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 1.470 0.000 0.000 1.00 0.00 C ATOM 3 C ALA S 1 2.028 1.409 0.000 1.00 0.00 C ATOM 4 O ALA S 1 1.592 2.291 -0.730 1.00 0.00 O ATOM 5 CB ALA S 1 1.951 -0.742 -1.248 1.00 0.00 C ATOM 6 HT1 ALA S 1 -0.347 -0.981 0.000 1.00 0.00 H ATOM 7 HT2 ALA S 1 -0.347 0.490 0.849 1.00 0.00 H ATOM 8 HT3 ALA S 1 -0.347 0.490 -0.849 1.00 0.00 H ATOM 9 N GLN S 2 3.029 1.594 0.863 1.00 0.00 N ATOM 10 CA GLN S 2 3.628 2.924 0.930 1.00 0.00 C ATOM 11 C GLN S 2 5.135 2.883 1.077 1.00 0.00 C ATOM 12 O GLN S 2 5.701 2.131 1.861 1.00 0.00 O ATOM 13 CB GLN S 2 3.015 3.651 2.128 1.00 0.00 C ATOM 14 CG GLN S 2 3.569 5.066 2.301 1.00 0.00 C ATOM 15 CD GLN S 2 2.918 5.720 3.503 1.00 0.00 C ATOM 16 NE2 GLN S 2 2.031 4.942 4.128 1.00 0.00 N ATOM 17 OE1 GLN S 2 3.188 6.860 3.861 1.00 0.00 O ATOM 18 H GLN S 2 3.363 0.853 1.446 1.00 0.00 H ATOM 19 HE2 GLN S 2 1.841 4.016 3.802 1.00 0.00 H ATOM 20 HE2 GLN S 2 1.540 5.270 4.935 1.00 0.00 H ATOM 21 N ALA S 3 5.780 3.736 0.278 1.00 0.00 N ATOM 22 CA ALA S 3 7.237 3.764 0.353 1.00 0.00 C ATOM 23 C ALA S 3 7.803 5.167 0.269 1.00 0.00 C ATOM 24 O ALA S 3 8.338 5.522 -0.779 1.00 0.00 O ATOM 25 CB ALA S 3 7.779 2.922 -0.804 1.00 0.00 C ATOM 26 OXT ALA S 3 7.706 5.898 1.254 1.00 0.00 O1- ATOM 27 H ALA S 3 5.288 4.338 -0.352 1.00 0.00 H END