REMARK Name = BDB061752 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 C MET A 12 -4.309 -5.555 -2.564 0.00 0.00 +0.234 C ATOM 2 N GLY A 13 -4.772 -6.374 -1.580 0.00 0.00 -0.305 N ATOM 3 H GLY A 13 -4.011 -6.964 -1.223 0.00 0.00 +0.149 HD ATOM 4 O MET A 12 -3.081 -5.572 -2.749 0.00 0.00 -0.274 OA ENDROOT BRANCH 2 5 ATOM 5 CA GLY A 13 -6.009 -6.341 -0.816 0.00 0.00 +0.200 C BRANCH 5 6 ATOM 6 C GLY A 13 -5.883 -5.470 0.431 0.00 0.00 +0.231 C ATOM 7 N LEU A 14 -5.272 -6.078 1.516 0.00 0.00 -0.303 N ATOM 8 H LEU A 14 -4.703 -6.891 1.310 0.00 0.00 +0.149 HD ATOM 9 O GLY A 13 -6.196 -4.278 0.433 0.00 0.00 -0.274 OA BRANCH 7 10 ATOM 10 CA LEU A 14 -4.819 -5.242 2.634 0.00 0.00 +0.159 C BRANCH 10 11 ATOM 11 C LEU A 14 -3.617 -4.488 2.039 0.00 0.00 +0.234 C ATOM 12 N ASP A 15 -3.926 -3.198 1.614 0.00 0.00 -0.302 N ATOM 13 H ASP A 15 -4.938 -3.065 1.549 0.00 0.00 +0.150 HD ATOM 14 O LEU A 14 -2.556 -5.051 1.779 0.00 0.00 -0.274 OA BRANCH 12 15 ATOM 15 CA ASP A 15 -3.202 -2.671 0.460 0.00 0.00 +0.169 C BRANCH 15 16 ATOM 16 C ASP A 15 -1.693 -2.620 0.750 0.00 0.00 +0.234 C ATOM 17 N ARG A 16 -0.959 -3.419 -0.116 0.00 0.00 -0.302 N ATOM 18 H ARG A 16 -1.488 -4.208 -0.468 0.00 0.00 +0.150 HD ATOM 19 O ASP A 15 -1.192 -1.947 1.644 0.00 0.00 -0.274 OA BRANCH 17 20 ATOM 20 CA ARG A 16 0.437 -3.745 0.221 0.00 0.00 +0.159 C BRANCH 20 21 ATOM 21 C ARG A 16 1.384 -2.544 -0.011 0.00 0.00 +0.234 C ATOM 22 N TRP A 17 0.874 -1.628 -0.907 0.00 0.00 -0.302 N ATOM 23 H TRP A 17 -0.108 -1.740 -1.118 0.00 0.00 +0.150 HD ATOM 24 O ARG A 16 2.519 -2.490 0.463 0.00 0.00 -0.274 OA BRANCH 22 25 ATOM 25 CA TRP A 17 1.417 -0.282 -1.079 0.00 0.00 +0.163 C BRANCH 25 26 ATOM 26 C TRP A 17 0.453 0.661 -0.319 0.00 0.00 +0.234 C ATOM 27 N LYS A 18 0.997 1.818 0.181 0.00 0.00 -0.302 N ATOM 28 H LYS A 18 2.008 1.955 0.079 0.00 0.00 +0.150 HD ATOM 29 O TRP A 17 -0.763 0.441 -0.261 0.00 0.00 -0.274 OA BRANCH 27 30 ATOM 30 CA LYS A 18 0.199 2.896 0.762 0.00 0.00 +0.159 C BRANCH 30 31 ATOM 31 C LYS A 18 -0.437 2.407 2.104 0.00 0.00 +0.234 C ATOM 32 N GLU A 19 -1.686 2.904 2.422 0.00 0.00 -0.302 N ATOM 33 H GLU A 19 -2.102 3.644 1.872 0.00 0.00 +0.150 HD ATOM 34 O LYS A 18 0.162 1.661 2.878 0.00 0.00 -0.274 OA BRANCH 32 35 ATOM 35 CA GLU A 19 -2.305 2.674 3.733 0.00 0.00 +0.159 C BRANCH 35 36 ATOM 36 C GLU A 19 -3.827 2.860 3.518 0.00 0.00 +0.234 C ATOM 37 N LEU A 20 -4.337 1.958 2.602 0.00 0.00 -0.302 N ATOM 38 H LEU A 20 -3.626 1.476 2.062 0.00 0.00 +0.150 HD ATOM 39 O GLU A 19 -4.493 3.699 4.106 0.00 0.00 -0.274 OA BRANCH 37 40 ATOM 40 CA LEU A 20 -5.670 2.038 1.995 0.00 0.00 +0.159 C BRANCH 40 41 ATOM 41 C LEU A 20 -5.629 3.066 0.824 0.00 0.00 +0.237 C ATOM 42 N PRO A 21 -6.459 2.844 -0.264 0.00 0.00 -0.288 N ATOM 43 CA PRO A 21 -6.329 3.660 -1.478 0.00 0.00 +0.162 C ATOM 44 CB PRO A 21 -6.709 2.689 -2.600 0.00 0.00 +0.033 C ATOM 45 CG PRO A 21 -7.757 1.799 -1.944 0.00 0.00 +0.021 C ATOM 46 CD PRO A 21 -7.218 1.630 -0.533 0.00 0.00 +0.109 C ATOM 47 O LEU A 20 -4.833 4.005 0.810 0.00 0.00 -0.274 OA BRANCH 43 48 ATOM 48 C PRO A 21 -7.276 4.883 -1.538 0.00 0.00 +0.234 C ATOM 49 N GLU A 22 -6.785 5.931 -2.298 0.00 0.00 -0.302 N ATOM 50 H GLU A 22 -5.782 6.102 -2.209 0.00 0.00 +0.150 HD ATOM 51 O PRO A 21 -8.412 4.873 -1.070 0.00 0.00 -0.274 OA BRANCH 49 52 ATOM 52 CA GLU A 22 -7.602 7.065 -2.759 0.00 0.00 +0.159 C BRANCH 52 53 ATOM 53 C GLU A 22 -7.969 8.077 -1.651 0.00 0.00 +0.234 C ATOM 54 N LEU A 23 -6.899 8.839 -1.192 0.00 0.00 -0.301 N ATOM 55 H LEU A 23 -6.007 8.348 -1.219 0.00 0.00 +0.150 HD ATOM 56 O GLU A 22 -9.117 8.307 -1.287 0.00 0.00 -0.274 OA BRANCH 54 57 ATOM 57 CA LEU A 23 -7.134 9.759 -0.054 0.00 0.00 +0.182 C BRANCH 57 58 ATOM 58 C LEU A 23 -7.936 11.010 -0.493 0.00 0.00 +0.325 C ATOM 59 O LEU A 23 -8.439 11.810 0.283 0.00 0.00 -0.249 OA BRANCH 58 60 ATOM 60 OXT LEU A 23 -7.917 11.223 -1.833 0.00 0.00 -0.479 OA ATOM 61 HXT LEU A 23 -7.470 10.470 -2.275 0.00 0.00 +0.295 HD ENDBRANCH 58 60 ENDBRANCH 57 58 BRANCH 57 62 ATOM 62 CB LEU A 23 -5.782 10.220 0.517 0.00 0.00 +0.036 C BRANCH 62 63 ATOM 63 CG LEU A 23 -5.839 10.963 1.869 0.00 0.00 -0.015 C ATOM 64 CD2 LEU A 23 -4.415 11.259 2.354 0.00 0.00 +0.007 C ATOM 65 CD1 LEU A 23 -6.593 10.176 2.941 0.00 0.00 +0.007 C ENDBRANCH 62 63 ENDBRANCH 57 62 ENDBRANCH 54 57 ENDBRANCH 52 53 BRANCH 52 66 ATOM 66 CB GLU A 22 -8.860 6.666 -3.555 0.00 0.00 +0.043 C BRANCH 66 67 ATOM 67 CG GLU A 22 -8.596 5.845 -4.819 0.00 0.00 +0.123 C BRANCH 67 68 ATOM 68 CD GLU A 22 -7.864 6.616 -5.894 0.00 0.00 +0.305 C ATOM 69 OE1 GLU A 22 -7.331 7.701 -5.747 0.00 0.00 -0.251 OA BRANCH 68 70 ATOM 70 OE2 GLU A 22 -7.822 5.943 -7.068 0.00 0.00 -0.481 OA ATOM 71 HE2 GLU A 22 -8.334 5.115 -7.065 0.00 0.00 +0.295 HD ENDBRANCH 68 70 ENDBRANCH 67 68 ENDBRANCH 66 67 ENDBRANCH 52 66 ENDBRANCH 49 52 ENDBRANCH 43 48 ENDBRANCH 40 41 BRANCH 40 72 ATOM 72 CB LEU A 20 -6.863 2.286 2.934 0.00 0.00 +0.034 C BRANCH 72 73 ATOM 73 CG LEU A 20 -7.272 1.112 3.853 0.00 0.00 -0.015 C ATOM 74 CD2 LEU A 20 -7.868 -0.058 3.064 0.00 0.00 +0.007 C ATOM 75 CD1 LEU A 20 -6.153 0.613 4.765 0.00 0.00 +0.007 C ENDBRANCH 72 73 ENDBRANCH 40 72 ENDBRANCH 37 40 ENDBRANCH 35 36 BRANCH 35 76 ATOM 76 CB GLU A 19 -1.731 3.628 4.780 0.00 0.00 +0.043 C BRANCH 76 77 ATOM 77 CG GLU A 19 -2.135 3.235 6.197 0.00 0.00 +0.123 C BRANCH 77 78 ATOM 78 CD GLU A 19 -1.439 4.111 7.197 0.00 0.00 +0.305 C ATOM 79 OE1 GLU A 19 -1.859 5.158 7.662 0.00 0.00 -0.251 OA BRANCH 78 80 ATOM 80 OE2 GLU A 19 -0.225 3.644 7.539 0.00 0.00 -0.481 OA ATOM 81 HE2 GLU A 19 0.123 4.324 8.154 0.00 0.00 +0.295 HD ENDBRANCH 78 80 ENDBRANCH 77 78 ENDBRANCH 76 77 ENDBRANCH 35 76 ENDBRANCH 32 35 ENDBRANCH 30 31 BRANCH 30 82 ATOM 82 CB LYS A 18 -0.782 3.459 -0.286 0.00 0.00 +0.032 C BRANCH 82 83 ATOM 83 CG LYS A 18 -1.081 4.958 -0.096 0.00 0.00 +0.003 C BRANCH 83 84 ATOM 84 CD LYS A 18 -2.370 5.359 -0.826 0.00 0.00 +0.015 C BRANCH 84 85 ATOM 85 CE LYS A 18 -3.002 6.619 -0.228 0.00 0.00 +0.077 C BRANCH 85 86 ATOM 86 NZ LYS A 18 -4.458 6.631 -0.449 0.00 0.00 -0.330 NA ATOM 87 HZ1 LYS A 18 -4.783 5.708 -0.108 0.00 0.00 +0.118 HD ATOM 88 HZ2 LYS A 18 -4.851 7.233 0.276 0.00 0.00 +0.118 HD ENDBRANCH 85 86 ENDBRANCH 84 85 ENDBRANCH 83 84 ENDBRANCH 82 83 ENDBRANCH 30 82 ENDBRANCH 27 30 ENDBRANCH 25 26 BRANCH 25 89 ATOM 89 CB TRP A 17 1.374 0.169 -2.554 0.00 0.00 +0.069 C BRANCH 89 90 ATOM 90 CG TRP A 17 2.130 -0.690 -3.521 0.00 0.00 -0.020 A ATOM 91 CD2 TRP A 17 3.152 -0.279 -4.438 0.00 0.00 +0.003 A ATOM 92 CE2 TRP A 17 3.471 -1.374 -5.237 0.00 0.00 +0.047 A ATOM 93 CZ2 TRP A 17 4.408 -1.312 -6.276 0.00 0.00 +0.026 A ATOM 94 CH2 TRP A 17 5.047 -0.092 -6.505 0.00 0.00 +0.002 A ATOM 95 CZ3 TRP A 17 4.754 1.021 -5.720 0.00 0.00 +0.001 A ATOM 96 NE1 TRP A 17 2.692 -2.417 -4.813 0.00 0.00 -0.360 N ATOM 97 HE1 TRP A 17 2.690 -3.343 -5.217 0.00 0.00 +0.165 HD ATOM 98 CE3 TRP A 17 3.818 0.936 -4.688 0.00 0.00 +0.010 A ATOM 99 CD1 TRP A 17 1.910 -2.028 -3.764 0.00 0.00 +0.087 A ENDBRANCH 89 90 ENDBRANCH 25 89 ENDBRANCH 22 25 ENDBRANCH 20 21 BRANCH 20 100 ATOM 100 CB ARG A 16 0.869 -4.933 -0.645 0.00 0.00 +0.033 C BRANCH 100 101 ATOM 101 CG ARG A 16 0.376 -6.260 -0.048 0.00 0.00 +0.023 C BRANCH 101 102 ATOM 102 CD ARG A 16 0.290 -7.384 -1.077 0.00 0.00 +0.115 C BRANCH 102 103 ATOM 103 NE ARG A 16 -1.081 -7.525 -1.536 0.00 0.00 -0.356 N ATOM 104 HE ARG A 16 -1.420 -6.787 -2.148 0.00 0.00 +0.162 HD BRANCH 103 105 ATOM 105 CZ ARG A 16 -1.799 -8.672 -1.532 0.00 0.00 +0.188 C ATOM 106 NH1 ARG A 16 -1.591 -9.752 -0.882 0.00 0.00 -0.269 NA ATOM 107 HH1 ARG A 16 -0.771 -9.645 -0.288 0.00 0.00 +0.190 HD BRANCH 105 108 ATOM 108 NH2 ARG A 16 -2.878 -8.603 -2.337 0.00 0.00 -0.370 N ATOM 109 HH21 ARG A 16 -3.263 -9.538 -2.452 0.00 0.00 +0.159 HD ATOM 110 HH22 ARG A 16 -2.653 -8.207 -3.240 0.00 0.00 +0.159 HD ENDBRANCH 105 108 ENDBRANCH 103 105 ENDBRANCH 102 103 ENDBRANCH 101 102 ENDBRANCH 100 101 ENDBRANCH 20 100 ENDBRANCH 17 20 ENDBRANCH 15 16 BRANCH 15 111 ATOM 111 CB ASP A 15 -3.668 -1.266 0.098 0.00 0.00 +0.152 C BRANCH 111 112 ATOM 112 CG ASP A 15 -3.533 -1.085 -1.389 0.00 0.00 +0.307 C ATOM 113 OD1 ASP A 15 -4.229 -1.676 -2.210 0.00 0.00 -0.251 OA BRANCH 112 114 ATOM 114 OD2 ASP A 15 -2.564 -0.255 -1.791 0.00 0.00 -0.481 OA ATOM 115 HD2 ASP A 15 -1.998 0.132 -1.067 0.00 0.00 +0.295 HD ENDBRANCH 112 114 ENDBRANCH 111 112 ENDBRANCH 15 111 ENDBRANCH 12 15 ENDBRANCH 10 11 BRANCH 10 116 ATOM 116 CB LEU A 14 -4.417 -6.079 3.856 0.00 0.00 +0.034 C BRANCH 116 117 ATOM 117 CG LEU A 14 -3.880 -5.255 5.048 0.00 0.00 -0.015 C ATOM 118 CD2 LEU A 14 -3.550 -6.184 6.218 0.00 0.00 +0.007 C ATOM 119 CD1 LEU A 14 -4.860 -4.176 5.513 0.00 0.00 +0.007 C ENDBRANCH 116 117 ENDBRANCH 10 116 ENDBRANCH 7 10 ENDBRANCH 5 6 ENDBRANCH 2 5 BRANCH 1 120 ATOM 120 CA MET A 12 -5.257 -4.648 -3.405 0.00 0.00 +0.160 C BRANCH 120 122 ATOM 121 C GLU A 11 -3.624 -3.938 -5.195 0.00 0.00 +0.234 C ATOM 122 N MET A 12 -4.373 -3.646 -4.069 0.00 0.00 -0.302 N ATOM 123 H MET A 12 -4.053 -2.913 -3.448 0.00 0.00 +0.150 HD ATOM 124 O GLU A 11 -3.819 -4.950 -5.869 0.00 0.00 -0.274 OA BRANCH 121 125 ATOM 125 CA GLU A 11 -2.378 -3.058 -5.471 0.00 0.00 +0.159 C BRANCH 125 127 ATOM 126 C ILE A 10 -1.666 -0.685 -5.548 0.00 0.00 +0.234 C ATOM 127 N GLU A 11 -2.467 -1.669 -5.000 0.00 0.00 -0.302 N ATOM 128 H GLU A 11 -3.209 -1.404 -4.355 0.00 0.00 +0.150 HD ATOM 129 O ILE A 10 -0.762 -0.939 -6.347 0.00 0.00 -0.274 OA BRANCH 126 130 ATOM 130 CA ILE A 10 -2.021 0.772 -5.161 0.00 0.00 +0.162 C BRANCH 130 131 ATOM 131 N ILE A 10 -0.831 1.639 -5.349 0.00 0.00 -0.302 N ATOM 132 H ILE A 10 -0.007 1.193 -5.742 0.00 0.00 +0.150 HD ATOM 133 C VAL A 9 -0.778 2.925 -4.880 0.00 0.00 +0.234 C ATOM 134 O VAL A 9 -1.645 3.341 -4.099 0.00 0.00 -0.274 OA BRANCH 133 135 ATOM 135 CA VAL A 9 0.443 3.834 -5.214 0.00 0.00 +0.161 C BRANCH 135 136 ATOM 136 N VAL A 9 1.172 3.929 -3.932 0.00 0.00 -0.302 N ATOM 137 H VAL A 9 0.546 4.002 -3.137 0.00 0.00 +0.150 HD ATOM 138 C LEU A 8 2.496 4.215 -3.690 0.00 0.00 +0.234 C ATOM 139 O LEU A 8 3.367 4.308 -4.555 0.00 0.00 -0.274 OA BRANCH 138 140 ATOM 140 CA LEU A 8 2.826 4.458 -2.204 0.00 0.00 +0.159 C BRANCH 140 141 ATOM 141 N LEU A 8 4.163 3.994 -1.868 0.00 0.00 -0.302 N ATOM 142 H LEU A 8 4.928 4.314 -2.466 0.00 0.00 +0.150 HD ATOM 143 C SER A 7 4.360 2.767 -1.267 0.00 0.00 +0.236 C ATOM 144 O SER A 7 3.408 2.043 -0.969 0.00 0.00 -0.274 OA BRANCH 143 145 ATOM 145 CA SER A 7 5.830 2.396 -0.953 0.00 0.00 +0.184 C BRANCH 145 146 ATOM 146 N SER A 7 5.875 1.111 -0.265 0.00 0.00 -0.301 N ATOM 147 H SER A 7 5.863 0.256 -0.808 0.00 0.00 +0.150 HD ATOM 148 C TRP A 6 5.432 0.993 1.036 0.00 0.00 +0.234 C ATOM 149 O TRP A 6 5.108 1.987 1.688 0.00 0.00 -0.274 OA BRANCH 148 150 ATOM 150 CA TRP A 6 5.478 -0.430 1.658 0.00 0.00 +0.163 C BRANCH 150 151 ATOM 151 N TRP A 6 5.161 -1.552 0.740 0.00 0.00 -0.302 N ATOM 152 H TRP A 6 4.230 -1.964 0.806 0.00 0.00 +0.150 HD ATOM 153 C LEU A 5 6.061 -2.058 -0.171 0.00 0.00 +0.234 C ATOM 154 O LEU A 5 6.923 -1.333 -0.671 0.00 0.00 -0.274 OA BRANCH 153 155 ATOM 155 CA LEU A 5 5.869 -3.509 -0.649 0.00 0.00 +0.159 C BRANCH 155 156 ATOM 156 N LEU A 5 5.286 -4.358 0.394 0.00 0.00 -0.302 N ATOM 157 H LEU A 5 4.425 -4.040 0.827 0.00 0.00 +0.150 HD ATOM 158 C VAL A 4 5.985 -5.423 0.902 0.00 0.00 +0.234 C ATOM 159 O VAL A 4 7.106 -5.716 0.472 0.00 0.00 -0.274 OA BRANCH 158 160 ATOM 160 CA VAL A 4 5.394 -6.228 2.089 0.00 0.00 +0.161 C BRANCH 160 161 ATOM 161 N VAL A 4 5.931 -5.875 3.411 0.00 0.00 -0.302 N ATOM 162 H VAL A 4 5.522 -6.491 4.099 0.00 0.00 +0.150 HD ATOM 163 C GLU A 3 7.287 -5.960 3.677 0.00 0.00 +0.234 C ATOM 164 O GLU A 3 7.698 -6.898 4.363 0.00 0.00 -0.274 OA BRANCH 163 165 ATOM 165 CA GLU A 3 8.158 -4.772 3.209 0.00 0.00 +0.159 C BRANCH 165 166 ATOM 166 N GLU A 3 8.572 -3.898 4.317 0.00 0.00 -0.302 N ATOM 167 H GLU A 3 9.359 -3.292 4.117 0.00 0.00 +0.150 HD ATOM 168 C GLU A 2 7.661 -3.382 5.226 0.00 0.00 +0.234 C ATOM 169 O GLU A 2 6.493 -3.772 5.307 0.00 0.00 -0.274 OA BRANCH 168 170 ATOM 170 CA GLU A 2 8.195 -2.201 6.073 0.00 0.00 +0.159 C BRANCH 170 171 ATOM 171 N GLU A 2 7.201 -1.762 7.045 0.00 0.00 -0.303 N ATOM 172 H GLU A 2 6.431 -1.208 6.670 0.00 0.00 +0.149 HD ATOM 173 C ASP A 1 6.852 -2.539 8.128 0.00 0.00 +0.231 C ATOM 174 O ASP A 1 7.498 -3.508 8.518 0.00 0.00 -0.274 OA BRANCH 173 175 ATOM 175 CA ASP A 1 5.533 -2.132 8.813 0.00 0.00 +0.148 C BRANCH 175 176 ATOM 176 N ASP A 1 5.491 -0.677 9.070 0.00 0.00 -0.320 NA ATOM 177 H1 ASP A 1 4.695 -0.471 9.672 0.00 0.00 +0.119 HD ATOM 178 H2 ASP A 1 6.325 -0.423 9.604 0.00 0.00 +0.119 HD ENDBRANCH 175 176 BRANCH 175 179 ATOM 179 CB ASP A 1 4.331 -2.667 8.041 0.00 0.00 +0.148 C BRANCH 179 180 ATOM 180 CG ASP A 1 3.921 -1.825 6.862 0.00 0.00 +0.307 C ATOM 181 OD1 ASP A 1 4.633 -1.206 6.086 0.00 0.00 -0.251 OA BRANCH 180 182 ATOM 182 OD2 ASP A 1 2.578 -1.786 6.725 0.00 0.00 -0.481 OA ATOM 183 HD2 ASP A 1 2.423 -1.227 5.934 0.00 0.00 +0.295 HD ENDBRANCH 180 182 ENDBRANCH 179 180 ENDBRANCH 175 179 ENDBRANCH 173 175 ENDBRANCH 170 171 BRANCH 170 184 ATOM 184 CB GLU A 2 9.604 -2.377 6.676 0.00 0.00 +0.043 C BRANCH 184 185 ATOM 185 CG GLU A 2 10.405 -1.074 6.586 0.00 0.00 +0.123 C BRANCH 185 186 ATOM 186 CD GLU A 2 10.735 -0.755 5.155 0.00 0.00 +0.305 C ATOM 187 OE1 GLU A 2 10.640 -1.517 4.200 0.00 0.00 -0.251 OA BRANCH 186 188 ATOM 188 OE2 GLU A 2 11.161 0.512 5.010 0.00 0.00 -0.481 OA ATOM 189 HE2 GLU A 2 11.145 0.674 4.040 0.00 0.00 +0.295 HD ENDBRANCH 186 188 ENDBRANCH 185 186 ENDBRANCH 184 185 ENDBRANCH 170 184 ENDBRANCH 168 170 ENDBRANCH 165 166 BRANCH 165 190 ATOM 190 CB GLU A 3 9.405 -5.361 2.528 0.00 0.00 +0.043 C BRANCH 190 191 ATOM 191 CG GLU A 3 10.089 -4.383 1.575 0.00 0.00 +0.123 C BRANCH 191 192 ATOM 192 CD GLU A 3 11.309 -5.007 0.958 0.00 0.00 +0.305 C ATOM 193 OE1 GLU A 3 11.678 -6.164 1.041 0.00 0.00 -0.251 OA BRANCH 192 194 ATOM 194 OE2 GLU A 3 12.020 -4.123 0.230 0.00 0.00 -0.481 OA ATOM 195 HE2 GLU A 3 12.772 -4.653 -0.103 0.00 0.00 +0.295 HD ENDBRANCH 192 194 ENDBRANCH 191 192 ENDBRANCH 190 191 ENDBRANCH 165 190 ENDBRANCH 163 165 ENDBRANCH 160 161 BRANCH 160 196 ATOM 196 CB VAL A 4 3.841 -6.269 2.100 0.00 0.00 +0.012 C ATOM 197 CG2 VAL A 4 3.336 -7.629 2.605 0.00 0.00 +0.009 C ATOM 198 CG1 VAL A 4 3.204 -5.154 2.942 0.00 0.00 +0.009 C ENDBRANCH 160 196 ENDBRANCH 158 160 ENDBRANCH 155 156 BRANCH 155 199 ATOM 199 CB LEU A 5 5.109 -3.591 -1.980 0.00 0.00 +0.034 C BRANCH 199 200 ATOM 200 CG LEU A 5 5.443 -4.882 -2.772 0.00 0.00 -0.015 C ATOM 201 CD2 LEU A 5 5.365 -4.662 -4.285 0.00 0.00 +0.007 C ATOM 202 CD1 LEU A 5 4.528 -6.046 -2.388 0.00 0.00 +0.007 C ENDBRANCH 199 200 ENDBRANCH 155 199 ENDBRANCH 153 155 ENDBRANCH 150 151 BRANCH 150 203 ATOM 203 CB TRP A 6 6.769 -0.720 2.455 0.00 0.00 +0.069 C BRANCH 203 204 ATOM 204 CG TRP A 6 7.402 0.451 3.132 0.00 0.00 -0.020 A ATOM 205 CD2 TRP A 6 8.542 1.184 2.668 0.00 0.00 +0.003 A ATOM 206 CE2 TRP A 6 8.779 2.216 3.575 0.00 0.00 +0.047 A ATOM 207 CZ2 TRP A 6 9.829 3.134 3.422 0.00 0.00 +0.026 A ATOM 208 CH2 TRP A 6 10.667 2.982 2.316 0.00 0.00 +0.002 A ATOM 209 CZ3 TRP A 6 10.458 1.959 1.393 0.00 0.00 +0.001 A ATOM 210 NE1 TRP A 6 7.829 2.109 4.563 0.00 0.00 -0.360 N ATOM 211 HE1 TRP A 6 7.753 2.730 5.359 0.00 0.00 +0.165 HD ATOM 212 CE3 TRP A 6 9.398 1.061 1.553 0.00 0.00 +0.010 A ATOM 213 CD1 TRP A 6 7.003 1.042 4.316 0.00 0.00 +0.087 A ENDBRANCH 203 204 ENDBRANCH 150 203 ENDBRANCH 148 150 ENDBRANCH 145 146 BRANCH 145 214 ATOM 214 CB SER A 7 6.665 2.357 -2.234 0.00 0.00 +0.187 C BRANCH 214 215 ATOM 215 OG SER A 7 6.971 3.674 -2.685 0.00 0.00 -0.393 OA ATOM 216 H SER A 7 7.715 3.997 -2.130 0.00 0.00 +0.209 HD ENDBRANCH 214 215 ENDBRANCH 145 214 ENDBRANCH 143 145 ENDBRANCH 140 141 BRANCH 140 217 ATOM 217 CB LEU A 8 2.558 5.915 -1.792 0.00 0.00 +0.034 C BRANCH 217 218 ATOM 218 CG LEU A 8 3.346 7.026 -2.519 0.00 0.00 -0.015 C ATOM 219 CD2 LEU A 8 4.794 7.147 -2.040 0.00 0.00 +0.007 C ATOM 220 CD1 LEU A 8 2.640 8.368 -2.286 0.00 0.00 +0.007 C ENDBRANCH 217 218 ENDBRANCH 140 217 ENDBRANCH 138 140 ENDBRANCH 135 136 BRANCH 135 221 ATOM 221 CB VAL A 9 1.266 3.605 -6.506 0.00 0.00 +0.012 C ATOM 222 CG2 VAL A 9 1.852 4.944 -7.010 0.00 0.00 +0.009 C ATOM 223 CG1 VAL A 9 0.469 3.039 -7.690 0.00 0.00 +0.009 C ENDBRANCH 135 221 ENDBRANCH 133 135 ENDBRANCH 130 131 BRANCH 130 224 ATOM 224 CB ILE A 10 -3.239 1.303 -5.981 0.00 0.00 +0.015 C ATOM 225 CG2 ILE A 10 -3.043 1.140 -7.496 0.00 0.00 +0.010 C BRANCH 224 227 ATOM 226 CD1 ILE A 10 -5.802 1.365 -6.087 0.00 0.00 +0.004 C ATOM 227 CG1 ILE A 10 -4.570 0.665 -5.524 0.00 0.00 +0.002 C ENDBRANCH 224 227 ENDBRANCH 130 224 ENDBRANCH 126 130 ENDBRANCH 125 127 BRANCH 125 228 ATOM 228 CB GLU A 11 -1.130 -3.754 -4.897 0.00 0.00 +0.043 C BRANCH 228 229 ATOM 229 CG GLU A 11 -0.756 -5.051 -5.634 0.00 0.00 +0.123 C BRANCH 229 230 ATOM 230 CD GLU A 11 0.433 -5.729 -5.017 0.00 0.00 +0.305 C ATOM 231 OE1 GLU A 11 1.126 -5.330 -4.095 0.00 0.00 -0.251 OA BRANCH 230 232 ATOM 232 OE2 GLU A 11 0.694 -6.908 -5.609 0.00 0.00 -0.481 OA ATOM 233 HE2 GLU A 11 1.473 -7.284 -5.140 0.00 0.00 +0.295 HD ENDBRANCH 230 232 ENDBRANCH 229 230 ENDBRANCH 228 229 ENDBRANCH 125 228 ENDBRANCH 121 125 ENDBRANCH 120 122 BRANCH 120 234 ATOM 234 CB MET A 12 -6.131 -5.403 -4.429 0.00 0.00 +0.042 C BRANCH 234 235 ATOM 235 CG MET A 12 -7.503 -5.904 -3.991 0.00 0.00 +0.071 C BRANCH 235 236 ATOM 236 SD MET A 12 -8.611 -4.640 -3.276 0.00 0.00 -0.164 S ATOM 237 CE MET A 12 -8.857 -3.592 -4.731 0.00 0.00 +0.084 C ENDBRANCH 235 236 ENDBRANCH 234 235 ENDBRANCH 120 234 ENDBRANCH 1 120 TORSDOF 106