' ' ' U' . . . . . 0.752 " H4'" " H2'" ' B' ' 5' ' ' 5MC . . . . . . . . 0 O5'--C5' 1.422 -1.128 3 OP2-P-O3' 79.611 -8.965 . 0.0 OUTLIER . 93.96 . . . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' C' C ' 33' ' ' LYS . . . . . . . . . . . . . 2.0 mmtp . . . . . 0 CA--C 1.531 0.247 0 N-CA-C 109.464 -0.569 . . . . 60.86 109.464 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 34' ' ' VAL . . . . . . . . . . . . . 24.9 t -95.84 140.84 16.3 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.499 0 N-CA-C 114.878 1.436 . . . . 40.52 114.878 -162.793 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 35' ' ' ILE . . . . . 0.685 HD11 ' HG3' ' C' ' 95' ' ' GLU . 65.6 mt -112.29 -32.07 2.16 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 C-N-CA 123.475 0.71 . . . . 35.23 112.612 -177.628 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 36' ' ' ALA . . . . . . . . . . . . . . . -164.98 149.43 9.05 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 110.117 -0.327 . . . . 36.76 110.117 176.363 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 37' ' ' THR . . . . . . . . . . . . . 80.9 p -127.54 152.48 47.55 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 113.056 0.762 . . . . 51.45 113.056 -177.163 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 38' ' ' LYS . . . . . . . . . . . . . 99.6 mttt 48.91 47.42 21.54 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.157 -0.928 . . . . 68.4 111.542 -179.186 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 39' ' ' VAL . . . . . . . . . . . . . 22.0 t -84.67 133.42 29.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 115.512 -0.767 . . . . 34.29 110.065 177.475 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 40' ' ' LEU . . . . . . . . . . . . . 12.9 mt -101.74 140.74 35.61 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.589 -0.522 . . . . 37.56 109.589 174.208 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 41' ' ' GLY . . . . . . . . . . . . . . . -155.75 176.43 33.27 Favored Glycine 0 N--CA 1.447 -0.583 0 CA-C-N 115.929 -0.578 . . . . 34.78 112.547 -175.699 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 42' ' ' THR . . . . . . . . . . . . . 82.7 m -122.59 132.45 54.3 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 108.805 -0.813 . . . . 38.91 108.805 177.495 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 43' ' ' VAL . . . . . . . . . . . . . 79.1 t -64.26 119.55 8.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 109.493 -0.558 . . . . 28.41 109.493 177.974 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 44' ' ' LYS . . . . . . . . . . . . . 43.8 tttm -75.76 -55.24 5.83 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.626 -0.716 . . . . 56.01 109.202 -178.859 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 45' ' ' TRP . . . . . . . . . . . . . 68.1 p-90 -160.69 160.34 31.35 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.306 -0.861 . . . . 33.01 108.89 168.863 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 46' ' ' PHE . . . . . 0.454 ' HA ' ' HA3' ' C' ' 53' ' ' GLY . 44.1 t80 -145.47 113.0 6.27 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.282 -0.636 . . . . 35.7 109.282 177.144 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 47' ' ' ASN . . . . . . . . . . . . . 19.1 t-20 -77.45 103.95 7.69 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.617 -0.512 . . . . 43.42 109.617 176.967 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 48' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -56.95 -42.47 78.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.289 -0.869 . . . . 38.95 112.639 -175.601 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 49' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -75.91 -29.4 58.4 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.855 0.687 . . . . 71.68 112.855 -175.323 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 50' ' ' ASN . . . . . . . . . . . . . 98.5 m-20 -87.7 -23.22 24.24 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.862 0.363 . . . . 55.96 111.733 176.977 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 51' ' ' GLY . . . . . . . . . . . . . . . 86.01 22.14 50.12 Favored Glycine 0 N--CA 1.451 -0.332 0 N-CA-C 115.786 1.074 . . . . 36.77 115.786 173.254 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 52' ' ' TYR . . . . . . . . . . . . . 27.1 p90 -152.71 170.44 20.26 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.214 0.53 . . . . 55.46 110.707 176.207 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 53' ' ' GLY . . . . . 0.454 ' HA3' ' HA ' ' C' ' 46' ' ' PHE . . . -174.97 -165.06 30.7 Favored Glycine 0 N--CA 1.446 -0.644 0 N-CA-C 108.277 -1.929 . . . . 24.83 108.277 178.622 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 54' ' ' PHE . . . . . . . . . . . . . 64.2 m-85 -127.41 146.17 50.57 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 112.893 0.701 . . . . 30.08 112.893 -179.299 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 55' ' ' ILE . . . . . . . . . . . . . 58.0 mt -111.16 132.36 59.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.099 -0.955 . . . . 35.04 109.832 175.423 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 56' ' ' ASN . . . . . . . . . . . . . 50.7 t30 -90.58 107.08 18.94 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.949 -0.568 . . . . 51.79 110.202 179.143 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 57' ' ' ARG . . . . . . . . . . . . . 53.5 mtp180 -57.16 129.86 43.62 Favored 'General case' 0 C--O 1.218 -0.596 0 CA-C-N 116.405 -0.361 . . . . 35.56 110.784 179.835 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 58' ' ' ASN . . . . . 0.611 ' O ' ' O ' ' C' ' 303' ' ' HOH . 11.1 m-20 -73.41 -25.7 60.65 Favored 'General case' 0 CA--C 1.512 -0.515 0 N-CA-C 113.714 1.005 . . . . 35.87 113.714 179.762 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 59' ' ' ASP . . . . . . . . . . . . . 26.3 p-10 -84.52 -29.88 25.6 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.063 -0.517 . . . . 43.48 111.842 -174.218 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 60' ' ' THR . . . . . . . . . . . . . 54.0 p -127.37 -13.31 5.53 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 113.173 0.805 . . . . 37.2 113.173 -174.654 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 61' ' ' LYS . . . . . . . . . . . . . 12.0 mmtt 58.28 24.19 11.24 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 124.493 1.117 . . . . 57.23 111.984 -176.867 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 62' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -81.55 142.52 32.77 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 108.59 -0.893 . . . . 42.95 108.59 170.822 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 63' ' ' ASP . . . . . . . . . . . . . 34.6 m-20 -73.06 138.78 46.1 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.486 -0.561 . . . . 40.9 109.486 172.439 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 64' ' ' VAL . . . . . . . . . . . . . 60.1 t -128.65 129.63 68.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.97 0.414 . . . . 30.64 111.005 176.502 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 65' ' ' PHE . . . . . . . . . . . . . 48.1 t80 -66.77 134.1 51.5 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.583 -0.735 . . . . 28.73 111.25 178.818 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 66' ' ' VAL . . . . . . . . . . . . . 2.4 p -135.09 126.6 46.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 121.17 0.51 . . . . 26.26 110.711 175.309 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 67' ' ' HIS . . . . . . . . . . . . . 11.0 t-80 -95.58 157.09 16.05 Favored 'General case' 0 N--CA 1.453 -0.325 0 N-CA-C 108.596 -0.891 . . . . 30.13 108.596 176.126 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 68' ' ' GLN . . . . . . . . . . . . . 9.4 pt20 -62.8 -18.94 63.53 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 111.887 0.328 . . . . 66.9 111.887 -177.455 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 69' ' ' THR . . . . . 0.467 ' HA ' ' NH2' ' C' ' 81' ' ' ARG . 11.9 t -81.03 -6.14 58.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.418 -0.356 . . . . 49.35 111.517 179.101 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 70' ' ' ALA . . . . . . . . . . . . . . . -88.13 -8.54 55.28 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.821 0.343 . . . . 32.2 111.3 -179.192 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 71' ' ' ILE . . . . . . . . . . . . . 64.6 mt -80.85 100.51 5.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 121.164 0.507 . . . . 37.65 111.114 -177.601 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 72' ' ' LYS . . . . . 0.436 ' HB2' ' HA ' ' C' ' 104' ' ' ASN . 81.4 tttt -70.97 -39.1 72.72 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.564 -0.744 . . . . 56.21 111.947 -177.254 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 73' ' ' LYS . . . . . . . . . . . . . 67.9 mttt -124.72 87.86 2.79 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.198 0.523 . . . . 58.87 111.615 -176.948 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 74' ' ' ASN . . . . . 0.755 ' OD1' ' O ' ' C' ' 301' ' ' HOH . 66.7 t30 -79.16 154.1 29.55 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.494 -0.775 . . . . 35.2 111.831 -178.677 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 75' ' ' ASN . . . . . . . . . . . . . 59.5 t-20 -61.17 112.95 6.63 Favored Pre-proline 0 C--N 1.33 -0.26 0 N-CA-C 109.508 -0.553 . . . . 38.27 109.508 172.465 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 76' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_endo -60.46 -27.91 85.73 Favored 'Trans proline' 0 C--N 1.342 0.209 0 C-N-CA 122.425 2.083 . . . . 39.07 113.079 -175.767 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 77' ' ' ARG . . . . . . . . . . . . . 8.9 mtt180 -81.47 1.14 34.62 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 112.803 0.668 . . . . 73.1 112.803 -178.215 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 78' ' ' LYS . . . . . . . . . . . . . 14.5 mmtt -108.04 151.39 25.91 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.871 0.367 . . . . 54.76 111.856 178.033 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 79' ' ' TYR . . . . . . . . . . . . . 92.3 m-85 -75.68 -32.41 60.12 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.363 0.601 . . . . 43.76 109.927 173.585 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 80' ' ' LEU . . . . . 0.489 HD22 ' HA ' ' C' ' 119' ' ' ALA . 5.5 mp -95.17 151.9 18.82 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.181 -0.918 . . . . 47.37 112.611 -166.454 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 81' ' ' ARG . . . . . 0.467 ' NH2' ' HA ' ' C' ' 69' ' ' THR . 8.9 mtm180 -93.22 101.68 13.96 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 107.869 -1.16 . . . . 62.35 107.869 167.162 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 82' ' ' SER . . . . . . . . . . . . . 26.1 p -150.32 164.2 36.38 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.323 0.582 . . . . 34.92 111.922 -174.579 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 83' ' ' VAL . . . . . . . . . . . . . 15.8 m -126.05 146.02 32.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 N-CA-C 107.17 -1.418 . . . . 32.5 107.17 168.672 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 84' ' ' GLY . . . . . . . . . . . . . . . -91.34 149.46 19.86 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 121.08 -0.581 . . . . 32.44 112.88 -178.087 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 85' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -61.41 129.58 41.88 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.735 0.303 . . . . 44.67 111.127 -179.879 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 86' ' ' GLY . . . . . . . . . . . . . . . 87.89 -2.91 86.0 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 121.328 -0.463 . . . . 34.08 112.847 179.408 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 87' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -76.0 140.91 42.24 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 119.412 -0.915 . . . . 44.71 111.461 179.846 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 88' ' ' THR . . . . . 0.654 HG22 ' HG3' ' C' ' 108' ' ' PRO . 1.5 m -81.34 123.32 28.43 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 114.419 -1.264 . . . . 41.11 110.128 176.953 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 89' ' ' VAL . . . . . . . . . . . . . 4.5 m -130.1 155.13 41.35 Favored 'Isoleucine or valine' 0 C--O 1.232 0.164 0 N-CA-C 113.249 0.833 . . . . 31.28 113.249 -176.895 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 90' ' ' GLU . . . . . . . . . . . . . 57.2 tt0 -119.32 136.38 54.28 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.014 -0.994 . . . . 51.08 108.925 174.929 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 91' ' ' PHE . . . . . . . . . . . . . 26.8 p90 -163.24 169.1 19.72 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 113.41 0.892 . . . . 28.2 113.41 -169.312 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 92' ' ' ASP . . . . . . . . . . . . . 86.2 m-20 -108.5 145.44 34.71 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.408 -0.815 . . . . 33.5 109.736 171.979 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 93' ' ' VAL . . . . . . . . . . . . . 38.2 t -97.81 124.57 50.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 N-CA-C 108.563 -0.903 . . . . 39.48 108.563 171.557 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 94' ' ' VAL . . . . . . . . . . . . . 33.3 m -125.61 165.24 23.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 N-CA-C 109.791 -0.448 . . . . 35.73 109.791 177.981 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 95' ' ' GLU . . . . . 0.685 ' HG3' HD11 ' C' ' 35' ' ' ILE . 2.3 mt-10 -85.84 126.32 33.96 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 120.51 -0.476 . . . . 65.16 110.163 177.424 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 96' ' ' GLY . . . . . . . . . . . . . . . -112.13 -160.63 15.53 Favored Glycine 0 N--CA 1.45 -0.412 0 CA-C-N 115.963 -0.562 . . . . 39.38 114.013 -174.77 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 97' ' ' GLU . . . . . . . . . . . . . 52.1 mp0 -59.88 -45.98 90.76 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 112.256 0.465 . . . . 53.31 112.256 -177.291 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 98' ' ' LYS . . . . . . . . . . . . . 87.6 mttt -118.89 -8.59 10.26 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 113.043 0.757 . . . . 49.44 113.043 -172.967 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 99' ' ' GLY . . . . . . . . . . . . . . . 171.14 -152.75 19.05 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.752 -0.737 . . . . 38.31 113.484 177.918 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 100' ' ' ALA . . . . . . . . . . . . . . . -73.2 129.14 37.4 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.803 0.335 . . . . 39.06 110.55 178.91 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 101' ' ' GLU . . . . . 0.439 ' OE2' ' O ' ' C' ' 304' ' ' HOH . 62.8 mt-10 -129.94 146.3 51.64 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.916 -0.584 . . . . 46.88 110.91 178.367 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 102' ' ' ALA . . . . . . . . . . . . . . . -74.12 148.34 41.88 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.464 -0.569 . . . . 27.89 109.464 174.237 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 103' ' ' ALA . . . . . . . . . . . . . . . -146.78 156.84 43.45 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.453 -0.34 . . . . 33.41 110.651 178.459 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 104' ' ' ASN . . . . . 0.436 ' HA ' ' HB2' ' C' ' 72' ' ' LYS . 80.7 m-20 54.49 40.88 32.14 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.911 -0.586 . . . . 39.29 112.032 -179.972 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 105' ' ' VAL . . . . . . . . . . . . . 14.6 t -70.35 123.47 24.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.028 -0.533 . . . . 39.16 112.075 -174.94 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 106' ' ' THR . . . . . . . . . . . . . 5.2 p -133.42 174.96 9.84 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.872 -0.604 . . . . 36.47 109.836 175.323 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 107' ' ' GLY . . . . . 0.425 ' N ' ' O ' ' C' ' 111' ' ' VAL . . . -79.63 171.62 54.73 Favored Glycine 0 C--O 1.226 -0.4 0 N-CA-C 108.447 -1.861 . . . . 36.04 108.447 170.584 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 108' ' ' PRO . . . . . 0.654 ' HG3' HG22 ' C' ' 88' ' ' THR . 58.8 Cg_exo -50.4 115.86 2.17 Favored 'Trans proline' 0 N--CA 1.466 -0.135 0 C-N-CA 125.215 3.943 . . . . 39.25 113.209 -178.958 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 109' ' ' GLY . . . . . . . . . . . . . . . 81.17 39.19 13.2 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 121.13 -0.557 . . . . 47.87 113.454 174.487 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 110' ' ' GLY . . . . . . . . . . . . . . . 67.27 21.26 72.0 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 121.845 -0.217 . . . . 39.32 113.156 176.39 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 111' ' ' VAL . . . . . 0.425 ' O ' ' N ' ' C' ' 107' ' ' GLY . 1.6 t -89.99 147.31 36.96 Favored Pre-proline 0 C--N 1.327 -0.39 0 N-CA-C 108.425 -0.954 . . . . 43.85 108.425 177.863 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 112' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_exo -55.93 150.01 48.78 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 120.485 0.79 . . . . 39.89 113.088 176.806 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 113' ' ' VAL . . . . . 0.403 HG22 ' HA ' ' C' ' 74' ' ' ASN . 15.0 m -67.59 164.25 2.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 N-CA-C 108.663 -0.865 . . . . 36.96 108.663 172.292 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 114' ' ' GLN . . . . . . . . . . . . . 10.2 mt-30 -96.71 -25.35 15.57 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.33 -0.548 . . . . 53.21 112.005 178.015 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 115' ' ' GLY . . . . . . . . . . . . . . . 86.15 -178.25 49.37 Favored Glycine 0 CA--C 1.519 0.296 0 C-N-CA 121.509 -0.377 . . . . 27.16 113.178 175.331 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 116' ' ' SER . . . . . . . . . . . . . 1.4 t -82.56 151.18 26.52 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 112.04 0.385 . . . . 32.28 112.04 -175.263 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 117' ' ' LYS . . . . . . . . . . . . . 1.5 ttpt -62.35 -24.76 67.52 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.617 -0.719 . . . . 57.48 110.419 175.67 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 118' ' ' TYR . . . . . . . . . . . . . 50.6 m-85 -94.69 4.8 53.39 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.833 -0.621 . . . . 51.91 111.65 -175.645 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 119' ' ' ALA . . . . . 0.489 ' HA ' HD22 ' C' ' 80' ' ' LEU . . . -86.34 132.71 33.9 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.519 -0.548 . . . . 41.33 109.519 170.877 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 120' ' ' ALA . . . . . 0.643 ' O ' ' O ' ' C' ' 302' ' ' HOH . . . -84.68 138.77 32.47 Favored 'General case' 0 N--CA 1.464 0.246 0 N-CA-C 113.535 0.939 . . . . 41.98 113.535 -173.469 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 121' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -68.8 148.68 49.95 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.629 -0.714 . . . . 60.58 109.925 175.074 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 122' ' ' ARG . . . . . . . . . . . . . 71.0 mtt180 . . . . . 0 C--N 1.329 -0.31 0 CA-C-O 121.037 0.446 . . . . 54.23 111.322 177.469 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 2' ' ' ' C' . . . . . 0.68 ' OP1' ' O ' ' D' ' 101' ' ' HOH . . . . . . . . 0 O5'--C5' 1.426 -0.858 0 O5'-C5'-C4' 111.888 1.206 . 0.0 '__' . 53.07 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 3' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.424 -0.973 0 O5'-C5'-C4' 111.399 0.856 . 0.489 4b . 45.29 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 4' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.422 -1.095 0 O5'-C5'-C4' 111.751 1.108 . 0.458 4b . 46.18 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 5' ' ' 5MC . . . . . 0.433 " H2'" " O4'" ' D' ' 6' ' ' ' U' . . . . . . . . 0 P--OP2 1.516 1.844 0 O4'-C4'-C3' 103.294 -1.576 . 0.01 0a . 64.22 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 6' ' ' ' U' . . . . . 0.433 " O4'" " H2'" ' D' ' 5' ' ' 5MC . . . . . . . . 0 O5'--C5' 1.425 -0.967 0 O5'-C5'-C4' 111.718 1.084 . 0.0 OUTLIER . 79.41 . . . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 301' ' ' HOH . . . . . 0.498 ' O ' ' NH2' ' A' ' 49' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 303' ' ' HOH . . . . . 0.657 ' O ' ' N ' ' A' ' 33' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 310' ' ' HOH . . . . . 0.441 ' O ' ' HB2' ' A' ' 79' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 313' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 316' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 317' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 318' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 319' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 320' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 321' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 322' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 101' ' ' HOH . . . . . 0.426 ' O ' ' OP2' ' B' ' 5' ' ' 5MC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 301' ' ' HOH . . . . . 0.755 ' O ' ' OD1' ' C' ' 74' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 302' ' ' HOH . . . . . 0.643 ' O ' ' O ' ' C' ' 120' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 303' ' ' HOH . . . . . 0.611 ' O ' ' O ' ' C' ' 58' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 304' ' ' HOH . . . . . 0.439 ' O ' ' OE2' ' C' ' 101' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 313' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 316' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 317' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 318' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 101' ' ' HOH . . . . . 0.68 ' O ' ' OP1' ' D' ' 2' ' ' ' C' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_