/usr/share/autodock/Tests/1pgp_flex.pdbqt is in autodock-test 4.2.6-3.
This file is owned by root:root, with mode 0o644.
The actual contents of the file can be viewed below.
1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 | BEGIN_RES ASN 1 187
REMARK 2 active torsions:
REMARK status: ('A' for Active; 'I' for Inactive)
REMARK 1 A between atoms: CA and CB
REMARK 2 A between atoms: CB and CG
REMARK I between atoms: CG and ND2
ROOT
ATOM 1 CA ASN 1 187 23.401 31.717 33.495 1.00 20.32 0.185 C
ENDROOT
BRANCH 1 2
ATOM 2 CB ASN 1 187 24.025 30.451 34.015 1.00 20.54 0.137 C
BRANCH 2 3
ATOM 3 CG ASN 1 187 23.223 29.842 35.141 1.00 25.69 0.217 C
ATOM 4 ND2 ASN 1 187 23.889 29.169 36.039 1.00 34.37 -0.370 N
ATOM 5 1HD2 ASN 1 187 23.402 28.747 36.804 1.00 0.00 0.159 HD
ATOM 6 2HD2 ASN 1 187 24.882 29.080 35.956 1.00 0.00 0.159 HD
ATOM 7 OD1 ASN 1 187 22.014 29.997 35.265 1.00 28.79 -0.274 OA
ENDBRANCH 2 3
ENDBRANCH 1 2
END_RES ASN 1 187
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