COMPND 2BL (3S, 4R)-1-TOLUENESULPHONYL-3-ETHYL-AZETIDIN-2-ONE-4- CARBOXYLIC ACID
REMARK 2BL Part of HIC-Up: http://xray.bmc.uu.se/hicup
REMARK 2BL Extracted from PDB file pdb1btu.ent
REMARK 2BL Formula C13 H15 N O5 S
REMARK 2BL Nr of non-hydrogen atoms  20
REMARK 2BL Eigen-values covariance X/Y/Z      167.0      31.2      23.1
REMARK 2BL Residue type 2BL
REMARK 2BL Residue name    464
REMARK 2BL Original residue name (for O) $7
REMARK 2BL  RESOLUTION. 1.60 ANGSTROMS.
REMARK 2BL occurs in        0 other PDB entries
REMARK 2BL
HETATM    1  C   2BL   464      -0.854  -0.718   1.867  1.00 20.00           C+0
HETATM    2  CA  2BL   464       0.399  -0.697   2.717  1.00 20.00           C+0
HETATM    3  CB  2BL   464       0.851   0.499   1.864  1.00 20.00           C+0
HETATM    4  CC  2BL   464       2.071   0.219   1.026  1.00 20.00           C+0
HETATM    5  CD  2BL   464       0.142  -0.344   4.184  1.00 20.00           C+0
HETATM    6  CE  2BL   464      -0.342  -1.588   4.930  1.00 20.00           C+0
HETATM    7  CF  2BL   464      -0.552   0.384  -1.616  1.00 20.00           C+0
HETATM    8  CG1 2BL   464      -1.300  -0.642  -2.162  1.00 20.00           C+0
HETATM    9  CG2 2BL   464       0.612   0.796  -2.236  1.00 20.00           C+0
HETATM   10  CH1 2BL   464      -0.880  -1.260  -3.325  1.00 20.00           C+0
HETATM   11  CH2 2BL   464       1.034   0.175  -3.397  1.00 20.00           C+0
HETATM   12  CI  2BL   464       0.286  -0.851  -3.942  1.00 20.00           C+0
HETATM   13  CJ  2BL   464       0.744  -1.525  -5.210  1.00 20.00           C+0
HETATM   14  O   2BL   464      -1.852  -1.407   1.847  1.00 20.00           O+0
HETATM   15  OA  2BL   464       1.947  -0.220  -0.092  1.00 20.00           O+0
HETATM   16  OB  2BL   464       3.295   0.457   1.522  1.00 20.00           O+0
HETATM   17  OC  2BL   464      -2.486   0.937  -0.055  1.00 20.00           O+0
HETATM   18  OD  2BL   464      -0.466   2.450  -0.130  1.00 20.00           O+0
HETATM   19  S   2BL   464      -1.087   1.172  -0.133  1.00 20.00           S+0
HETATM   20  N   2BL   464      -0.420   0.343   1.135  1.00 20.00           N+0
REMARK 2BL ENDHET