REMARK GENERATED USING QUANTA FOR NACCESS REMARK AUTHOR SIMON HUBBARD ATOM 1 N ALA S 1 0.000 0.000 0.000 1.00 0.00 N ATOM 2 CA ALA S 1 1.409 0.000 0.419 1.00 0.00 C ATOM 3 C ALA S 1 1.944 1.409 0.578 1.00 0.00 C ATOM 4 O ALA S 1 1.734 2.291 -0.246 1.00 0.00 O ATOM 5 CB ALA S 1 2.226 -0.742 -0.641 1.00 0.00 C ATOM 6 N PHE S 2 2.658 1.594 1.690 1.00 0.00 N ATOM 7 CA PHE S 2 3.212 2.924 1.925 1.00 0.00 C ATOM 8 C PHE S 2 4.615 2.883 2.495 1.00 0.00 C ATOM 9 O PHE S 2 4.935 2.131 3.408 1.00 0.00 O ATOM 10 CB PHE S 2 2.283 3.651 2.899 1.00 0.00 C ATOM 11 CG PHE S 2 2.821 5.035 3.170 1.00 0.00 C ATOM 12 CZ PHE S 2 3.812 7.584 3.668 1.00 0.00 C ATOM 19 CD2 PHE S 2 2.432 6.101 2.367 1.00 0.00 1 C ATOM 20 CE2 PHE S 2 2.927 7.376 2.617 1.00 0.00 1 C ATOM 21 CD1 PHE S 2 3.706 5.244 4.222 1.00 0.00 2 C ATOM 22 CE1 PHE S 2 4.201 6.518 4.471 1.00 0.00 2 C ATOM 13 N ALA S 3 5.461 3.736 1.913 1.00 0.00 N ATOM 14 CA ALA S 3 6.837 3.764 2.400 1.00 0.00 C ATOM 15 C ALA S 3 7.403 5.167 2.481 1.00 0.00 C ATOM 16 O ALA S 3 8.215 5.522 1.628 1.00 0.00 O ATOM 17 CB ALA S 3 7.686 2.922 1.446 1.00 0.00 C ATOM 18 OXT ALA S 3 7.030 5.898 3.397 1.00 0.00 O1- END