zap background [0,0,0] load pdb inline rotate z 86 rotate x -90 translate x -5 translate y 52 zoom 300 restrict (c9:a, g4:b) and not backbone wireframe 80 hbonds on exit HEADER DEOXYRIBONUCLEIC ACID 26-JAN-81 1BNA 1BNA 3 COMPND /DNA$ (B, 1BNAD 1 COMPND 2 5(PRIME)-$D(*CP*GP*CP*GP*AP*AP*TP*TP*CP*GP*CP*G)-3(PRIME)) 1BNAD 2 COMPND 3 (290 DEGREES K) 1BNAD 3 SOURCE SYNTHETIC DNA 1BNA 5 AUTHOR H.R.DREW,R.E.DICKERSON 1BNA 6 REVDAT 6 30-SEP-83 1BNAE 1 REVDAT 1BNAE 1 REVDAT 5 27-JAN-82 1BNAD 1 COMPND REMARK 1BNAE 2 REVDAT 4 06-JAN-82 1BNAC 1 COMPND 1BNAE 3 REVDAT 3 03-DEC-81 1BNAB 1 COMPND REMARK 1BNAE 4 REVDAT 2 15-SEP-81 1BNAA 1 JRNL REMARK 1BNAE 5 REVDAT 1 21-MAY-81 1BNA 0 1BNAE 6 JRNL AUTH H.R.DREW,R.M.WING,T.TAKANO,C.BROKA,S.TANAKA, 1BNA 7 JRNL AUTH 2 K.ITAKURA,R.E.DICKERSON 1BNA 8 JRNL TITL STRUCTURE OF A B-/DNA$ DODECAMER. CONFORMATION AND 1BNA 9 JRNL TITL 2 DYNAMICS 1BNA 10 JRNL REF PROC.NAT.ACAD.SCI.USA V. 78 2179 1981 1BNAA 1 JRNL REFN ASTM PNASA6 US ISSN 0027-8424 040 1BNAA 2 REMARK 1 1BNA 13 REMARK 1 REFERENCE 1 1BNAD 4 REMARK 1 AUTH R.E.DICKERSON,H.R.DREW 1BNAD 5 REMARK 1 TITL KINEMATIC MODEL FOR B-/DNA$ 1BNAD 6 REMARK 1 REF PROC.NAT.ACAD.SCI.USA V. 78 7318 1981 1BNAD 7 REMARK 1 REFN ASTM PNASA6 US ISSN 0027-8424 040 1BNAD 8 REMARK 1 REFERENCE 2 1BNAD 9 REMARK 1 AUTH R.E.DICKERSON,H.R.DREW 1BNA 15 REMARK 1 TITL STRUCTURE OF A B-/DNA$ DODECAMER. II. INFLUENCE OF 1BNA 16 REMARK 1 TITL 2 BASE SEQUENCE ON HELIX STRUCTURE 1BNA 17 REMARK 1 REF J.MOL.BIOL. V. 149 761 1981 1BNAA 3 REMARK 1 REFN ASTM JMOBAK UK ISSN 0022-2836 070 1BNAA 4 REMARK 1 REFERENCE 3 1BNAD 10 REMARK 1 AUTH H.R.DREW,R.E.DICKERSON 1BNA 21 REMARK 1 TITL STRUCTURE OF A B-/DNA$ DODECAMER. III. GEOMETRY 1BNA 22 REMARK 1 TITL 2 OF HYDRATION 1BNA 23 REMARK 1 REF J.MOL.BIOL. V. 151 535 1981 1BNAB 2 REMARK 1 REFN ASTM JMOBAK UK ISSN 0022-2836 070 1BNAB 3 REMARK 1 REFERENCE 4 1BNAD 11 REMARK 1 AUTH R.WING,H.DREW,T.TAKANO,C.BROKA,S.TANAKA,K.ITAKURA, 1BNA 27 REMARK 1 AUTH 2 R.E.DICKERSON 1BNA 28 REMARK 1 TITL CRYSTAL STRUCTURE ANALYSIS OF A COMPLETE TURN OF 1BNA 29 REMARK 1 TITL 2 B-/DNA$ 1BNA 30 REMARK 1 REF NATURE V. 287 755 1980 1BNA 31 REMARK 1 REFN ASTM NATUAS UK ISSN 0028-0836 006 1BNA 32 REMARK 2 1BNA 33 REMARK 2 RESOLUTION. 1.9 ANGSTROMS. (NOMINAL). EFFECTIVE 1BNA 34 REMARK 2 RESOLUTION IS APPROXIMATELY 2.3 ANGSTROMS. 1BNA 35 REMARK 3 1BNA 36 REMARK 3 REFINEMENT. METHOD OF JACK AND LEVITT (ACTA CRYST., A34, 1BNA 37 REMARK 3 931 (1978)). THE LEAST-SQUARES REFINEMENT INCLUDES DATA 1BNA 38 REMARK 3 BELOW 8.0 ANGSTROMS. 1BNA 39 REMARK 4 1BNA 40 REMARK 4 EIGHT OF THE ATOMS DESIGNATED AS WATER BELOW (HOH 25, 54, 1BNA 41 REMARK 4 62, 63, 76, 77, 79, 86) ACTUALLY REPRESENT A SPERMINE 1BNA 42 REMARK 4 MOLECULE. 1BNA 43 REMARK 5 1BNA 44 REMARK 5 THIS COORDINATE SET IS DESIGNATED CYCLE 61 BY THE 1BNA 45 REMARK 5 DEPOSITOR. THE TWO STRANDS IN THE ASYMMETRIC UNIT HAVE 1BNA 46 REMARK 5 BEEN ASSIGNED CHAIN IDENTIFIERS *A* AND *B*. 1BNA 47 REMARK 6 1BNA 48 REMARK 6 STRUCTURE FACTORS FOR THIS ENTRY HAVE BEEN DEPOSITED AND 1BNA 49 REMARK 6 ARE AVAILABLE FROM THE PROTEIN DATA BANK AS A SEPARATE 1BNA 50 REMARK 6 ENTRY. 1BNA 51 REMARK 7 1BNA 52 REMARK 7 THE PROTEIN DATA BANK HAS ADOPTED THE SACCHARIDE CHEMISTS 1BNA 53 REMARK 7 NOMENCLATURE FOR ATOMS OF THE DEOXYRIBOSE MOIETY RATHER 1BNA 54 REMARK 7 THAN THAT OF THE NUCLEOSIDE CHEMIST. THE RING-OXYGEN ATOM 1BNA 55 REMARK 7 ACCORDINGLY IS LABELLED O4* AND NOT O1*. 1BNA 56 REMARK 8 1BNAA 5 REMARK 8 CORRECTION. UPDATE REFERENCE 1 TO REFLECT PUBLICATION. 1BNAA 6 REMARK 8 CORRECT JRNL REFERENCE. 15-SEP-81. 1BNAA 7 REMARK 9 1BNAB 4 REMARK 9 CORRECTION. UPDATE REFERENCE 2 TO REFLECT PUBLICATION. 1BNAB 5 REMARK 9 ADD TEMPERATURE OF STUDY TO COMPND RECORD. 03-DEC-81. 1BNAB 6 REMARK 10 1BNAC 2 REMARK 10 CORRECTION. CORRECT SPELLING ERROR ON COMPND RECORD. 1BNAC 3 REMARK 10 06-JAN-82. 1BNAC 4 REMARK 11 1BNAD 12 REMARK 11 CORRECTION. INSERT NEW PUBLICATION AS REFERENCE 1 AND 1BNAD 13 REMARK 11 RENUMBER THE OTHERS. STANDARDIZE COMPND RECORDS. 1BNAD 14 REMARK 11 27-JAN-82. 1BNAD 15 REMARK 12 1BNAE 7 REMARK 12 CORRECTION. INSERT REVDAT RECORDS. 30-SEP-83. 1BNAE 8 SEQRES 1 A 12 C G C G A A T T C G C G 1BNA 57 SEQRES 1 B 12 C G C G A A T T C G C G 1BNA 58 FORMUL 2 HOH *80(H2 O1) 1BNA 59 CRYST1 24.870 40.390 66.200 90.00 90.00 90.00 P 21 21 21 8 1BNA 60 ORIGX1 1.000000 0.000000 0.000000 0.00000 1BNA 61 ORIGX2 0.000000 1.000000 0.000000 0.00000 1BNA 62 ORIGX3 0.000000 0.000000 1.000000 0.00000 1BNA 63 SCALE1 .040209 0.000000 0.000000 0.00000 1BNA 64 SCALE2 0.000000 .024759 0.000000 0.00000 1BNA 65 SCALE3 0.000000 0.000000 .015106 0.00000 1BNA 66 ATOM 5 O5* C A 1 18.935 34.195 25.617 1.00 64.35 1BNA 67 ATOM 6 C5* C A 1 19.130 33.921 24.219 1.00 44.69 1BNA 68 ATOM 7 C4* C A 1 19.961 32.668 24.100 1.00 31.28 1BNA 69 ATOM 8 O4* C A 1 19.360 31.583 24.852 1.00 37.45 1BNA 70 ATOM 9 C3* C A 1 20.172 32.122 22.694 1.00 46.72 1BNA 71 ATOM 10 O3* C A 1 21.350 31.325 22.681 1.00 48.89 1BNA 72 ATOM 11 C2* C A 1 18.948 31.223 22.647 1.00 30.88 1BNA 73 ATOM 12 C1* C A 1 19.231 30.482 23.944 1.00 36.58 1BNA 74 ATOM 13 N1 C A 1 18.070 29.661 24.380 1.00 40.51 1BNA 75 ATOM 14 C2 C A 1 18.224 28.454 25.015 1.00 16.62 1BNA 76 ATOM 15 O2 C A 1 19.360 28.014 25.214 1.00 27.75 1BNA 77 ATOM 16 N3 C A 1 17.143 27.761 25.377 1.00 20.55 1BNA 78 ATOM 17 C4 C A 1 15.917 28.226 25.120 1.00 34.72 1BNA 79 ATOM 18 N4 C A 1 14.828 27.477 25.444 1.00 40.31 1BNA 80 ATOM 19 C5 C A 1 15.719 29.442 24.471 1.00 30.78 1BNA 81 ATOM 20 C6 C A 1 16.843 30.171 24.101 1.00 25.90 1BNA 82 ATOM 21 P G A 2 22.409 31.286 21.483 1.00 58.85 1BNA 83 ATOM 22 O1P G A 2 21.822 31.459 20.139 1.00 78.33 1BNA 84 ATOM 23 O2P G A 2 23.536 32.157 21.851 1.00 57.82 1BNA 85 ATOM 24 O5* G A 2 22.840 29.751 21.498 1.00 40.36 1BNA 86 ATOM 25 C5* G A 2 23.543 29.175 22.594 1.00 47.19 1BNA 87 ATOM 26 C4* G A 2 23.494 27.709 22.279 1.00 47.81 1BNA 88 ATOM 27 O4* G A 2 22.193 27.252 22.674 1.00 38.76 1BNA 89 ATOM 28 C3* G A 2 23.693 27.325 20.807 1.00 28.58 1BNA 90 ATOM 29 O3* G A 2 24.723 26.320 20.653 1.00 40.44 1BNA 91 ATOM 30 C2* G A 2 22.273 26.885 20.416 1.00 21.14 1BNA 92 ATOM 31 C1* G A 2 21.721 26.304 21.716 1.00 33.95 1BNA 93 ATOM 32 N9 G A 2 20.237 26.470 21.780 1.00 34.00 1BNA 94 ATOM 33 C8 G A 2 19.526 27.584 21.429 1.00 36.47 1BNA 95 ATOM 34 N7 G A 2 18.207 27.455 21.636 1.00 32.37 1BNA 96 ATOM 35 C5 G A 2 18.083 26.212 22.142 1.00 15.06 1BNA 97 ATOM 36 C6 G A 2 16.904 25.525 22.545 1.00 11.88 1BNA 98 ATOM 37 O6 G A 2 15.739 25.916 22.518 1.00 21.30 1BNA 99 ATOM 38 N1 G A 2 17.197 24.279 23.037 1.00 15.44 1BNA 100 ATOM 39 C2 G A 2 18.434 23.717 23.155 1.00 9.63 1BNA 101 ATOM 40 N2 G A 2 18.508 22.456 23.668 1.00 16.69 1BNA 102 ATOM 41 N3 G A 2 19.537 24.360 22.770 1.00 30.98 1BNA 103 ATOM 42 C4 G A 2 19.290 25.594 22.274 1.00 18.56 1BNA 104 ATOM 43 P C A 3 25.064 25.621 19.252 1.00 44.67 1BNA 105 ATOM 44 O1P C A 3 24.559 26.412 18.115 1.00 57.79 1BNA 106 ATOM 45 O2P C A 3 26.506 25.316 19.220 1.00 53.89 1BNA 107 ATOM 46 O5* C A 3 24.260 24.246 19.327 1.00 35.42 1BNA 108 ATOM 47 C5* C A 3 24.584 23.285 20.335 1.00 45.75 1BNA 109 ATOM 48 C4* C A 3 23.523 22.233 20.245 1.00 43.02 1BNA 110 ATOM 49 O4* C A 3 22.256 22.844 20.453 1.00 36.85 1BNA 111 ATOM 50 C3* C A 3 23.424 21.557 18.903 1.00 40.14 1BNA 112 ATOM 51 O3* C A 3 24.121 20.309 18.928 1.00 49.62 1BNA 113 ATOM 52 C2* C A 3 21.930 21.406 18.661 1.00 53.79 1BNA 114 ATOM 53 C1* C A 3 21.278 21.966 19.909 1.00 22.18 1BNA 115 ATOM 54 N1 C A 3 20.196 22.889 19.521 1.00 25.44 1BNA 116 ATOM 55 C2 C A 3 18.909 22.584 19.816 1.00 19.81 1BNA 117 ATOM 56 O2 C A 3 18.685 21.512 20.382 1.00 29.92 1BNA 118 ATOM 57 N3 C A 3 17.935 23.447 19.502 1.00 21.59 1BNA 119 ATOM 58 C4 C A 3 18.217 24.603 18.897 1.00 14.01 1BNA 120 ATOM 59 N4 C A 3 17.221 25.499 18.629 1.00 26.88 1BNA 121 ATOM 60 C5 C A 3 19.526 24.945 18.571 1.00 27.59 1BNA 122 ATOM 61 C6 C A 3 20.537 24.048 18.899 1.00 27.05 1BNA 123 ATOM 62 P G A 4 24.249 19.412 17.617 1.00 44.54 1BNA 124 ATOM 63 O1P G A 4 24.208 20.296 16.440 1.00 37.36 1BNA 125 ATOM 64 O2P G A 4 25.420 18.535 17.765 1.00 61.90 1BNA 126 ATOM 65 O5* G A 4 22.931 18.537 17.670 1.00 32.01 1BNA 127 ATOM 66 C5* G A 4 22.714 17.625 18.753 1.00 37.89 1BNA 128 ATOM 67 C4* G A 4 21.393 16.960 18.505 1.00 53.00 1BNA 129 ATOM 68 O4* G A 4 20.353 17.952 18.496 1.00 38.79 1BNA 130 ATOM 69 C3* G A 4 21.264 16.229 17.176 1.00 56.72 1BNA 131 ATOM 70 O3* G A 4 20.284 15.214 17.238 1.00 64.12 1BNA 132 ATOM 71 C2* G A 4 20.793 17.368 16.288 1.00 40.81 1BNA 133 ATOM 72 C1* G A 4 19.716 17.901 17.218 1.00 30.52 1BNA 134 ATOM 73 N9 G A 4 19.305 19.281 16.869 1.00 28.53 1BNA 135 ATOM 74 C8 G A 4 20.017 20.263 16.232 1.00 27.82 1BNA 136 ATOM 75 N7 G A 4 19.313 21.394 16.077 1.00 28.01 1BNA 137 ATOM 76 C5 G A 4 18.121 21.100 16.635 1.00 23.22 1BNA 138 ATOM 77 C6 G A 4 16.952 21.904 16.749 1.00 29.21 1BNA 139 ATOM 78 O6 G A 4 16.769 23.057 16.368 1.00 38.58 1BNA 140 ATOM 79 N1 G A 4 15.933 21.214 17.352 1.00 27.94 1BNA 141 ATOM 80 C2 G A 4 15.972 19.930 17.816 1.00 23.44 1BNA 142 ATOM 81 N2 G A 4 14.831 19.416 18.353 1.00 42.64 1BNA 143 ATOM 82 N3 G A 4 17.068 19.179 17.717 1.00 21.56 1BNA 144 ATOM 83 C4 G A 4 18.084 19.825 17.121 1.00 23.44 1BNA 145 ATOM 84 P A A 5 20.356 13.969 16.245 1.00 57.01 1BNA 146 ATOM 85 O1P A A 5 20.837 14.423 14.910 1.00 51.96 1BNA 147 ATOM 86 O2P A A 5 21.116 12.891 16.892 1.00 58.59 1BNA 148 ATOM 87 O5* A A 5 18.810 13.581 16.161 1.00 47.12 1BNA 149 ATOM 88 C5* A A 5 18.015 13.569 17.362 1.00 47.67 1BNA 150 ATOM 89 C4* A A 5 16.672 14.088 16.957 1.00 64.79 1BNA 151 ATOM 90 O4* A A 5 16.842 15.447 16.561 1.00 47.60 1BNA 152 ATOM 91 C3* A A 5 16.019 13.393 15.764 1.00 51.50 1BNA 153 ATOM 92 O3* A A 5 14.762 12.796 16.120 1.00 52.18 1BNA 154 ATOM 93 C2* A A 5 15.952 14.498 14.696 1.00 45.00 1BNA 155 ATOM 94 C1* A A 5 15.851 15.732 15.569 1.00 26.88 1BNA 156 ATOM 95 N9 A A 5 16.391 16.916 14.867 1.00 16.69 1BNA 157 ATOM 96 C8 A A 5 17.658 17.103 14.382 1.00 28.14 1BNA 158 ATOM 97 N7 A A 5 17.863 18.346 13.913 1.00 34.85 1BNA 159 ATOM 98 C5 A A 5 16.673 18.953 14.098 1.00 22.49 1BNA 160 ATOM 99 C6 A A 5 16.230 20.279 13.819 1.00 18.12 1BNA 161 ATOM 100 N6 A A 5 17.045 21.222 13.268 1.00 29.30 1BNA 162 ATOM 101 N1 A A 5 14.966 20.578 14.118 1.00 27.61 1BNA 163 ATOM 102 C2 A A 5 14.178 19.652 14.669 1.00 18.53 1BNA 164 ATOM 103 N3 A A 5 14.463 18.392 14.984 1.00 29.16 1BNA 165 ATOM 104 C4 A A 5 15.750 18.110 14.661 1.00 15.08 1BNA 166 ATOM 105 P A A 6 13.866 12.006 15.063 1.00 43.68 1BNA 167 ATOM 106 O1P A A 6 14.715 11.499 13.968 1.00 54.20 1BNA 168 ATOM 107 O2P A A 6 13.028 11.039 15.800 1.00 42.55 1BNA 169 ATOM 108 O5* A A 6 12.879 13.111 14.480 1.00 28.20 1BNA 170 ATOM 109 C5* A A 6 11.802 13.597 15.290 1.00 42.29 1BNA 171 ATOM 110 C4* A A 6 11.111 14.603 14.435 1.00 33.23 1BNA 172 ATOM 111 O4* A A 6 12.152 15.460 13.962 1.00 41.48 1BNA 173 ATOM 112 C3* A A 6 10.417 14.070 13.187 1.00 18.16 1BNA 174 ATOM 113 O3* A A 6 9.007 14.369 13.181 1.00 30.42 1BNA 175 ATOM 114 C2* A A 6 11.240 14.692 12.061 1.00 52.97 1BNA 176 ATOM 115 C1* A A 6 11.699 15.974 12.719 1.00 38.93 1BNA 177 ATOM 116 N9 A A 6 12.918 16.526 12.078 1.00 19.06 1BNA 178 ATOM 117 C8 A A 6 14.115 15.899 11.868 1.00 17.83 1BNA 179 ATOM 118 N7 A A 6 15.049 16.714 11.356 1.00 29.55 1BNA 180 ATOM 119 C5 A A 6 14.416 17.901 11.246 1.00 19.88 1BNA 181 ATOM 120 C6 A A 6 14.873 19.187 10.815 1.00 17.26 1BNA 182 ATOM 121 N6 A A 6 16.161 19.418 10.427 1.00 19.85 1BNA 183 ATOM 122 N1 A A 6 13.999 20.191 10.852 1.00 17.93 1BNA 184 ATOM 123 C2 A A 6 12.753 19.962 11.272 1.00 23.00 1BNA 185 ATOM 124 N3 A A 6 12.210 18.824 11.698 1.00 21.37 1BNA 186 ATOM 125 C4 A A 6 13.116 17.823 11.657 1.00 15.93 1BNA 187 ATOM 126 P T A 7 8.081 14.050 11.915 1.00 40.72 1BNA 188 ATOM 127 O1P T A 7 8.600 12.894 11.137 1.00 42.53 1BNA 189 ATOM 128 O2P T A 7 6.668 13.960 12.342 1.00 46.75 1BNA 190 ATOM 129 O5* T A 7 8.239 15.387 11.076 1.00 35.21 1BNA 191 ATOM 130 C5* T A 7 7.907 16.635 11.686 1.00 34.88 1BNA 192 ATOM 131 C4* T A 7 8.162 17.628 10.598 1.00 31.45 1BNA 193 ATOM 132 O4* T A 7 9.543 17.580 10.279 1.00 46.82 1BNA 194 ATOM 133 C3* T A 7 7.461 17.284 9.296 1.00 23.76 1BNA 195 ATOM 134 O3* T A 7 6.251 18.034 9.162 1.00 44.27 1BNA 196 ATOM 135 C2* T A 7 8.532 17.527 8.223 1.00 26.30 1BNA 197 ATOM 136 C1* T A 7 9.644 18.209 9.019 1.00 28.96 1BNA 198 ATOM 137 N1 T A 7 11.021 17.903 8.565 1.00 20.47 1BNA 199 ATOM 138 C2 T A 7 11.822 18.923 8.176 1.00 28.01 1BNA 200 ATOM 139 O2 T A 7 11.383 20.077 8.143 1.00 40.01 1BNA 201 ATOM 140 N3 T A 7 13.119 18.641 7.852 1.00 27.94 1BNA 202 ATOM 141 C4 T A 7 13.633 17.372 7.882 1.00 15.14 1BNA 203 ATOM 142 O4 T A 7 14.830 17.222 7.619 1.00 32.54 1BNA 204 ATOM 143 C5 T A 7 12.781 16.325 8.235 1.00 10.83 1BNA 205 ATOM 144 C5M T A 7 13.269 14.902 8.236 1.00 36.33 1BNA 206 ATOM 145 C6 T A 7 11.465 16.616 8.594 1.00 12.19 1BNA 207 ATOM 146 P T A 8 5.384 17.990 7.824 1.00 49.10 1BNA 208 ATOM 147 O1P T A 8 5.458 16.668 7.160 1.00 39.21 1BNA 209 ATOM 148 O2P T A 8 4.025 18.444 8.180 1.00 41.11 1BNA 210 ATOM 149 O5* T A 8 6.086 19.118 6.927 1.00 48.80 1BNA 211 ATOM 150 C5* T A 8 6.146 20.478 7.418 1.00 34.73 1BNA 212 ATOM 151 C4* T A 8 6.995 21.229 6.438 1.00 28.73 1BNA 213 ATOM 152 O4* T A 8 8.188 20.458 6.284 1.00 39.07 1BNA 214 ATOM 153 C3* T A 8 6.418 21.332 5.029 1.00 37.88 1BNA 215 ATOM 154 O3* T A 8 5.967 22.667 4.696 1.00 52.04 1BNA 216 ATOM 155 C2* T A 8 7.513 20.718 4.139 1.00 32.80 1BNA 217 ATOM 156 C1* T A 8 8.736 20.855 5.034 1.00 36.58 1BNA 218 ATOM 157 N1 T A 8 9.823 19.876 4.759 1.00 24.57 1BNA 219 ATOM 158 C2 T A 8 11.086 20.316 4.494 1.00 19.41 1BNA 220 ATOM 159 O2 T A 8 11.324 21.516 4.389 1.00 32.74 1BNA 221 ATOM 160 N3 T A 8 12.094 19.403 4.412 1.00 25.12 1BNA 222 ATOM 161 C4 T A 8 11.876 18.060 4.551 1.00 31.35 1BNA 223 ATOM 162 O4 T A 8 12.858 17.317 4.503 1.00 28.53 1BNA 224 ATOM 163 C5 T A 8 10.569 17.611 4.765 1.00 22.80 1BNA 225 ATOM 164 C5M T A 8 10.261 16.140 4.896 1.00 24.98 1BNA 226 ATOM 165 C6 T A 8 9.545 18.548 4.904 1.00 20.28 1BNA 227 ATOM 166 P C A 9 5.531 23.071 3.209 1.00 48.97 1BNA 228 ATOM 167 O1P C A 9 5.010 21.905 2.470 1.00 51.53 1BNA 229 ATOM 168 O2P C A 9 4.648 24.244 3.269 1.00 62.33 1BNA 230 ATOM 169 O5* C A 9 6.926 23.547 2.611 1.00 43.99 1BNA 231 ATOM 170 C5* C A 9 7.636 24.627 3.249 1.00 50.86 1BNA 232 ATOM 171 C4* C A 9 8.897 24.853 2.457 1.00 46.66 1BNA 233 ATOM 172 O4* C A 9 9.638 23.627 2.448 1.00 42.69 1BNA 234 ATOM 173 C3* C A 9 8.717 25.240 .998 1.00 56.96 1BNA 235 ATOM 174 O3* C A 9 9.470 26.414 .667 1.00 63.54 1BNA 236 ATOM 175 C2* C A 9 9.126 23.965 .253 1.00 50.41 1BNA 237 ATOM 176 C1* C A 9 10.241 23.483 1.157 1.00 41.08 1BNA 238 ATOM 177 N1 C A 9 10.524 22.022 1.015 1.00 37.23 1BNA 239 ATOM 178 C2 C A 9 11.814 21.603 .840 1.00 40.54 1BNA 240 ATOM 179 O2 C A 9 12.691 22.447 .670 1.00 43.89 1BNA 241 ATOM 180 N3 C A 9 12.106 20.297 .873 1.00 32.57 1BNA 242 ATOM 181 C4 C A 9 11.141 19.395 1.046 1.00 24.65 1BNA 243 ATOM 182 N4 C A 9 11.461 18.075 1.089 1.00 27.84 1BNA 244 ATOM 183 C5 C A 9 9.803 19.775 1.177 1.00 17.61 1BNA 245 ATOM 184 C6 C A 9 9.499 21.133 1.167 1.00 30.63 1BNA 246 ATOM 185 P G A 10 9.055 27.333 -.581 1.00 65.48 1BNA 247 ATOM 186 O1P G A 10 7.632 27.106 -.947 1.00 45.71 1BNA 248 ATOM 187 O2P G A 10 9.496 28.717 -.258 1.00 59.09 1BNA 249 ATOM 188 O5* G A 10 9.954 26.765 -1.771 1.00 70.30 1BNA 250 ATOM 189 C5* G A 10 11.382 26.940 -1.720 1.00 71.73 1BNA 251 ATOM 190 C4* G A 10 11.972 26.090 -2.802 1.00 58.69 1BNA 252 ATOM 191 O4* G A 10 11.802 24.724 -2.404 1.00 41.03 1BNA 253 ATOM 192 C3* G A 10 11.327 26.178 -4.188 1.00 45.61 1BNA 254 ATOM 193 O3* G A 10 12.311 26.096 -5.214 1.00 52.70 1BNA 255 ATOM 194 C2* G A 10 10.414 24.962 -4.186 1.00 36.02 1BNA 256 ATOM 195 C1* G A 10 11.429 24.028 -3.587 1.00 50.90 1BNA 257 ATOM 196 N9 G A 10 10.890 22.713 -3.200 1.00 45.86 1BNA 258 ATOM 197 C8 G A 10 9.616 22.315 -2.910 1.00 44.49 1BNA 259 ATOM 198 N7 G A 10 9.541 21.009 -2.613 1.00 39.96 1BNA 260 ATOM 199 C5 G A 10 10.818 20.588 -2.718 1.00 38.99 1BNA 261 ATOM 200 C6 G A 10 11.376 19.292 -2.511 1.00 35.78 1BNA 262 ATOM 201 O6 G A 10 10.813 18.252 -2.179 1.00 34.90 1BNA 263 ATOM 202 N1 G A 10 12.729 19.299 -2.720 1.00 23.54 1BNA 264 ATOM 203 C2 G A 10 13.498 20.365 -3.082 1.00 8.73 1BNA 265 ATOM 204 N2 G A 10 14.834 20.169 -3.237 1.00 23.15 1BNA 266 ATOM 205 N3 G A 10 12.982 21.573 -3.267 1.00 24.68 1BNA 267 ATOM 206 C4 G A 10 11.656 21.601 -3.061 1.00 31.53 1BNA 268 ATOM 207 P C A 11 12.763 27.421 -5.980 1.00 60.62 1BNA 269 ATOM 208 O1P C A 11 11.886 27.542 -7.164 1.00 52.44 1BNA 270 ATOM 209 O2P C A 11 12.796 28.572 -5.049 1.00 63.74 1BNA 271 ATOM 210 O5* C A 11 14.272 27.086 -6.366 1.00 57.57 1BNA 272 ATOM 211 C5* C A 11 15.275 27.108 -5.318 1.00 54.70 1BNA 273 ATOM 212 C4* C A 11 16.222 25.946 -5.510 1.00 72.51 1BNA 274 ATOM 213 O4* C A 11 15.443 24.754 -5.397 1.00 47.18 1BNA 275 ATOM 214 C3* C A 11 16.942 25.827 -6.848 1.00 29.82 1BNA 276 ATOM 215 O3* C A 11 18.340 25.511 -6.701 1.00 43.53 1BNA 277 ATOM 216 C2* C A 11 16.118 24.767 -7.578 1.00 51.34 1BNA 278 ATOM 217 C1* C A 11 15.856 23.836 -6.414 1.00 30.07 1BNA 279 ATOM 218 N1 C A 11 14.672 22.975 -6.637 1.00 23.25 1BNA 280 ATOM 219 C2 C A 11 14.802 21.628 -6.529 1.00 20.38 1BNA 281 ATOM 220 O2 C A 11 15.924 21.178 -6.314 1.00 38.77 1BNA 282 ATOM 221 N3 C A 11 13.723 20.842 -6.627 1.00 15.92 1BNA 283 ATOM 222 C4 C A 11 12.515 21.373 -6.836 1.00 15.82 1BNA 284 ATOM 223 N4 C A 11 11.410 20.574 -6.872 1.00 28.04 1BNA 285 ATOM 224 C5 C A 11 12.348 22.744 -6.978 1.00 26.17 1BNA 286 ATOM 225 C6 C A 11 13.470 23.558 -6.869 1.00 35.50 1BNA 287 ATOM 226 P G A 12 19.331 25.774 -7.925 1.00 55.98 1BNA 288 ATOM 227 O1P G A 12 18.763 26.851 -8.758 1.00 44.26 1BNA 289 ATOM 228 O2P G A 12 20.704 25.976 -7.408 1.00 45.83 1BNA 290 ATOM 229 O5* G A 12 19.302 24.412 -8.763 1.00 62.63 1BNA 291 ATOM 230 C5* G A 12 20.109 23.284 -8.359 1.00 69.50 1BNA 292 ATOM 231 C4* G A 12 19.748 22.167 -9.299 1.00 39.92 1BNA 293 ATOM 232 O4* G A 12 18.350 21.969 -9.139 1.00 32.00 1BNA 294 ATOM 233 C3* G A 12 19.921 22.404 -10.815 1.00 50.39 1BNA 295 ATOM 234 O3* G A 12 20.985 21.635 -11.401 1.00 64.13 1BNA 296 ATOM 235 C2* G A 12 18.535 22.062 -11.381 1.00 36.18 1BNA 297 ATOM 236 C1* G A 12 17.965 21.200 -10.269 1.00 24.79 1BNA 298 ATOM 237 N9 G A 12 16.493 21.220 -10.265 1.00 28.44 1BNA 299 ATOM 238 C8 G A 12 15.663 22.289 -10.478 1.00 31.85 1BNA 300 ATOM 239 N7 G A 12 14.368 21.958 -10.390 1.00 38.26 1BNA 301 ATOM 240 C5 G A 12 14.388 20.640 -10.102 1.00 28.99 1BNA 302 ATOM 241 C6 G A 12 13.301 19.742 -9.856 1.00 42.63 1BNA 303 ATOM 242 O6 G A 12 12.091 19.967 -9.857 1.00 49.17 1BNA 304 ATOM 243 N1 G A 12 13.750 18.466 -9.625 1.00 40.15 1BNA 305 ATOM 244 C2 G A 12 15.042 18.043 -9.605 1.00 33.42 1BNA 306 ATOM 245 N2 G A 12 15.259 16.717 -9.406 1.00 40.53 1BNA 307 ATOM 246 N3 G A 12 16.061 18.885 -9.792 1.00 37.34 1BNA 308 ATOM 247 C4 G A 12 15.660 20.156 -10.027 1.00 31.14 1BNA 309 TER 248 G A 12 1BNA 310 ATOM 253 O5* C B 1 7.458 11.884 -9.070 1.00 66.23 1BNA 311 ATOM 254 C5* C B 1 8.252 10.968 -9.854 1.00 71.49 1BNA 312 ATOM 255 C4* C B 1 9.714 11.141 -9.512 1.00 56.82 1BNA 313 ATOM 256 O4* C B 1 10.144 12.455 -9.908 1.00 57.92 1BNA 314 ATOM 257 C3* C B 1 10.103 10.989 -8.055 1.00 34.34 1BNA 315 ATOM 258 O3* C B 1 11.293 10.221 -7.904 1.00 42.11 1BNA 316 ATOM 259 C2* C B 1 10.254 12.437 -7.607 1.00 29.08 1BNA 317 ATOM 260 C1* C B 1 10.896 13.044 -8.837 1.00 38.40 1BNA 318 ATOM 261 N1 C B 1 10.575 14.487 -8.944 1.00 34.33 1BNA 319 ATOM 262 C2 C B 1 11.559 15.430 -9.006 1.00 22.98 1BNA 320 ATOM 263 O2 C B 1 12.725 15.066 -8.932 1.00 50.83 1BNA 321 ATOM 264 N3 C B 1 11.246 16.714 -9.193 1.00 37.14 1BNA 322 ATOM 265 C4 C B 1 9.980 17.088 -9.334 1.00 42.60 1BNA 323 ATOM 266 N4 C B 1 9.698 18.395 -9.589 1.00 54.91 1BNA 324 ATOM 267 C5 C B 1 8.939 16.162 -9.274 1.00 56.67 1BNA 325 ATOM 268 C6 C B 1 9.265 14.824 -9.080 1.00 49.21 1BNA 326 ATOM 269 P G B 2 11.602 9.510 -6.502 1.00 60.42 1BNA 327 ATOM 270 O1P G B 2 10.644 10.010 -5.494 1.00 46.07 1BNA 328 ATOM 271 O2P G B 2 11.666 8.032 -6.664 1.00 57.44 1BNA 329 ATOM 272 O5* G B 2 13.051 10.094 -6.177 1.00 50.94 1BNA 330 ATOM 273 C5* G B 2 14.100 10.021 -7.156 1.00 34.84 1BNA 331 ATOM 274 C4* G B 2 15.113 10.992 -6.657 1.00 48.06 1BNA 332 ATOM 275 O4* G B 2 14.556 12.300 -6.755 1.00 37.01 1BNA 333 ATOM 276 C3* G B 2 15.445 10.806 -5.189 1.00 50.58 1BNA 334 ATOM 277 O3* G B 2 16.836 10.560 -5.013 1.00 51.98 1BNA 335 ATOM 278 C2* G B 2 14.937 12.100 -4.529 1.00 40.32 1BNA 336 ATOM 279 C1* G B 2 15.058 13.086 -5.671 1.00 46.69 1BNA 337 ATOM 280 N9 G B 2 14.036 14.140 -5.536 1.00 29.17 1BNA 338 ATOM 281 C8 G B 2 12.710 13.957 -5.259 1.00 23.48 1BNA 339 ATOM 282 N7 G B 2 12.016 15.103 -5.269 1.00 37.54 1BNA 340 ATOM 283 C5 G B 2 12.937 16.041 -5.558 1.00 26.27 1BNA 341 ATOM 284 C6 G B 2 12.761 17.451 -5.710 1.00 40.82 1BNA 342 ATOM 285 O6 G B 2 11.723 18.111 -5.630 1.00 44.39 1BNA 343 ATOM 286 N1 G B 2 13.952 18.079 -5.973 1.00 19.52 1BNA 344 ATOM 287 C2 G B 2 15.171 17.485 -6.107 1.00 18.48 1BNA 345 ATOM 288 N2 G B 2 16.244 18.292 -6.325 1.00 36.58 1BNA 346 ATOM 289 N3 G B 2 15.329 16.161 -5.986 1.00 46.96 1BNA 347 ATOM 290 C4 G B 2 14.179 15.499 -5.721 1.00 35.70 1BNA 348 ATOM 291 P C B 3 17.478 10.380 -3.569 1.00 46.26 1BNA 349 ATOM 292 O1P C B 3 16.427 9.940 -2.633 1.00 40.43 1BNA 350 ATOM 293 O2P C B 3 18.665 9.516 -3.729 1.00 46.07 1BNA 351 ATOM 294 O5* C B 3 17.957 11.865 -3.208 1.00 40.97 1BNA 352 ATOM 295 C5* C B 3 18.963 12.531 -3.996 1.00 28.78 1BNA 353 ATOM 296 C4* C B 3 18.936 13.958 -3.536 1.00 32.84 1BNA 354 ATOM 297 O4* C B 3 17.592 14.409 -3.622 1.00 37.24 1BNA 355 ATOM 298 C3* C B 3 19.253 14.139 -2.066 1.00 43.98 1BNA 356 ATOM 299 O3* C B 3 20.659 14.219 -1.858 1.00 40.90 1BNA 357 ATOM 300 C2* C B 3 18.520 15.417 -1.728 1.00 36.26 1BNA 358 ATOM 301 C1* C B 3 17.545 15.602 -2.872 1.00 20.54 1BNA 359 ATOM 302 N1 C B 3 16.145 15.696 -2.428 1.00 23.10 1BNA 360 ATOM 303 C2 C B 3 15.507 16.886 -2.558 1.00 32.12 1BNA 361 ATOM 304 O2 C B 3 16.162 17.846 -2.957 1.00 30.04 1BNA 362 ATOM 305 N3 C B 3 14.209 16.983 -2.264 1.00 32.94 1BNA 363 ATOM 306 C4 C B 3 13.536 15.919 -1.825 1.00 16.43 1BNA 364 ATOM 307 N4 C B 3 12.205 16.017 -1.553 1.00 34.91 1BNA 365 ATOM 308 C5 C B 3 14.164 14.689 -1.652 1.00 22.75 1BNA 366 ATOM 309 C6 C B 3 15.509 14.584 -1.979 1.00 26.42 1BNA 367 ATOM 310 P G B 4 21.304 14.529 -.436 1.00 42.39 1BNA 368 ATOM 311 O1P G B 4 20.488 13.954 .650 1.00 51.09 1BNA 369 ATOM 312 O2P G B 4 22.696 14.087 -.524 1.00 60.41 1BNA 370 ATOM 313 O5* G B 4 21.306 16.117 -.363 1.00 45.08 1BNA 371 ATOM 314 C5* G B 4 22.177 16.876 -1.212 1.00 33.20 1BNA 372 ATOM 315 C4* G B 4 21.739 18.292 -1.021 1.00 24.95 1BNA 373 ATOM 316 O4* G B 4 20.305 18.225 -1.048 1.00 32.83 1BNA 374 ATOM 317 C3* G B 4 22.101 18.959 .293 1.00 41.12 1BNA 375 ATOM 318 O3* G B 4 22.592 20.293 .097 1.00 53.45 1BNA 376 ATOM 319 C2* G B 4 20.820 18.829 1.121 1.00 28.93 1BNA 377 ATOM 320 C1* G B 4 19.765 18.985 .046 1.00 37.44 1BNA 378 ATOM 321 N9 G B 4 18.513 18.299 .468 1.00 17.75 1BNA 379 ATOM 322 C8 G B 4 18.363 17.062 1.039 1.00 17.96 1BNA 380 ATOM 323 N7 G B 4 17.080 16.744 1.281 1.00 24.14 1BNA 381 ATOM 324 C5 G B 4 16.400 17.832 .868 1.00 9.96 1BNA 382 ATOM 325 C6 G B 4 14.996 18.090 .882 1.00 18.10 1BNA 383 ATOM 326 O6 G B 4 14.082 17.378 1.280 1.00 31.13 1BNA 384 ATOM 327 N1 G B 4 14.712 19.349 .418 1.00 17.72 1BNA 385 ATOM 328 C2 G B 4 15.606 20.268 -.027 1.00 16.23 1BNA 386 ATOM 329 N2 G B 4 15.134 21.493 -.382 1.00 33.42 1BNA 387 ATOM 330 N3 G B 4 16.912 20.017 -.072 1.00 26.37 1BNA 388 ATOM 331 C4 G B 4 17.236 18.794 .384 1.00 31.72 1BNA 389 ATOM 332 P A B 5 22.904 21.238 1.339 1.00 46.87 1BNA 390 ATOM 333 O1P A B 5 23.104 20.390 2.538 1.00 46.81 1BNA 391 ATOM 334 O2P A B 5 23.994 22.183 1.025 1.00 47.75 1BNA 392 ATOM 335 O5* A B 5 21.577 22.107 1.390 1.00 39.51 1BNA 393 ATOM 336 C5* A B 5 21.216 22.833 .200 1.00 30.37 1BNA 394 ATOM 337 C4* A B 5 20.101 23.788 .484 1.00 35.43 1BNA 395 ATOM 338 O4* A B 5 18.913 23.054 .816 1.00 43.05 1BNA 396 ATOM 339 C3* A B 5 20.347 24.743 1.633 1.00 44.50 1BNA 397 ATOM 340 O3* A B 5 19.732 26.010 1.411 1.00 78.59 1BNA 398 ATOM 341 C2* A B 5 19.752 23.945 2.791 1.00 44.42 1BNA 399 ATOM 342 C1* A B 5 18.497 23.393 2.145 1.00 42.55 1BNA 400 ATOM 343 N9 A B 5 18.079 22.095 2.758 1.00 34.56 1BNA 401 ATOM 344 C8 A B 5 18.847 21.020 3.133 1.00 20.07 1BNA 402 ATOM 345 N7 A B 5 18.114 19.984 3.584 1.00 27.60 1BNA 403 ATOM 346 C5 A B 5 16.842 20.424 3.488 1.00 18.80 1BNA 404 ATOM 347 C6 A B 5 15.577 19.817 3.786 1.00 32.58 1BNA 405 ATOM 348 N6 A B 5 15.448 18.537 4.242 1.00 29.54 1BNA 406 ATOM 349 N1 A B 5 14.482 20.557 3.593 1.00 35.01 1BNA 407 ATOM 350 C2 A B 5 14.597 21.801 3.118 1.00 36.47 1BNA 408 ATOM 351 N3 A B 5 15.700 22.472 2.783 1.00 38.96 1BNA 409 ATOM 352 C4 A B 5 16.791 21.706 3.002 1.00 28.24 1BNA 410 ATOM 353 P A B 6 19.803 27.141 2.526 1.00 46.11 1BNA 411 ATOM 354 O1P A B 6 20.953 26.858 3.426 1.00 43.48 1BNA 412 ATOM 355 O2P A B 6 19.796 28.478 1.888 1.00 49.20 1BNA 413 ATOM 356 O5* A B 6 18.396 26.939 3.241 1.00 40.83 1BNA 414 ATOM 357 C5* A B 6 17.203 27.028 2.452 1.00 40.72 1BNA 415 ATOM 358 C4* A B 6 16.035 26.958 3.388 1.00 66.52 1BNA 416 ATOM 359 O4* A B 6 15.856 25.612 3.850 1.00 44.25 1BNA 417 ATOM 360 C3* A B 6 16.101 27.861 4.615 1.00 63.34 1BNA 418 ATOM 361 O3* A B 6 14.890 28.608 4.757 1.00 55.65 1BNA 419 ATOM 362 C2* A B 6 16.368 26.844 5.724 1.00 34.49 1BNA 420 ATOM 363 C1* A B 6 15.561 25.655 5.243 1.00 29.45 1BNA 421 ATOM 364 N9 A B 6 16.104 24.373 5.755 1.00 20.03 1BNA 422 ATOM 365 C8 A B 6 17.411 23.967 5.830 1.00 16.51 1BNA 423 ATOM 366 N7 A B 6 17.539 22.706 6.276 1.00 20.58 1BNA 424 ATOM 367 C5 A B 6 16.266 22.309 6.480 1.00 21.66 1BNA 425 ATOM 368 C6 A B 6 15.715 21.073 6.933 1.00 17.93 1BNA 426 ATOM 369 N6 A B 6 16.483 19.994 7.243 1.00 20.37 1BNA 427 ATOM 370 N1 A B 6 14.389 20.994 7.036 1.00 20.81 1BNA 428 ATOM 371 C2 A B 6 13.636 22.041 6.708 1.00 26.77 1BNA 429 ATOM 372 N3 A B 6 14.019 23.234 6.265 1.00 26.83 1BNA 430 ATOM 373 C4 A B 6 15.367 23.291 6.174 1.00 27.48 1BNA 431 ATOM 374 P T B 7 14.604 29.545 6.020 1.00 48.40 1BNA 432 ATOM 375 O1P T B 7 15.852 29.836 6.749 1.00 44.42 1BNA 433 ATOM 376 O2P T B 7 13.792 30.696 5.582 1.00 50.18 1BNA 434 ATOM 377 O5* T B 7 13.633 28.628 6.885 1.00 53.86 1BNA 435 ATOM 378 C5* T B 7 12.398 28.171 6.303 1.00 55.04 1BNA 436 ATOM 379 C4* T B 7 11.809 27.217 7.302 1.00 44.86 1BNA 437 ATOM 380 O4* T B 7 12.767 26.184 7.534 1.00 48.52 1BNA 438 ATOM 381 C3* T B 7 11.515 27.822 8.669 1.00 41.77 1BNA 439 ATOM 382 O3* T B 7 10.103 27.952 8.891 1.00 57.02 1BNA 440 ATOM 383 C2* T B 7 12.267 26.906 9.630 1.00 39.28 1BNA 441 ATOM 384 C1* T B 7 12.426 25.645 8.799 1.00 27.68 1BNA 442 ATOM 385 N1 T B 7 13.609 24.850 9.205 1.00 21.67 1BNA 443 ATOM 386 C2 T B 7 13.442 23.575 9.656 1.00 31.71 1BNA 444 ATOM 387 O2 T B 7 12.311 23.101 9.802 1.00 36.00 1BNA 445 ATOM 388 N3 T B 7 14.551 22.825 9.913 1.00 24.66 1BNA 446 ATOM 389 C4 T B 7 15.815 23.321 9.777 1.00 40.64 1BNA 447 ATOM 390 O4 T B 7 16.755 22.570 10.029 1.00 31.47 1BNA 448 ATOM 391 C5 T B 7 15.972 24.647 9.362 1.00 31.79 1BNA 449 ATOM 392 C5M T B 7 17.345 25.239 9.234 1.00 30.05 1BNA 450 ATOM 393 C6 T B 7 14.844 25.405 9.048 1.00 14.35 1BNA 451 ATOM 394 P T B 8 9.513 28.533 10.260 1.00 48.24 1BNA 452 ATOM 395 O1P T B 8 10.455 29.513 10.841 1.00 53.39 1BNA 453 ATOM 396 O2P T B 8 8.145 29.007 9.998 1.00 41.28 1BNA 454 ATOM 397 O5* T B 8 9.395 27.223 11.153 1.00 36.57 1BNA 455 ATOM 398 C5* T B 8 8.576 26.148 10.664 1.00 50.41 1BNA 456 ATOM 399 C4* T B 8 8.655 25.060 11.678 1.00 32.08 1BNA 457 ATOM 400 O4* T B 8 10.003 24.615 11.764 1.00 48.38 1BNA 458 ATOM 401 C3* T B 8 8.272 25.471 13.087 1.00 29.99 1BNA 459 ATOM 402 O3* T B 8 7.199 24.657 13.553 1.00 45.14 1BNA 460 ATOM 403 C2* T B 8 9.586 25.307 13.860 1.00 32.42 1BNA 461 ATOM 404 C1* T B 8 10.190 24.148 13.089 1.00 39.56 1BNA 462 ATOM 405 N1 T B 8 11.660 24.070 13.205 1.00 20.36 1BNA 463 ATOM 406 C2 T B 8 12.257 22.880 13.486 1.00 27.55 1BNA 464 ATOM 407 O2 T B 8 11.583 21.866 13.691 1.00 38.33 1BNA 465 ATOM 408 N3 T B 8 13.620 22.829 13.497 1.00 29.60 1BNA 466 ATOM 409 C4 T B 8 14.402 23.914 13.225 1.00 30.11 1BNA 467 ATOM 410 O4 T B 8 15.625 23.764 13.252 1.00 32.92 1BNA 468 ATOM 411 C5 T B 8 13.774 25.126 12.933 1.00 24.11 1BNA 469 ATOM 412 C5M T B 8 14.563 26.358 12.612 1.00 23.96 1BNA 470 ATOM 413 C6 T B 8 12.385 25.187 12.926 1.00 19.78 1BNA 471 ATOM 414 P C B 9 6.594 24.823 15.016 1.00 54.73 1BNA 472 ATOM 415 O1P C B 9 6.870 26.189 15.511 1.00 65.53 1BNA 473 ATOM 416 O2P C B 9 5.169 24.424 14.987 1.00 53.98 1BNA 474 ATOM 417 O5* C B 9 7.409 23.731 15.839 1.00 50.67 1BNA 475 ATOM 418 C5* C B 9 7.331 22.352 15.433 1.00 60.86 1BNA 476 ATOM 419 C4* C B 9 8.100 21.598 16.461 1.00 40.86 1BNA 477 ATOM 420 O4* C B 9 9.478 21.902 16.263 1.00 36.88 1BNA 478 ATOM 421 C3* C B 9 7.766 22.045 17.879 1.00 53.80 1BNA 479 ATOM 422 O3* C B 9 7.036 21.041 18.611 1.00 79.04 1BNA 480 ATOM 423 C2* C B 9 9.123 22.414 18.469 1.00 48.43 1BNA 481 ATOM 424 C1* C B 9 10.107 21.743 17.523 1.00 36.51 1BNA 482 ATOM 425 N1 C B 9 11.328 22.556 17.331 1.00 24.72 1BNA 483 ATOM 426 C2 C B 9 12.534 21.939 17.329 1.00 30.96 1BNA 484 ATOM 427 O2 C B 9 12.560 20.731 17.579 1.00 34.53 1BNA 485 ATOM 428 N3 C B 9 13.639 22.639 17.035 1.00 31.69 1BNA 486 ATOM 429 C4 C B 9 13.560 23.938 16.739 1.00 21.53 1BNA 487 ATOM 430 N4 C B 9 14.685 24.628 16.404 1.00 23.72 1BNA 488 ATOM 431 C5 C B 9 12.338 24.609 16.736 1.00 30.74 1BNA 489 ATOM 432 C6 C B 9 11.193 23.878 17.035 1.00 27.58 1BNA 490 ATOM 433 P G B 10 6.509 21.324 20.099 1.00 56.50 1BNA 491 ATOM 434 O1P G B 10 6.235 22.774 20.306 1.00 53.84 1BNA 492 ATOM 435 O2P G B 10 5.387 20.397 20.396 1.00 50.81 1BNA 493 ATOM 436 O5* G B 10 7.767 20.924 20.993 1.00 66.30 1BNA 494 ATOM 437 C5* G B 10 8.216 19.559 21.073 1.00 73.42 1BNA 495 ATOM 438 C4* G B 10 9.422 19.557 21.977 1.00 42.96 1BNA 496 ATOM 439 O4* G B 10 10.493 20.260 21.319 1.00 52.87 1BNA 497 ATOM 440 C3* G B 10 9.267 20.267 23.325 1.00 38.51 1BNA 498 ATOM 441 O3* G B 10 10.088 19.657 24.293 1.00 60.28 1BNA 499 ATOM 442 C2* G B 10 9.751 21.670 22.990 1.00 22.00 1BNA 500 ATOM 443 C1* G B 10 10.988 21.226 22.256 1.00 24.85 1BNA 501 ATOM 444 N9 G B 10 11.599 22.357 21.543 1.00 25.91 1BNA 502 ATOM 445 C8 G B 10 11.037 23.545 21.159 1.00 23.91 1BNA 503 ATOM 446 N7 G B 10 11.921 24.362 20.566 1.00 39.18 1BNA 504 ATOM 447 C5 G B 10 13.072 23.653 20.580 1.00 25.66 1BNA 505 ATOM 448 C6 G B 10 14.370 24.003 20.102 1.00 28.34 1BNA 506 ATOM 449 O6 G B 10 14.747 25.057 19.585 1.00 31.85 1BNA 507 ATOM 450 N1 G B 10 15.268 22.983 20.308 1.00 25.22 1BNA 508 ATOM 451 C2 G B 10 15.023 21.776 20.891 1.00 11.07 1BNA 509 ATOM 452 N2 G B 10 16.066 20.914 21.038 1.00 25.92 1BNA 510 ATOM 453 N3 G B 10 13.815 21.452 21.350 1.00 19.05 1BNA 511 ATOM 454 C4 G B 10 12.902 22.429 21.151 1.00 23.69 1BNA 512 ATOM 455 P C B 11 9.477 18.627 25.340 1.00 55.93 1BNA 513 ATOM 456 O1P C B 11 8.670 19.409 26.312 1.00 41.61 1BNA 514 ATOM 457 O2P C B 11 8.767 17.534 24.627 1.00 45.14 1BNA 515 ATOM 458 O5* C B 11 10.807 18.067 26.034 1.00 59.70 1BNA 516 ATOM 459 C5* C B 11 11.688 17.170 25.310 1.00 63.13 1BNA 517 ATOM 460 C4* C B 11 13.115 17.573 25.593 1.00 27.86 1BNA 518 ATOM 461 O4* C B 11 13.284 18.804 24.893 1.00 50.51 1BNA 519 ATOM 462 C3* C B 11 13.441 17.879 27.059 1.00 46.45 1BNA 520 ATOM 463 O3* C B 11 14.341 16.938 27.677 1.00 57.21 1BNA 521 ATOM 464 C2* C B 11 13.928 19.322 27.025 1.00 68.01 1BNA 522 ATOM 465 C1* C B 11 14.312 19.508 25.568 1.00 32.05 1BNA 523 ATOM 466 N1 C B 11 14.144 20.932 25.170 1.00 23.28 1BNA 524 ATOM 467 C2 C B 11 15.199 21.595 24.630 1.00 20.62 1BNA 525 ATOM 468 O2 C B 11 16.257 20.984 24.504 1.00 29.62 1BNA 526 ATOM 469 N3 C B 11 15.067 22.877 24.257 1.00 39.00 1BNA 527 ATOM 470 C4 C B 11 13.898 23.510 24.404 1.00 30.44 1BNA 528 ATOM 471 N4 C B 11 13.771 24.813 24.018 1.00 34.66 1BNA 529 ATOM 472 C5 C B 11 12.795 22.866 24.967 1.00 27.74 1BNA 530 ATOM 473 C6 C B 11 12.935 21.540 25.359 1.00 24.58 1BNA 531 ATOM 474 P G B 12 14.658 17.064 29.247 1.00 53.70 1BNA 532 ATOM 475 O1P G B 12 13.633 17.912 29.920 1.00 36.06 1BNA 533 ATOM 476 O2P G B 12 14.863 15.717 29.825 1.00 61.79 1BNA 534 ATOM 477 O5* G B 12 16.033 17.880 29.284 1.00 34.06 1BNA 535 ATOM 478 C5* G B 12 17.243 17.320 28.742 1.00 46.57 1BNA 536 ATOM 479 C4* G B 12 18.208 18.464 28.758 1.00 50.89 1BNA 537 ATOM 480 O4* G B 12 17.716 19.428 27.829 1.00 32.02 1BNA 538 ATOM 481 C3* G B 12 18.230 19.236 30.058 1.00 30.38 1BNA 539 ATOM 482 O3* G B 12 18.978 18.583 31.084 1.00 61.06 1BNA 540 ATOM 483 C2* G B 12 18.885 20.519 29.578 1.00 53.33 1BNA 541 ATOM 484 C1* G B 12 18.276 20.693 28.188 1.00 35.03 1BNA 542 ATOM 485 N9 G B 12 17.164 21.659 28.139 1.00 30.25 1BNA 543 ATOM 486 C8 G B 12 15.874 21.536 28.580 1.00 30.86 1BNA 544 ATOM 487 N7 G B 12 15.129 22.614 28.308 1.00 44.08 1BNA 545 ATOM 488 C5 G B 12 15.990 23.436 27.673 1.00 16.87 1BNA 546 ATOM 489 C6 G B 12 15.765 24.729 27.117 1.00 19.36 1BNA 547 ATOM 490 O6 G B 12 14.719 25.373 27.067 1.00 33.30 1BNA 548 ATOM 491 N1 G B 12 16.926 25.257 26.604 1.00 15.78 1BNA 549 ATOM 492 C2 G B 12 18.157 24.666 26.579 1.00 11.92 1BNA 550 ATOM 493 N2 G B 12 19.208 25.386 26.096 1.00 29.76 1BNA 551 ATOM 494 N3 G B 12 18.350 23.438 27.053 1.00 21.95 1BNA 552 ATOM 495 C4 G B 12 17.231 22.893 27.570 1.00 13.89 1BNA 553 TER 496 G B 12 1BNA 554 HETATM 497 O HOH 25 19.736 30.706 18.656 1.00 51.86 1BNA 555 HETATM 498 O HOH 26 14.354 27.683 16.369 1.00 40.92 1BNA 556 HETATM 499 O HOH 27 9.864 22.509 9.123 1.00 39.67 1BNA 557 HETATM 500 O HOH 28 19.526 19.144 7.481 1.00 51.15 1BNA 558 HETATM 501 O HOH 29 25.754 12.744 -1.835 1.00 51.80 1BNA 559 HETATM 502 O HOH 30 7.478 20.604 -9.000 1.00 44.82 1BNA 560 HETATM 503 O HOH 31 10.879 26.039 -8.906 1.00 47.07 1BNA 561 HETATM 504 O HOH 32 18.320 24.816 14.948 1.00 47.72 1BNA 562 HETATM 505 O HOH 33 9.012 24.586 7.009 1.00 43.42 1BNA 563 HETATM 506 O HOH 34 10.152 19.917 13.381 1.00 48.04 1BNA 564 HETATM 507 O HOH 35 7.764 21.397 11.075 1.00 41.41 1BNA 565 HETATM 508 O HOH 36 9.821 13.442 8.572 1.00 45.76 1BNA 566 HETATM 509 O HOH 37 13.239 14.428 2.049 1.00 55.54 1BNA 567 HETATM 510 O HOH 38 8.915 15.602 -3.388 1.00 50.97 1BNA 568 HETATM 511 O HOH 39 17.505 26.340 -10.581 1.00 51.90 1BNA 569 HETATM 512 O HOH 40 28.496 23.515 18.349 1.00 45.37 1BNA 570 HETATM 513 O HOH 41 11.346 24.175 4.920 1.00 45.03 1BNA 571 HETATM 514 O HOH 42 12.601 23.000 29.167 1.00 51.36 1BNA 572 HETATM 515 O HOH 43 10.440 25.542 24.443 1.00 56.79 1BNA 573 HETATM 516 O HOH 44 16.979 28.689 16.284 1.00 50.41 1BNA 574 HETATM 517 O HOH 45 4.794 22.966 13.368 1.00 45.95 1BNA 575 HETATM 518 O HOH 46 4.208 25.591 10.828 1.00 51.06 1BNA 576 HETATM 519 O HOH 47 6.362 24.374 9.188 1.00 51.85 1BNA 577 HETATM 520 O HOH 48 7.688 28.411 7.883 1.00 49.33 1BNA 578 HETATM 521 O HOH 49 18.379 17.074 4.809 1.00 50.72 1BNA 579 HETATM 522 O HOH 50 9.098 16.119 1.277 1.00 51.80 1BNA 580 HETATM 523 O HOH 51 26.464 23.826 1.396 1.00 53.21 1BNA 581 HETATM 524 O HOH 52 11.014 11.318 -2.909 1.00 51.36 1BNA 582 HETATM 525 O HOH 53 9.476 27.782 26.498 1.00 60.04 1BNA 583 HETATM 526 O HOH 54 16.488 29.195 19.861 1.00 54.92 1BNA 584 HETATM 527 O HOH 55 22.078 25.894 15.396 1.00 62.20 1BNA 585 HETATM 528 O HOH 56 5.522 27.411 9.017 1.00 62.36 1BNA 586 HETATM 529 O HOH 57 18.456 28.409 8.821 1.00 59.63 1BNA 587 HETATM 530 O HOH 58 7.133 14.448 4.647 1.00 57.15 1BNA 588 HETATM 531 O HOH 59 22.610 15.544 3.846 1.00 57.52 1BNA 589 HETATM 532 O HOH 60 24.407 13.162 2.229 1.00 52.30 1BNA 590 HETATM 533 O HOH 61 7.988 11.556 -2.976 1.00 59.14 1BNA 591 HETATM 534 O HOH 62 14.095 28.151 21.614 1.00 53.85 1BNA 592 HETATM 535 O HOH 63 14.213 27.722 18.905 1.00 57.29 1BNA 593 HETATM 536 O HOH 64 27.164 31.710 20.331 1.00 56.84 1BNA 594 HETATM 537 O HOH 65 15.295 11.873 12.209 1.00 57.34 1BNA 595 HETATM 538 O HOH 66 18.180 16.604 9.966 1.00 61.52 1BNA 596 HETATM 539 O HOH 67 6.216 17.035 1.672 1.00 62.91 1BNA 597 HETATM 540 O HOH 68 19.101 11.433 1.080 1.00 59.79 1BNA 598 HETATM 541 O HOH 69 12.607 10.967 .261 1.00 60.87 1BNA 599 HETATM 542 O HOH 70 7.055 25.519 -2.053 1.00 55.96 1BNA 600 HETATM 543 O HOH 71 15.062 26.024 -.766 1.00 56.35 1BNA 601 HETATM 544 O HOH 72 16.380 6.413 -4.784 1.00 59.07 1BNA 602 HETATM 545 O HOH 73 14.059 5.751 -6.198 1.00 56.68 1BNA 603 HETATM 546 O HOH 74 12.416 31.549 23.685 1.00 68.40 1BNA 604 HETATM 547 O HOH 75 9.613 17.039 29.793 1.00 63.48 1BNA 605 HETATM 548 O HOH 76 11.492 29.103 20.090 1.00 67.46 1BNA 606 HETATM 549 O HOH 77 14.220 29.189 20.392 1.00 48.22 1BNA 607 HETATM 550 O HOH 78 6.138 19.149 13.844 1.00 62.26 1BNA 608 HETATM 551 O HOH 79 17.315 9.638 13.392 1.00 65.70 1BNA 609 HETATM 552 O HOH 80 18.951 25.757 12.989 1.00 66.47 1BNA 610 HETATM 553 O HOH 81 20.460 18.861 12.664 1.00 63.00 1BNA 611 HETATM 554 O HOH 82 3.529 19.338 12.599 1.00 65.32 1BNA 612 HETATM 555 O HOH 83 25.276 15.890 -1.301 1.00 64.53 1BNA 613 HETATM 556 O HOH 84 3.788 7.844 -9.406 1.00 63.59 1BNA 614 HETATM 557 O HOH 85 12.989 29.901 -9.282 1.00 64.97 1BNA 615 HETATM 558 O HOH 86 17.510 30.569 18.702 1.00 61.79 1BNA 616 HETATM 559 O HOH 87 25.377 12.891 19.011 1.00 73.80 1BNA 617 HETATM 560 O HOH 88 13.610 15.742 18.593 1.00 69.48 1BNA 618 HETATM 561 O HOH 89 18.012 32.598 15.262 1.00 67.52 1BNA 619 HETATM 562 O HOH 90 2.622 23.030 10.332 1.00 68.01 1BNA 620 HETATM 563 O HOH 91 19.701 22.518 9.511 1.00 70.25 1BNA 621 HETATM 564 O HOH 92 8.723 13.216 6.359 1.00 70.66 1BNA 622 HETATM 565 O HOH 93 19.727 29.488 6.155 1.00 69.43 1BNA 623 HETATM 566 O HOH 94 17.241 11.563 4.511 1.00 72.18 1BNA 624 HETATM 567 O HOH 95 26.545 19.404 -1.091 1.00 70.14 1BNA 625 HETATM 568 O HOH 96 9.697 18.315 14.885 1.00 69.10 1BNA 626 HETATM 569 O HOH 97 18.779 13.814 11.704 1.00 71.14 1BNA 627 HETATM 570 O HOH 98 14.292 25.159 2.287 1.00 68.44 1BNA 628 HETATM 571 O HOH 99 12.227 25.192 -10.299 1.00 70.46 1BNA 629 HETATM 572 O HOH 100 12.292 30.291 27.102 1.00 73.04 1BNA 630 HETATM 573 O HOH 101 9.396 27.092 16.993 1.00 72.98 1BNA 631 HETATM 574 O HOH 102 20.170 23.000 12.999 1.00 73.63 1BNA 632 HETATM 575 O HOH 103 19.987 21.691 6.802 1.00 72.66 1BNA 633 HETATM 576 O HOH 104 18.692 31.584 4.596 1.00 72.98 1BNA 634 CONECT 15 14 493 1BNA 635 CONECT 16 14 17 491 1BNA 636 CONECT 18 17 490 1BNA 637 CONECT 37 36 471 1BNA 638 CONECT 38 36 39 469 1BNA 639 CONECT 40 39 468 1BNA 640 CONECT 56 55 452 1BNA 641 CONECT 57 55 58 450 1BNA 642 CONECT 59 58 449 1BNA 643 CONECT 78 77 430 1BNA 644 CONECT 79 77 80 428 1BNA 645 CONECT 81 80 427 1BNA 646 CONECT 100 99 410 1BNA 647 CONECT 101 99 102 408 1BNA 648 CONECT 121 120 390 1BNA 649 CONECT 122 120 123 388 1BNA 650 CONECT 140 138 141 370 1BNA 651 CONECT 142 141 369 1BNA 652 CONECT 160 158 161 349 1BNA 653 CONECT 162 161 348 1BNA 654 CONECT 179 178 329 1BNA 655 CONECT 180 178 181 327 1BNA 656 CONECT 182 181 326 1BNA 657 CONECT 201 200 307 1BNA 658 CONECT 202 200 203 305 1BNA 659 CONECT 204 203 304 1BNA 660 CONECT 220 219 288 1BNA 661 CONECT 221 219 222 286 1BNA 662 CONECT 223 222 285 1BNA 663 CONECT 242 241 266 1BNA 664 CONECT 243 241 244 264 1BNA 665 CONECT 245 244 263 1BNA 666 CONECT 263 262 245 1BNA 667 CONECT 264 262 265 243 1BNA 668 CONECT 266 265 242 1BNA 669 CONECT 285 284 223 1BNA 670 CONECT 286 284 287 221 1BNA 671 CONECT 288 287 220 1BNA 672 CONECT 304 303 204 1BNA 673 CONECT 305 303 306 202 1BNA 674 CONECT 307 306 201 1BNA 675 CONECT 326 325 182 1BNA 676 CONECT 327 325 328 180 1BNA 677 CONECT 329 328 179 1BNA 678 CONECT 348 347 162 1BNA 679 CONECT 349 347 350 160 1BNA 680 CONECT 369 368 142 1BNA 681 CONECT 370 368 371 140 1BNA 682 CONECT 388 386 389 122 1BNA 683 CONECT 390 389 121 1BNA 684 CONECT 408 406 409 101 1BNA 685 CONECT 410 409 100 1BNA 686 CONECT 427 426 81 1BNA 687 CONECT 428 426 429 79 1BNA 688 CONECT 430 429 78 1BNA 689 CONECT 449 448 59 1BNA 690 CONECT 450 448 451 57 1BNA 691 CONECT 452 451 56 1BNA 692 CONECT 468 467 40 1BNA 693 CONECT 469 467 470 38 1BNA 694 CONECT 471 470 37 1BNA 695 CONECT 490 489 18 1BNA 696 CONECT 491 489 492 16 1BNA 697 CONECT 493 492 15 1BNA 698 MASTER 64 0 0 0 0 0 0 6 566 2 64 2 1BNAE 9 END 1BNA 700