REMARK Name = BDB053138 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 CA THR A 2 1.499 2.858 -0.694 0.00 0.00 +0.187 C ENDROOT BRANCH 1 4 ATOM 2 N ALA A 3 -0.474 1.390 -0.448 0.00 0.00 -0.303 N ATOM 3 H ALA A 3 0.154 0.819 0.119 0.00 0.00 +0.149 HD ATOM 4 C THR A 2 -0.032 2.645 -0.800 0.00 0.00 +0.236 C ATOM 5 O THR A 2 -0.809 3.559 -1.077 0.00 0.00 -0.274 OA BRANCH 2 6 ATOM 6 CA ALA A 3 -1.890 1.060 -0.344 0.00 0.00 +0.156 C ATOM 7 CB ALA A 3 -2.531 0.914 -1.721 0.00 0.00 +0.038 C BRANCH 6 10 ATOM 8 N VAL A 4 -3.290 -0.545 0.893 0.00 0.00 -0.301 N ATOM 9 H VAL A 4 -4.054 -0.076 0.421 0.00 0.00 +0.150 HD ATOM 10 C ALA A 3 -2.017 -0.260 0.443 0.00 0.00 +0.234 C ATOM 11 O ALA A 3 -1.054 -1.000 0.642 0.00 0.00 -0.274 OA BRANCH 8 12 ATOM 12 CA VAL A 4 -3.602 -1.862 1.465 0.00 0.00 +0.184 C BRANCH 12 14 ATOM 13 CG1 VAL A 4 -4.822 -3.027 3.370 0.00 0.00 +0.009 C ATOM 14 CB VAL A 4 -4.704 -1.745 2.541 0.00 0.00 +0.014 C ATOM 15 CG2 VAL A 4 -6.077 -1.361 1.980 0.00 0.00 +0.009 C ENDBRANCH 12 14 BRANCH 12 16 ATOM 16 C VAL A 4 -3.985 -2.785 0.304 0.00 0.00 +0.326 C ATOM 17 O VAL A 4 -4.474 -2.435 -0.761 0.00 0.00 -0.249 OA BRANCH 16 18 ATOM 18 OXT VAL A 4 -3.756 -4.089 0.555 0.00 0.00 -0.479 OA ATOM 19 HXT VAL A 4 -4.023 -4.547 -0.270 0.00 0.00 +0.295 HD ENDBRANCH 16 18 ENDBRANCH 12 16 ENDBRANCH 8 12 ENDBRANCH 6 10 ENDBRANCH 2 6 ENDBRANCH 1 4 BRANCH 1 20 ATOM 20 N THR A 2 2.253 1.653 -1.067 0.00 0.00 -0.301 N ATOM 21 H THR A 2 2.186 1.342 -2.029 0.00 0.00 +0.150 HD ATOM 22 C GLN A 1 2.573 0.684 -0.133 0.00 0.00 +0.231 C ATOM 23 O GLN A 1 2.240 0.782 1.043 0.00 0.00 -0.274 OA BRANCH 22 24 ATOM 24 CA GLN A 1 3.287 -0.549 -0.735 0.00 0.00 +0.138 C BRANCH 24 25 ATOM 25 N GLN A 1 4.435 -0.137 -1.563 0.00 0.00 -0.320 NA ATOM 26 H1 GLN A 1 4.191 0.675 -2.126 0.00 0.00 +0.119 HD ATOM 27 H2 GLN A 1 5.195 0.204 -0.959 0.00 0.00 +0.119 HD ENDBRANCH 24 25 BRANCH 24 28 ATOM 28 CB GLN A 1 3.653 -1.610 0.319 0.00 0.00 +0.037 C BRANCH 28 29 ATOM 29 CG GLN A 1 4.666 -1.189 1.386 0.00 0.00 +0.097 C BRANCH 29 30 ATOM 30 CD GLN A 1 6.078 -1.133 0.858 0.00 0.00 +0.211 C ATOM 31 OE1 GLN A 1 6.600 -0.094 0.466 0.00 0.00 -0.276 OA ATOM 32 NE2 GLN A 1 6.734 -2.324 0.802 0.00 0.00 -0.329 N ATOM 33 HE21 GLN A 1 7.641 -2.324 0.353 0.00 0.00 +0.145 HD ATOM 34 HE22 GLN A 1 6.248 -3.206 0.886 0.00 0.00 +0.145 HD ENDBRANCH 29 30 ENDBRANCH 28 29 ENDBRANCH 24 28 ENDBRANCH 22 24 ENDBRANCH 1 20 BRANCH 1 35 ATOM 35 CB THR A 2 1.956 4.094 -1.506 0.00 0.00 +0.141 C ATOM 36 CG2 THR A 2 1.699 3.999 -3.008 0.00 0.00 +0.040 C BRANCH 35 37 ATOM 37 OG1 THR A 2 1.360 5.297 -1.013 0.00 0.00 -0.390 OA ATOM 38 HG1 THR A 2 0.388 5.188 -1.088 0.00 0.00 +0.210 HD ENDBRANCH 35 37 ENDBRANCH 1 35 TORSDOF 15