REMARK
REMARK This file was generated by PRODRG version AA100323.0717
REMARK PRODRG written/copyrighted by Daan van Aalten
REMARK and Alexander Schuettelkopf
REMARK
REMARK Questions/comments to dava@davapc1.bioch.dundee.ac.uk
REMARK
REMARK When using this software in a publication, cite:
REMARK A. W. Schuettelkopf and D. M. F. van Aalten (2004).
REMARK PRODRG - a tool for high-throughput crystallography
REMARK of protein-ligand complexes.
REMARK Acta Crystallogr. D60, 1355--1363.
REMARK
REMARK
HETATM 1 CAA DRG 1 6.600 3.140 -0.480 1.00 20.00 C
HETATM 2 CAT DRG 1 7.660 3.760 0.430 1.00 20.00 C
HETATM 3 CAU DRG 1 8.610 4.620 -0.410 1.00 20.00 C
HETATM 4 CAV DRG 1 9.670 5.240 0.500 1.00 20.00 C
HETATM 5 CAW DRG 1 10.610 6.110 -0.340 1.00 20.00 C
HETATM 6 CAX DRG 1 11.680 6.720 0.570 1.00 20.00 C
HETATM 7 CAY DRG 1 12.620 7.580 -0.270 1.00 20.00 C
HETATM 8 CAZ DRG 1 13.700 8.190 0.630 1.00 20.00 C
HETATM 9 CBA DRG 1 14.650 9.030 -0.220 1.00 20.00 C
HETATM 10 CBB DRG 1 15.740 9.630 0.670 1.00 20.00 C
HETATM 11 CBC DRG 1 16.700 10.440 -0.200 1.00 20.00 C
HETATM 12 CBD DRG 1 17.810 11.030 0.680 1.00 20.00 C
HETATM 13 CBE DRG 1 18.780 11.800 -0.210 1.00 20.00 C
HETATM 14 CBF DRG 1 19.910 12.390 0.650 1.00 20.00 C
HETATM 15 CBG DRG 1 20.890 13.120 -0.270 1.00 20.00 C
HETATM 16 CBH DRG 1 22.030 13.710 0.560 1.00 20.00 C
HETATM 17 CBI DRG 1 23.000 14.420 -0.380 1.00 20.00 C
HETATM 18 CBJ DRG 1 24.150 15.050 0.420 1.00 20.00 C
HETATM 19 CBN DRG 1 25.110 15.790 -0.520 1.00 20.00 C
HETATM 20 OAC DRG 1 24.710 16.400 -1.510 1.00 20.00 O
HETATM 21 CBV DRG 1 26.460 15.780 -0.170 1.00 20.00 C
HETATM 22 CAS DRG 1 27.040 16.960 0.330 1.00 20.00 C
HETATM 23 HAS DRG 1 26.430 17.850 0.500 1.00 20.00 H
HETATM 24 CAQ DRG 1 28.420 16.990 0.610 1.00 20.00 C
HETATM 25 HAQ DRG 1 28.860 17.890 1.050 1.00 20.00 H
HETATM 26 CAR DRG 1 27.240 14.610 -0.380 1.00 20.00 C
HETATM 27 HAR DRG 1 26.790 13.700 -0.750 1.00 20.00 H
HETATM 28 CAP DRG 1 28.620 14.650 -0.100 1.00 20.00 C
HETATM 29 HAP DRG 1 29.230 13.750 -0.250 1.00 20.00 H
HETATM 30 CBU DRG 1 29.220 15.840 0.390 1.00 20.00 C
HETATM 31 NBM DRG 1 30.570 15.810 0.460 1.00 20.00 N
HETATM 32 HBW DRG 1 30.990 14.910 0.570 1.00 20.00 H
HETATM 33 CBT DRG 1 31.400 16.870 0.420 1.00 20.00 C
HETATM 34 CAO DRG 1 31.270 17.900 -0.560 1.00 20.00 C
HETATM 35 HAO DRG 1 30.350 18.000 -1.130 1.00 20.00 H
HETATM 36 CAM DRG 1 32.350 18.750 -0.840 1.00 20.00 C
HETATM 37 HAM DRG 1 32.270 19.480 -1.650 1.00 20.00 H
HETATM 38 CAN DRG 1 32.640 16.690 1.070 1.00 20.00 C
HETATM 39 HAN DRG 1 32.770 15.890 1.800 1.00 20.00 H
HETATM 40 CAL DRG 1 33.720 17.560 0.800 1.00 20.00 C
HETATM 41 HAL DRG 1 34.680 17.400 1.300 1.00 20.00 H
HETATM 42 CBS DRG 1 33.580 18.600 -0.140 1.00 20.00 C
HETATM 43 NBL DRG 1 34.580 19.520 -0.120 1.00 20.00 N
HETATM 44 HBV DRG 1 35.460 19.180 0.220 1.00 20.00 H
HETATM 45 CBR DRG 1 34.540 20.810 -0.490 1.00 20.00 C
HETATM 46 CAK DRG 1 33.440 21.680 -0.250 1.00 20.00 C
HETATM 47 HAK DRG 1 32.470 21.280 0.020 1.00 20.00 H
HETATM 48 CAI DRG 1 33.610 23.080 -0.270 1.00 20.00 C
HETATM 49 HAI DRG 1 32.730 23.710 -0.260 1.00 20.00 H
HETATM 50 CAJ DRG 1 35.820 21.380 -0.720 1.00 20.00 C
HETATM 51 HAJ DRG 1 36.680 20.730 -0.910 1.00 20.00 H
HETATM 52 CAH DRG 1 36.000 22.780 -0.710 1.00 20.00 C
HETATM 53 HAH DRG 1 36.990 23.190 -0.890 1.00 20.00 H
HETATM 54 CBQ DRG 1 34.900 23.640 -0.490 1.00 20.00 C
HETATM 55 NBK DRG 1 35.230 24.950 -0.480 1.00 20.00 N
HETATM 56 HBU DRG 1 36.130 25.150 -0.850 1.00 20.00 H
HETATM 57 CBP DRG 1 34.550 26.040 -0.050 1.00 20.00 C
HETATM 58 CAF DRG 1 34.990 27.240 -0.650 1.00 20.00 C
HETATM 59 HAF DRG 1 35.880 27.250 -1.280 1.00 20.00 H
HETATM 60 CAD DRG 1 34.290 28.440 -0.440 1.00 20.00 C
HETATM 61 HAD DRG 1 34.630 29.370 -0.910 1.00 20.00 H
HETATM 62 CBO DRG 1 33.140 28.430 0.380 1.00 20.00 C
HETATM 63 NAB DRG 1 32.450 29.560 0.550 1.00 20.00 N
HETATM 64 HBY DRG 1 31.630 29.560 1.130 1.00 20.00 H
HETATM 65 HBX DRG 1 32.740 30.400 0.100 1.00 20.00 H
HETATM 66 CAE DRG 1 32.700 27.250 1.010 1.00 20.00 C
HETATM 67 HAE DRG 1 31.810 27.260 1.640 1.00 20.00 H
HETATM 68 CAG DRG 1 33.410 26.060 0.800 1.00 20.00 C
HETATM 69 HAG DRG 1 33.160 25.180 1.400 1.00 20.00 H
CONECT 1 2
CONECT 2 1 3
CONECT 3 2 4
CONECT 4 3 5
CONECT 5 4 6
CONECT 6 5 7
CONECT 7 6 8
CONECT 8 7 9
CONECT 9 8 10
CONECT 10 9 11
CONECT 11 10 12
CONECT 12 11 13
CONECT 13 12 14
CONECT 14 13 15
CONECT 15 14 16
CONECT 16 15 17
CONECT 17 16 18
CONECT 18 17 19
CONECT 19 18 20 21
CONECT 20 19
CONECT 21 19 22 26
CONECT 22 21 23 24
CONECT 23 22
CONECT 24 22 25 30
CONECT 25 24
CONECT 26 21 27 28
CONECT 27 26
CONECT 28 26 29 30
CONECT 29 28
CONECT 30 24 28 31
CONECT 31 30 32 33
CONECT 32 31
CONECT 33 31 34 38
CONECT 34 33 35 36
CONECT 35 34
CONECT 36 34 37 42
CONECT 37 36
CONECT 38 33 39 40
CONECT 39 38
CONECT 40 38 41 42
CONECT 41 40
CONECT 42 36 40 43
CONECT 43 42 44 45
CONECT 44 43
CONECT 45 43 46 50
CONECT 46 45 47 48
CONECT 47 46
CONECT 48 46 49 54
CONECT 49 48
CONECT 50 45 51 52
CONECT 51 50
CONECT 52 50 53 54
CONECT 53 52
CONECT 54 48 52 55
CONECT 55 54 56 57
CONECT 56 55
CONECT 57 55 58 68
CONECT 58 57 59 60
CONECT 59 58
CONECT 60 58 61 62
CONECT 61 60
CONECT 62 60 63 66
CONECT 63 62 64 65
CONECT 64 63
CONECT 65 63
CONECT 66 62 67 68
CONECT 67 66
CONECT 68 57 66 69
CONECT 69 68
END
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