USER MOD reduce.3.24.130724 H: found=0, std=0, add=770, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 770 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 37 THR OG1 : rot -47:sc= 0.237 USER MOD Set 1.2: A 55 THR OG1 : rot 180:sc= 0 USER MOD Single : A 9 GLN : amide:sc= -2.19! C(o=-2.2!,f=-8.7!) USER MOD Single : A 13 GLN : amide:sc= 0 K(o=0,f=-1.1!) USER MOD Single : A 15 MET CE :methyl 153:sc= -0.0187 (180deg=-1.45) USER MOD Single : A 16 GLN : amide:sc= 0 K(o=0,f=-1.4!) USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 GLN : amide:sc= 0 K(o=0,f=-1.4!) USER MOD Single : A 28 LYS NZ :NH3+ 165:sc=-0.000848 (180deg=-0.182) USER MOD Single : A 34 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 35 MET CE :methyl -147:sc= -0.23 (180deg=-1.35!) USER MOD Single : A 36 THR OG1 : rot 180:sc= 0 USER MOD Single : A 39 SER OG : rot 8:sc= 0.411! USER MOD Single : A 43 MET CE :methyl -176:sc= -0.93 (180deg=-1.01) USER MOD Single : A 44 SER OG : rot 67:sc= 0.85 USER MOD Single : A 49 TYR OH : rot 180:sc= 0 USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 TYR OH : rot 180:sc= -0.417 USER MOD Single : A 58 ASN : amide:sc= -3.1 K(o=-3.1,f=-4.1!) USER MOD Single : A 60 LYS NZ :NH3+ 164:sc=-0.00889 (180deg=-0.228) USER MOD Single : A 66 LYS NZ :NH3+ -159:sc= -0.207 (180deg=-1.05) USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 GLN : amide:sc= -0.126 K(o=-0.13,f=-0.69) USER MOD Single : A 76 SER OG : rot 180:sc= 0 USER MOD Single : A 81 SER OG : rot 180:sc= -0.464 USER MOD Single : A 85 LYS NZ :NH3+ -169:sc= 0 (180deg=-0.125) USER MOD Single : A 87 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 96 THR OG1 : rot 180:sc= 0 USER MOD Single : A 99 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N PRO A 8 -8.894 132.417 117.861 1.00 0.00 N ATOM 2 CA PRO A 8 -9.809 131.333 118.329 1.00 0.00 C ATOM 3 C PRO A 8 -10.828 131.853 119.345 1.00 0.00 C ATOM 4 O PRO A 8 -11.870 131.237 119.564 1.00 0.00 O ATOM 5 CB PRO A 8 -8.850 130.289 118.945 1.00 0.00 C ATOM 6 CG PRO A 8 -7.649 131.082 119.363 1.00 0.00 C ATOM 7 CD PRO A 8 -7.510 132.203 118.327 1.00 0.00 C ATOM 0 HA PRO A 8 -10.416 130.915 117.526 1.00 0.00 H new ATOM 0 HB2 PRO A 8 -9.307 129.783 119.796 1.00 0.00 H new ATOM 0 HB3 PRO A 8 -8.584 129.518 118.221 1.00 0.00 H new ATOM 0 HG2 PRO A 8 -7.779 131.490 120.366 1.00 0.00 H new ATOM 0 HG3 PRO A 8 -6.756 130.457 119.386 1.00 0.00 H new ATOM 0 HD2 PRO A 8 -7.091 133.107 118.768 1.00 0.00 H new ATOM 0 HD3 PRO A 8 -6.851 131.913 117.508 1.00 0.00 H new ATOM 15 N GLN A 9 -10.521 132.990 119.961 1.00 0.00 N ATOM 16 CA GLN A 9 -11.422 133.577 120.947 1.00 0.00 C ATOM 17 C GLN A 9 -12.788 133.845 120.325 1.00 0.00 C ATOM 18 O GLN A 9 -13.817 133.715 120.986 1.00 0.00 O ATOM 19 CB GLN A 9 -10.840 134.890 121.479 1.00 0.00 C ATOM 20 CG GLN A 9 -9.581 134.608 122.303 1.00 0.00 C ATOM 21 CD GLN A 9 -8.440 134.182 121.387 1.00 0.00 C ATOM 22 OE1 GLN A 9 -8.383 134.597 120.230 1.00 0.00 O ATOM 23 NE2 GLN A 9 -7.518 133.377 121.840 1.00 0.00 N ATOM 0 H GLN A 9 -9.664 133.519 119.798 1.00 0.00 H new ATOM 0 HA GLN A 9 -11.536 132.872 121.770 1.00 0.00 H new ATOM 0 HB2 GLN A 9 -10.600 135.554 120.649 1.00 0.00 H new ATOM 0 HB3 GLN A 9 -11.580 135.403 122.094 1.00 0.00 H new ATOM 0 HG2 GLN A 9 -9.296 135.499 122.862 1.00 0.00 H new ATOM 0 HG3 GLN A 9 -9.783 133.825 123.034 1.00 0.00 H new ATOM 0 HE21 GLN A 9 -7.567 133.034 122.799 1.00 0.00 H new ATOM 0 HE22 GLN A 9 -6.749 133.091 121.235 1.00 0.00 H new ATOM 32 N ARG A 10 -12.789 134.222 119.049 1.00 0.00 N ATOM 33 CA ARG A 10 -14.036 134.509 118.352 1.00 0.00 C ATOM 34 C ARG A 10 -14.941 133.285 118.358 1.00 0.00 C ATOM 35 O ARG A 10 -16.153 133.401 118.535 1.00 0.00 O ATOM 36 CB ARG A 10 -13.740 134.921 116.907 1.00 0.00 C ATOM 37 CG ARG A 10 -15.036 135.351 116.217 1.00 0.00 C ATOM 38 CD ARG A 10 -14.729 135.796 114.786 1.00 0.00 C ATOM 39 NE ARG A 10 -14.325 134.650 113.979 1.00 0.00 N ATOM 40 CZ ARG A 10 -14.224 134.741 112.657 1.00 0.00 C ATOM 41 NH1 ARG A 10 -13.862 133.702 111.956 1.00 0.00 N1+ ATOM 42 NH2 ARG A 10 -14.488 135.871 112.059 1.00 0.00 N ATOM 0 H ARG A 10 -11.948 134.335 118.483 1.00 0.00 H new ATOM 0 HA ARG A 10 -14.543 135.325 118.866 1.00 0.00 H new ATOM 0 HB2 ARG A 10 -13.020 135.739 116.892 1.00 0.00 H new ATOM 0 HB3 ARG A 10 -13.288 134.089 116.367 1.00 0.00 H new ATOM 0 HG2 ARG A 10 -15.747 134.525 116.208 1.00 0.00 H new ATOM 0 HG3 ARG A 10 -15.502 136.166 116.771 1.00 0.00 H new ATOM 0 HD2 ARG A 10 -15.608 136.267 114.347 1.00 0.00 H new ATOM 0 HD3 ARG A 10 -13.936 136.544 114.792 1.00 0.00 H new ATOM 0 HE ARG A 10 -14.116 133.763 114.437 1.00 0.00 H new ATOM 0 HH11 ARG A 10 -13.656 132.819 112.423 1.00 0.00 H new ATOM 0 HH12 ARG A 10 -13.785 133.773 110.941 1.00 0.00 H new ATOM 0 HH21 ARG A 10 -14.772 136.684 112.606 1.00 0.00 H new ATOM 0 HH22 ARG A 10 -14.411 135.941 111.044 1.00 0.00 H new ATOM 56 N VAL A 11 -14.347 132.111 118.176 1.00 0.00 N ATOM 57 CA VAL A 11 -15.118 130.877 118.176 1.00 0.00 C ATOM 58 C VAL A 11 -15.818 130.706 119.516 1.00 0.00 C ATOM 59 O VAL A 11 -16.977 130.297 119.577 1.00 0.00 O ATOM 60 CB VAL A 11 -14.195 129.683 117.912 1.00 0.00 C ATOM 61 CG1 VAL A 11 -14.980 128.377 118.058 1.00 0.00 C ATOM 62 CG2 VAL A 11 -13.631 129.781 116.492 1.00 0.00 C ATOM 0 H VAL A 11 -13.345 131.989 118.028 1.00 0.00 H new ATOM 0 HA VAL A 11 -15.868 130.926 117.386 1.00 0.00 H new ATOM 0 HB VAL A 11 -13.378 129.694 118.634 1.00 0.00 H new ATOM 0 HG11 VAL A 11 -14.318 127.532 117.869 1.00 0.00 H new ATOM 0 HG12 VAL A 11 -15.381 128.305 119.069 1.00 0.00 H new ATOM 0 HG13 VAL A 11 -15.800 128.363 117.340 1.00 0.00 H new ATOM 0 HG21 VAL A 11 -12.974 128.932 116.302 1.00 0.00 H new ATOM 0 HG22 VAL A 11 -14.451 129.773 115.774 1.00 0.00 H new ATOM 0 HG23 VAL A 11 -13.066 130.707 116.388 1.00 0.00 H new ATOM 72 N ALA A 12 -15.106 131.031 120.585 1.00 0.00 N ATOM 73 CA ALA A 12 -15.665 130.918 121.922 1.00 0.00 C ATOM 74 C ALA A 12 -16.885 131.820 122.061 1.00 0.00 C ATOM 75 O ALA A 12 -17.871 131.455 122.697 1.00 0.00 O ATOM 76 CB ALA A 12 -14.603 131.302 122.961 1.00 0.00 C ATOM 0 H ALA A 12 -14.146 131.373 120.553 1.00 0.00 H new ATOM 0 HA ALA A 12 -15.974 129.887 122.092 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -15.026 131.216 123.962 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -13.747 130.634 122.870 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -14.281 132.329 122.790 1.00 0.00 H new ATOM 82 N GLN A 13 -16.803 133.000 121.459 1.00 0.00 N ATOM 83 CA GLN A 13 -17.903 133.958 121.511 1.00 0.00 C ATOM 84 C GLN A 13 -19.121 133.430 120.774 1.00 0.00 C ATOM 85 O GLN A 13 -20.246 133.540 121.257 1.00 0.00 O ATOM 86 CB GLN A 13 -17.461 135.271 120.880 1.00 0.00 C ATOM 87 CG GLN A 13 -16.320 135.860 121.705 1.00 0.00 C ATOM 88 CD GLN A 13 -15.806 137.140 121.060 1.00 0.00 C ATOM 89 OE1 GLN A 13 -16.434 137.675 120.147 1.00 0.00 O ATOM 90 NE2 GLN A 13 -14.682 137.656 121.476 1.00 0.00 N ATOM 0 H GLN A 13 -15.990 133.317 120.931 1.00 0.00 H new ATOM 0 HA GLN A 13 -18.173 134.116 122.555 1.00 0.00 H new ATOM 0 HB2 GLN A 13 -17.136 135.104 119.853 1.00 0.00 H new ATOM 0 HB3 GLN A 13 -18.297 135.970 120.840 1.00 0.00 H new ATOM 0 HG2 GLN A 13 -16.665 136.068 122.718 1.00 0.00 H new ATOM 0 HG3 GLN A 13 -15.510 135.135 121.787 1.00 0.00 H new ATOM 0 HE21 GLN A 13 -14.165 137.209 122.233 1.00 0.00 H new ATOM 0 HE22 GLN A 13 -14.320 138.506 121.044 1.00 0.00 H new ATOM 99 N GLU A 14 -18.886 132.841 119.607 1.00 0.00 N ATOM 100 CA GLU A 14 -19.981 132.286 118.827 1.00 0.00 C ATOM 101 C GLU A 14 -20.630 131.184 119.636 1.00 0.00 C ATOM 102 O GLU A 14 -21.847 131.017 119.645 1.00 0.00 O ATOM 103 CB GLU A 14 -19.451 131.722 117.507 1.00 0.00 C ATOM 104 CG GLU A 14 -18.896 132.861 116.653 1.00 0.00 C ATOM 105 CD GLU A 14 -18.418 132.320 115.310 1.00 0.00 C ATOM 106 OE1 GLU A 14 -18.376 131.110 115.163 1.00 0.00 O ATOM 107 OE2 GLU A 14 -18.101 133.124 114.449 1.00 0.00 O1- ATOM 0 H GLU A 14 -17.962 132.737 119.187 1.00 0.00 H new ATOM 0 HA GLU A 14 -20.710 133.064 118.601 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -18.671 130.985 117.701 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -20.250 131.208 116.972 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -19.665 133.618 116.497 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -18.071 133.348 117.173 1.00 0.00 H new ATOM 114 N MET A 15 -19.788 130.455 120.340 1.00 0.00 N ATOM 115 CA MET A 15 -20.254 129.387 121.202 1.00 0.00 C ATOM 116 C MET A 15 -20.904 129.970 122.440 1.00 0.00 C ATOM 117 O MET A 15 -21.873 129.433 122.954 1.00 0.00 O ATOM 118 CB MET A 15 -19.095 128.467 121.589 1.00 0.00 C ATOM 119 CG MET A 15 -18.661 127.654 120.364 1.00 0.00 C ATOM 120 SD MET A 15 -17.402 126.446 120.848 1.00 0.00 S ATOM 121 CE MET A 15 -17.095 125.763 119.200 1.00 0.00 C ATOM 0 H MET A 15 -18.776 130.583 120.332 1.00 0.00 H new ATOM 0 HA MET A 15 -20.993 128.796 120.661 1.00 0.00 H new ATOM 0 HB2 MET A 15 -18.258 129.056 121.964 1.00 0.00 H new ATOM 0 HB3 MET A 15 -19.400 127.798 122.394 1.00 0.00 H new ATOM 0 HG2 MET A 15 -19.521 127.143 119.931 1.00 0.00 H new ATOM 0 HG3 MET A 15 -18.265 128.319 119.596 1.00 0.00 H new ATOM 0 HE1 MET A 15 -16.078 125.373 119.151 1.00 0.00 H new ATOM 0 HE2 MET A 15 -17.802 124.958 119.002 1.00 0.00 H new ATOM 0 HE3 MET A 15 -17.219 126.547 118.453 1.00 0.00 H new ATOM 131 N GLN A 16 -20.351 131.078 122.916 1.00 0.00 N ATOM 132 CA GLN A 16 -20.881 131.726 124.106 1.00 0.00 C ATOM 133 C GLN A 16 -22.346 132.070 123.912 1.00 0.00 C ATOM 134 O GLN A 16 -23.182 131.773 124.767 1.00 0.00 O ATOM 135 CB GLN A 16 -20.089 133.004 124.398 1.00 0.00 C ATOM 136 CG GLN A 16 -20.546 133.600 125.731 1.00 0.00 C ATOM 137 CD GLN A 16 -19.742 134.857 126.042 1.00 0.00 C ATOM 138 OE1 GLN A 16 -18.778 135.168 125.343 1.00 0.00 O ATOM 139 NE2 GLN A 16 -20.084 135.604 127.056 1.00 0.00 N ATOM 0 H GLN A 16 -19.543 131.542 122.500 1.00 0.00 H new ATOM 0 HA GLN A 16 -20.787 131.040 124.948 1.00 0.00 H new ATOM 0 HB2 GLN A 16 -19.022 132.782 124.434 1.00 0.00 H new ATOM 0 HB3 GLN A 16 -20.237 133.727 123.596 1.00 0.00 H new ATOM 0 HG2 GLN A 16 -21.608 133.839 125.687 1.00 0.00 H new ATOM 0 HG3 GLN A 16 -20.417 132.869 126.529 1.00 0.00 H new ATOM 0 HE21 GLN A 16 -20.883 135.344 127.634 1.00 0.00 H new ATOM 0 HE22 GLN A 16 -19.552 136.447 127.270 1.00 0.00 H new ATOM 148 N LYS A 17 -22.658 132.674 122.777 1.00 0.00 N ATOM 149 CA LYS A 17 -24.038 133.023 122.486 1.00 0.00 C ATOM 150 C LYS A 17 -24.867 131.761 122.310 1.00 0.00 C ATOM 151 O LYS A 17 -26.024 131.700 122.726 1.00 0.00 O ATOM 152 CB LYS A 17 -24.140 133.921 121.245 1.00 0.00 C ATOM 153 CG LYS A 17 -23.419 133.277 120.064 1.00 0.00 C ATOM 154 CD LYS A 17 -23.626 134.126 118.802 1.00 0.00 C ATOM 155 CE LYS A 17 -22.932 135.489 118.946 1.00 0.00 C ATOM 156 NZ LYS A 17 -22.685 136.060 117.592 1.00 0.00 N1+ ATOM 0 H LYS A 17 -21.987 132.929 122.053 1.00 0.00 H new ATOM 0 HA LYS A 17 -24.432 133.589 123.330 1.00 0.00 H new ATOM 0 HB2 LYS A 17 -25.187 134.087 120.993 1.00 0.00 H new ATOM 0 HB3 LYS A 17 -23.704 134.897 121.457 1.00 0.00 H new ATOM 0 HG2 LYS A 17 -22.355 133.186 120.282 1.00 0.00 H new ATOM 0 HG3 LYS A 17 -23.798 132.268 119.901 1.00 0.00 H new ATOM 0 HD2 LYS A 17 -23.229 133.600 117.934 1.00 0.00 H new ATOM 0 HD3 LYS A 17 -24.692 134.272 118.626 1.00 0.00 H new ATOM 0 HE2 LYS A 17 -23.553 136.167 119.531 1.00 0.00 H new ATOM 0 HE3 LYS A 17 -21.990 135.376 119.483 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 -22.215 136.983 117.685 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 -22.076 135.415 117.049 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 -23.591 136.181 117.096 1.00 0.00 H new ATOM 170 N GLU A 18 -24.261 130.751 121.696 1.00 0.00 N ATOM 171 CA GLU A 18 -24.950 129.484 121.474 1.00 0.00 C ATOM 172 C GLU A 18 -25.243 128.803 122.803 1.00 0.00 C ATOM 173 O GLU A 18 -26.322 128.249 123.008 1.00 0.00 O ATOM 174 CB GLU A 18 -24.101 128.563 120.594 1.00 0.00 C ATOM 175 CG GLU A 18 -24.918 127.329 120.205 1.00 0.00 C ATOM 176 CD GLU A 18 -24.059 126.367 119.393 1.00 0.00 C ATOM 177 OE1 GLU A 18 -22.892 126.663 119.200 1.00 0.00 O ATOM 178 OE2 GLU A 18 -24.583 125.347 118.975 1.00 0.00 O1- ATOM 0 H GLU A 18 -23.303 130.783 121.346 1.00 0.00 H new ATOM 0 HA GLU A 18 -25.892 129.688 120.965 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -23.778 129.095 119.699 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -23.200 128.262 121.128 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -25.288 126.831 121.101 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -25.790 127.629 119.624 1.00 0.00 H new ATOM 185 N ILE A 19 -24.283 128.871 123.710 1.00 0.00 N ATOM 186 CA ILE A 19 -24.457 128.284 125.029 1.00 0.00 C ATOM 187 C ILE A 19 -25.593 129.005 125.732 1.00 0.00 C ATOM 188 O ILE A 19 -26.449 128.388 126.360 1.00 0.00 O ATOM 189 CB ILE A 19 -23.148 128.414 125.838 1.00 0.00 C ATOM 190 CG1 ILE A 19 -22.056 127.472 125.245 1.00 0.00 C ATOM 191 CG2 ILE A 19 -23.396 128.095 127.326 1.00 0.00 C ATOM 192 CD1 ILE A 19 -22.183 126.033 125.782 1.00 0.00 C ATOM 0 H ILE A 19 -23.381 129.323 123.560 1.00 0.00 H new ATOM 0 HA ILE A 19 -24.698 127.225 124.941 1.00 0.00 H new ATOM 0 HB ILE A 19 -22.794 129.443 125.768 1.00 0.00 H new ATOM 0 HG12 ILE A 19 -22.137 127.462 124.158 1.00 0.00 H new ATOM 0 HG13 ILE A 19 -21.068 127.864 125.488 1.00 0.00 H new ATOM 0 HG21 ILE A 19 -22.462 128.192 127.879 1.00 0.00 H new ATOM 0 HG22 ILE A 19 -24.131 128.791 127.730 1.00 0.00 H new ATOM 0 HG23 ILE A 19 -23.771 127.076 127.422 1.00 0.00 H new ATOM 0 HD11 ILE A 19 -21.403 125.411 125.343 1.00 0.00 H new ATOM 0 HD12 ILE A 19 -22.075 126.039 126.867 1.00 0.00 H new ATOM 0 HD13 ILE A 19 -23.161 125.631 125.516 1.00 0.00 H new ATOM 204 N ALA A 20 -25.595 130.320 125.584 1.00 0.00 N ATOM 205 CA ALA A 20 -26.630 131.145 126.173 1.00 0.00 C ATOM 206 C ALA A 20 -27.957 130.818 125.527 1.00 0.00 C ATOM 207 O ALA A 20 -28.997 130.785 126.183 1.00 0.00 O ATOM 208 CB ALA A 20 -26.305 132.627 125.971 1.00 0.00 C ATOM 0 H ALA A 20 -24.889 130.837 125.060 1.00 0.00 H new ATOM 0 HA ALA A 20 -26.684 130.943 127.243 1.00 0.00 H new ATOM 0 HB1 ALA A 20 -27.091 133.236 126.418 1.00 0.00 H new ATOM 0 HB2 ALA A 20 -25.352 132.858 126.446 1.00 0.00 H new ATOM 0 HB3 ALA A 20 -26.241 132.843 124.905 1.00 0.00 H new ATOM 214 N LEU A 21 -27.904 130.575 124.225 1.00 0.00 N ATOM 215 CA LEU A 21 -29.104 130.248 123.484 1.00 0.00 C ATOM 216 C LEU A 21 -29.696 128.947 123.996 1.00 0.00 C ATOM 217 O LEU A 21 -30.877 128.880 124.337 1.00 0.00 O ATOM 218 CB LEU A 21 -28.775 130.113 121.992 1.00 0.00 C ATOM 219 CG LEU A 21 -30.048 129.851 121.158 1.00 0.00 C ATOM 220 CD1 LEU A 21 -30.961 131.093 121.158 1.00 0.00 C ATOM 221 CD2 LEU A 21 -29.622 129.519 119.722 1.00 0.00 C ATOM 0 H LEU A 21 -27.050 130.599 123.668 1.00 0.00 H new ATOM 0 HA LEU A 21 -29.831 131.048 123.622 1.00 0.00 H new ATOM 0 HB2 LEU A 21 -28.289 131.023 121.641 1.00 0.00 H new ATOM 0 HB3 LEU A 21 -28.068 129.297 121.846 1.00 0.00 H new ATOM 0 HG LEU A 21 -30.606 129.021 121.591 1.00 0.00 H new ATOM 0 HD11 LEU A 21 -31.853 130.889 120.565 1.00 0.00 H new ATOM 0 HD12 LEU A 21 -31.252 131.331 122.181 1.00 0.00 H new ATOM 0 HD13 LEU A 21 -30.425 131.939 120.728 1.00 0.00 H new ATOM 0 HD21 LEU A 21 -30.507 129.330 119.114 1.00 0.00 H new ATOM 0 HD22 LEU A 21 -29.067 130.359 119.304 1.00 0.00 H new ATOM 0 HD23 LEU A 21 -28.989 128.632 119.726 1.00 0.00 H new ATOM 233 N ILE A 22 -28.866 127.919 124.054 1.00 0.00 N ATOM 234 CA ILE A 22 -29.311 126.628 124.532 1.00 0.00 C ATOM 235 C ILE A 22 -29.645 126.686 126.017 1.00 0.00 C ATOM 236 O ILE A 22 -30.550 125.995 126.487 1.00 0.00 O ATOM 237 CB ILE A 22 -28.229 125.583 124.236 1.00 0.00 C ATOM 238 CG1 ILE A 22 -28.170 125.365 122.715 1.00 0.00 C ATOM 239 CG2 ILE A 22 -28.548 124.267 124.951 1.00 0.00 C ATOM 240 CD1 ILE A 22 -26.954 124.516 122.353 1.00 0.00 C ATOM 0 H ILE A 22 -27.885 127.956 123.777 1.00 0.00 H new ATOM 0 HA ILE A 22 -30.225 126.342 124.012 1.00 0.00 H new ATOM 0 HB ILE A 22 -27.263 125.935 124.599 1.00 0.00 H new ATOM 0 HG12 ILE A 22 -29.081 124.873 122.375 1.00 0.00 H new ATOM 0 HG13 ILE A 22 -28.117 126.326 122.204 1.00 0.00 H new ATOM 0 HG21 ILE A 22 -27.770 123.536 124.731 1.00 0.00 H new ATOM 0 HG22 ILE A 22 -28.591 124.438 126.027 1.00 0.00 H new ATOM 0 HG23 ILE A 22 -29.510 123.889 124.605 1.00 0.00 H new ATOM 0 HD11 ILE A 22 -26.922 124.368 121.274 1.00 0.00 H new ATOM 0 HD12 ILE A 22 -26.046 125.025 122.677 1.00 0.00 H new ATOM 0 HD13 ILE A 22 -27.025 123.549 122.850 1.00 0.00 H new ATOM 252 N LEU A 23 -28.913 127.507 126.748 1.00 0.00 N ATOM 253 CA LEU A 23 -29.149 127.634 128.179 1.00 0.00 C ATOM 254 C LEU A 23 -30.590 128.058 128.444 1.00 0.00 C ATOM 255 O LEU A 23 -31.199 127.642 129.422 1.00 0.00 O ATOM 256 CB LEU A 23 -28.172 128.650 128.794 1.00 0.00 C ATOM 257 CG LEU A 23 -28.379 128.769 130.319 1.00 0.00 C ATOM 258 CD1 LEU A 23 -28.078 127.423 131.013 1.00 0.00 C ATOM 259 CD2 LEU A 23 -27.431 129.853 130.856 1.00 0.00 C ATOM 0 H LEU A 23 -28.159 128.090 126.383 1.00 0.00 H new ATOM 0 HA LEU A 23 -28.981 126.663 128.646 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -27.147 128.345 128.586 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -28.315 129.625 128.328 1.00 0.00 H new ATOM 0 HG LEU A 23 -29.415 129.036 130.526 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -28.229 127.526 132.088 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -28.747 126.656 130.624 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -27.045 127.136 130.818 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -27.564 129.951 131.933 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -26.400 129.573 130.641 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -27.657 130.805 130.375 1.00 0.00 H new ATOM 271 N GLN A 24 -31.122 128.906 127.578 1.00 0.00 N ATOM 272 CA GLN A 24 -32.493 129.392 127.724 1.00 0.00 C ATOM 273 C GLN A 24 -33.513 128.428 127.124 1.00 0.00 C ATOM 274 O GLN A 24 -34.637 128.310 127.612 1.00 0.00 O ATOM 275 CB GLN A 24 -32.628 130.753 127.041 1.00 0.00 C ATOM 276 CG GLN A 24 -31.743 131.775 127.757 1.00 0.00 C ATOM 277 CD GLN A 24 -31.830 133.125 127.052 1.00 0.00 C ATOM 278 OE1 GLN A 24 -32.279 133.200 125.908 1.00 0.00 O ATOM 279 NE2 GLN A 24 -31.427 134.200 127.670 1.00 0.00 N ATOM 0 H GLN A 24 -30.628 129.275 126.765 1.00 0.00 H new ATOM 0 HA GLN A 24 -32.699 129.476 128.791 1.00 0.00 H new ATOM 0 HB2 GLN A 24 -32.338 130.676 125.993 1.00 0.00 H new ATOM 0 HB3 GLN A 24 -33.668 131.080 127.061 1.00 0.00 H new ATOM 0 HG2 GLN A 24 -32.058 131.877 128.796 1.00 0.00 H new ATOM 0 HG3 GLN A 24 -30.710 131.428 127.770 1.00 0.00 H new ATOM 0 HE21 GLN A 24 -31.056 134.134 128.618 1.00 0.00 H new ATOM 0 HE22 GLN A 24 -31.483 135.106 127.206 1.00 0.00 H new ATOM 288 N ARG A 25 -33.132 127.798 126.020 1.00 0.00 N ATOM 289 CA ARG A 25 -34.041 126.906 125.298 1.00 0.00 C ATOM 290 C ARG A 25 -34.221 125.537 125.946 1.00 0.00 C ATOM 291 O ARG A 25 -35.347 125.060 126.088 1.00 0.00 O ATOM 292 CB ARG A 25 -33.525 126.720 123.872 1.00 0.00 C ATOM 293 CG ARG A 25 -34.575 126.000 123.016 1.00 0.00 C ATOM 294 CD ARG A 25 -34.018 125.776 121.611 1.00 0.00 C ATOM 295 NE ARG A 25 -33.700 127.055 120.983 1.00 0.00 N ATOM 296 CZ ARG A 25 -32.943 127.115 119.892 1.00 0.00 C ATOM 297 NH1 ARG A 25 -32.672 128.270 119.350 1.00 0.00 N1+ ATOM 298 NH2 ARG A 25 -32.470 126.019 119.365 1.00 0.00 N ATOM 0 H ARG A 25 -32.205 127.885 125.604 1.00 0.00 H new ATOM 0 HA ARG A 25 -35.021 127.384 125.316 1.00 0.00 H new ATOM 0 HB2 ARG A 25 -33.291 127.690 123.433 1.00 0.00 H new ATOM 0 HB3 ARG A 25 -32.599 126.144 123.885 1.00 0.00 H new ATOM 0 HG2 ARG A 25 -34.839 125.045 123.471 1.00 0.00 H new ATOM 0 HG3 ARG A 25 -35.489 126.593 122.967 1.00 0.00 H new ATOM 0 HD2 ARG A 25 -33.123 125.155 121.662 1.00 0.00 H new ATOM 0 HD3 ARG A 25 -34.746 125.237 121.005 1.00 0.00 H new ATOM 0 HE ARG A 25 -34.065 127.917 121.388 1.00 0.00 H new ATOM 0 HH11 ARG A 25 -33.041 129.126 119.763 1.00 0.00 H new ATOM 0 HH12 ARG A 25 -32.091 128.317 118.513 1.00 0.00 H new ATOM 0 HH21 ARG A 25 -32.681 125.116 119.790 1.00 0.00 H new ATOM 0 HH22 ARG A 25 -31.889 126.065 118.528 1.00 0.00 H new ATOM 312 N GLU A 26 -33.127 124.897 126.318 1.00 0.00 N ATOM 313 CA GLU A 26 -33.213 123.564 126.929 1.00 0.00 C ATOM 314 C GLU A 26 -33.686 123.672 128.365 1.00 0.00 C ATOM 315 O GLU A 26 -33.902 122.666 129.041 1.00 0.00 O ATOM 316 CB GLU A 26 -31.856 122.844 126.865 1.00 0.00 C ATOM 317 CG GLU A 26 -31.595 122.344 125.438 1.00 0.00 C ATOM 318 CD GLU A 26 -32.548 121.202 125.093 1.00 0.00 C ATOM 319 OE1 GLU A 26 -33.128 120.645 126.010 1.00 0.00 O ATOM 320 OE2 GLU A 26 -32.682 120.903 123.918 1.00 0.00 O1- ATOM 0 H GLU A 26 -32.180 125.262 126.215 1.00 0.00 H new ATOM 0 HA GLU A 26 -33.937 122.976 126.365 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -31.060 123.522 127.173 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -31.847 122.005 127.561 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -31.725 123.162 124.729 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -30.563 122.005 125.347 1.00 0.00 H new ATOM 327 N ILE A 27 -33.851 124.908 128.821 1.00 0.00 N ATOM 328 CA ILE A 27 -34.311 125.188 130.187 1.00 0.00 C ATOM 329 C ILE A 27 -35.679 125.852 130.148 1.00 0.00 C ATOM 330 O ILE A 27 -35.872 126.862 129.469 1.00 0.00 O ATOM 331 CB ILE A 27 -33.302 126.117 130.853 1.00 0.00 C ATOM 332 CG1 ILE A 27 -31.899 125.481 130.770 1.00 0.00 C ATOM 333 CG2 ILE A 27 -33.696 126.375 132.312 1.00 0.00 C ATOM 334 CD1 ILE A 27 -31.869 124.092 131.429 1.00 0.00 C ATOM 0 H ILE A 27 -33.673 125.743 128.263 1.00 0.00 H new ATOM 0 HA ILE A 27 -34.393 124.259 130.751 1.00 0.00 H new ATOM 0 HB ILE A 27 -33.292 127.076 130.335 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -31.598 125.396 129.726 1.00 0.00 H new ATOM 0 HG13 ILE A 27 -31.174 126.132 131.258 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -32.966 127.040 132.774 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -34.682 126.839 132.346 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -33.721 125.430 132.855 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -30.865 123.674 131.352 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -32.145 124.182 132.480 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -32.576 123.434 130.923 1.00 0.00 H new ATOM 346 N LYS A 28 -36.630 125.279 130.881 1.00 0.00 N ATOM 347 CA LYS A 28 -37.982 125.824 130.924 1.00 0.00 C ATOM 348 C LYS A 28 -38.036 126.967 131.931 1.00 0.00 C ATOM 349 O LYS A 28 -38.054 126.746 133.142 1.00 0.00 O ATOM 350 CB LYS A 28 -38.956 124.702 131.312 1.00 0.00 C ATOM 351 CG LYS A 28 -40.400 125.176 131.151 1.00 0.00 C ATOM 352 CD LYS A 28 -41.349 123.991 131.341 1.00 0.00 C ATOM 353 CE LYS A 28 -42.781 124.427 131.026 1.00 0.00 C ATOM 354 NZ LYS A 28 -42.946 124.561 129.551 1.00 0.00 N1+ ATOM 0 H LYS A 28 -36.490 124.443 131.449 1.00 0.00 H new ATOM 0 HA LYS A 28 -38.266 126.216 129.947 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -38.781 123.827 130.686 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -38.779 124.397 132.343 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -40.622 125.954 131.881 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -40.542 125.615 130.163 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -41.056 123.169 130.688 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -41.287 123.622 132.365 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -43.489 123.697 131.417 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -42.999 125.376 131.515 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -43.958 124.605 129.318 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -42.478 125.431 129.227 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -42.517 123.740 129.078 1.00 0.00 H new ATOM 368 N ASP A 29 -38.037 128.197 131.414 1.00 0.00 N ATOM 369 CA ASP A 29 -38.060 129.383 132.265 1.00 0.00 C ATOM 370 C ASP A 29 -39.459 129.682 132.817 1.00 0.00 C ATOM 371 O ASP A 29 -39.585 130.138 133.953 1.00 0.00 O ATOM 372 CB ASP A 29 -37.529 130.601 131.482 1.00 0.00 C ATOM 373 CG ASP A 29 -36.420 130.161 130.532 1.00 0.00 C ATOM 374 OD1 ASP A 29 -35.317 129.940 131.003 1.00 0.00 O ATOM 375 OD2 ASP A 29 -36.690 130.052 129.347 1.00 0.00 O1- ATOM 0 H ASP A 29 -38.022 128.395 130.414 1.00 0.00 H new ATOM 0 HA ASP A 29 -37.414 129.181 133.120 1.00 0.00 H new ATOM 0 HB2 ASP A 29 -38.339 131.065 130.920 1.00 0.00 H new ATOM 0 HB3 ASP A 29 -37.150 131.353 132.174 1.00 0.00 H new ATOM 380 N PRO A 30 -40.506 129.463 132.054 1.00 0.00 N ATOM 381 CA PRO A 30 -41.895 129.756 132.525 1.00 0.00 C ATOM 382 C PRO A 30 -42.195 129.192 133.919 1.00 0.00 C ATOM 383 O PRO A 30 -42.879 129.838 134.712 1.00 0.00 O ATOM 384 CB PRO A 30 -42.778 129.104 131.449 1.00 0.00 C ATOM 385 CG PRO A 30 -41.948 129.168 130.208 1.00 0.00 C ATOM 386 CD PRO A 30 -40.508 128.928 130.673 1.00 0.00 C ATOM 0 HA PRO A 30 -42.067 130.826 132.640 1.00 0.00 H new ATOM 0 HB2 PRO A 30 -43.028 128.075 131.708 1.00 0.00 H new ATOM 0 HB3 PRO A 30 -43.719 129.640 131.327 1.00 0.00 H new ATOM 0 HG2 PRO A 30 -42.260 128.412 129.487 1.00 0.00 H new ATOM 0 HG3 PRO A 30 -42.047 130.137 129.718 1.00 0.00 H new ATOM 0 HD2 PRO A 30 -40.249 127.870 130.651 1.00 0.00 H new ATOM 0 HD3 PRO A 30 -39.788 129.446 130.039 1.00 0.00 H new ATOM 394 N ARG A 31 -41.690 127.998 134.225 1.00 0.00 N ATOM 395 CA ARG A 31 -41.941 127.412 135.542 1.00 0.00 C ATOM 396 C ARG A 31 -41.323 128.270 136.643 1.00 0.00 C ATOM 397 O ARG A 31 -41.906 128.431 137.714 1.00 0.00 O ATOM 398 CB ARG A 31 -41.361 125.998 135.624 1.00 0.00 C ATOM 399 CG ARG A 31 -42.102 125.058 134.658 1.00 0.00 C ATOM 400 CD ARG A 31 -43.567 124.837 135.103 1.00 0.00 C ATOM 401 NE ARG A 31 -44.434 125.846 134.504 1.00 0.00 N ATOM 402 CZ ARG A 31 -45.738 125.870 134.758 1.00 0.00 C ATOM 403 NH1 ARG A 31 -46.493 126.783 134.211 1.00 0.00 N1+ ATOM 404 NH2 ARG A 31 -46.263 124.982 135.557 1.00 0.00 N ATOM 0 H ARG A 31 -41.120 127.430 133.599 1.00 0.00 H new ATOM 0 HA ARG A 31 -43.021 127.368 135.684 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -40.299 126.019 135.379 1.00 0.00 H new ATOM 0 HB3 ARG A 31 -41.445 125.622 136.644 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -42.084 125.479 133.653 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -41.585 124.099 134.612 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -43.898 123.841 134.808 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -43.636 124.887 136.190 1.00 0.00 H new ATOM 0 HE ARG A 31 -44.032 126.545 133.879 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -46.082 127.479 133.588 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -47.494 126.801 134.406 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -45.672 124.270 135.986 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -47.264 125.000 135.752 1.00 0.00 H new ATOM 418 N LEU A 32 -40.145 128.830 136.368 1.00 0.00 N ATOM 419 CA LEU A 32 -39.467 129.683 137.344 1.00 0.00 C ATOM 420 C LEU A 32 -40.018 131.103 137.260 1.00 0.00 C ATOM 421 O LEU A 32 -39.887 131.892 138.195 1.00 0.00 O ATOM 422 CB LEU A 32 -37.957 129.697 137.076 1.00 0.00 C ATOM 423 CG LEU A 32 -37.411 128.259 137.013 1.00 0.00 C ATOM 424 CD1 LEU A 32 -35.889 128.310 136.835 1.00 0.00 C ATOM 425 CD2 LEU A 32 -37.758 127.497 138.309 1.00 0.00 C ATOM 0 H LEU A 32 -39.645 128.710 135.487 1.00 0.00 H new ATOM 0 HA LEU A 32 -39.645 129.285 138.343 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -37.752 130.212 136.137 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -37.447 130.253 137.863 1.00 0.00 H new ATOM 0 HG LEU A 32 -37.866 127.738 136.171 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -35.494 127.295 136.789 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -35.648 128.835 135.911 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -35.441 128.836 137.678 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -37.366 126.482 138.250 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -37.313 128.009 139.162 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -38.841 127.461 138.431 1.00 0.00 H new ATOM 437 N GLY A 33 -40.639 131.412 136.126 1.00 0.00 N ATOM 438 CA GLY A 33 -41.221 132.730 135.904 1.00 0.00 C ATOM 439 C GLY A 33 -40.145 133.756 135.561 1.00 0.00 C ATOM 440 O GLY A 33 -40.434 134.944 135.416 1.00 0.00 O ATOM 0 H GLY A 33 -40.752 130.766 135.345 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -41.949 132.678 135.094 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -41.759 133.048 136.797 1.00 0.00 H new ATOM 444 N MET A 34 -38.900 133.291 135.426 1.00 0.00 N ATOM 445 CA MET A 34 -37.774 134.176 135.092 1.00 0.00 C ATOM 446 C MET A 34 -36.739 133.425 134.257 1.00 0.00 C ATOM 447 O MET A 34 -36.660 132.198 134.309 1.00 0.00 O ATOM 448 CB MET A 34 -37.120 134.705 136.372 1.00 0.00 C ATOM 449 CG MET A 34 -38.130 135.545 137.159 1.00 0.00 C ATOM 450 SD MET A 34 -37.294 136.364 138.538 1.00 0.00 S ATOM 451 CE MET A 34 -38.766 137.105 139.286 1.00 0.00 C ATOM 0 H MET A 34 -38.644 132.311 135.542 1.00 0.00 H new ATOM 0 HA MET A 34 -38.155 135.017 134.512 1.00 0.00 H new ATOM 0 HB2 MET A 34 -36.770 133.873 136.983 1.00 0.00 H new ATOM 0 HB3 MET A 34 -36.247 135.308 136.123 1.00 0.00 H new ATOM 0 HG2 MET A 34 -38.588 136.287 136.506 1.00 0.00 H new ATOM 0 HG3 MET A 34 -38.933 134.910 137.533 1.00 0.00 H new ATOM 0 HE1 MET A 34 -38.478 137.670 140.173 1.00 0.00 H new ATOM 0 HE2 MET A 34 -39.242 137.773 138.568 1.00 0.00 H new ATOM 0 HE3 MET A 34 -39.466 136.318 139.568 1.00 0.00 H new ATOM 461 N MET A 35 -35.943 134.174 133.485 1.00 0.00 N ATOM 462 CA MET A 35 -34.903 133.584 132.628 1.00 0.00 C ATOM 463 C MET A 35 -33.538 133.642 133.309 1.00 0.00 C ATOM 464 O MET A 35 -33.253 134.564 134.074 1.00 0.00 O ATOM 465 CB MET A 35 -34.838 134.349 131.304 1.00 0.00 C ATOM 466 CG MET A 35 -36.150 134.154 130.540 1.00 0.00 C ATOM 467 SD MET A 35 -36.005 134.883 128.888 1.00 0.00 S ATOM 468 CE MET A 35 -35.699 136.589 129.410 1.00 0.00 C ATOM 0 H MET A 35 -35.998 135.191 133.435 1.00 0.00 H new ATOM 0 HA MET A 35 -35.158 132.540 132.446 1.00 0.00 H new ATOM 0 HB2 MET A 35 -34.668 135.409 131.492 1.00 0.00 H new ATOM 0 HB3 MET A 35 -33.999 133.992 130.706 1.00 0.00 H new ATOM 0 HG2 MET A 35 -36.382 133.092 130.461 1.00 0.00 H new ATOM 0 HG3 MET A 35 -36.972 134.620 131.083 1.00 0.00 H new ATOM 0 HE1 MET A 35 -36.138 137.275 128.686 1.00 0.00 H new ATOM 0 HE2 MET A 35 -36.150 136.757 130.388 1.00 0.00 H new ATOM 0 HE3 MET A 35 -34.625 136.764 129.471 1.00 0.00 H new ATOM 478 N THR A 36 -32.696 132.645 133.026 1.00 0.00 N ATOM 479 CA THR A 36 -31.354 132.581 133.614 1.00 0.00 C ATOM 480 C THR A 36 -30.357 133.358 132.757 1.00 0.00 C ATOM 481 O THR A 36 -30.572 133.553 131.562 1.00 0.00 O ATOM 482 CB THR A 36 -30.901 131.120 133.720 1.00 0.00 C ATOM 483 OG1 THR A 36 -30.598 130.624 132.423 1.00 0.00 O ATOM 484 CG2 THR A 36 -32.015 130.274 134.341 1.00 0.00 C ATOM 0 H THR A 36 -32.918 131.874 132.396 1.00 0.00 H new ATOM 0 HA THR A 36 -31.391 133.027 134.608 1.00 0.00 H new ATOM 0 HB THR A 36 -30.014 131.064 134.351 1.00 0.00 H new ATOM 0 HG1 THR A 36 -30.307 129.691 132.490 1.00 0.00 H new ATOM 0 HG21 THR A 36 -31.687 129.237 134.414 1.00 0.00 H new ATOM 0 HG22 THR A 36 -32.247 130.652 135.337 1.00 0.00 H new ATOM 0 HG23 THR A 36 -32.906 130.330 133.715 1.00 0.00 H new ATOM 492 N THR A 37 -29.257 133.804 133.383 1.00 0.00 N ATOM 493 CA THR A 37 -28.208 134.574 132.684 1.00 0.00 C ATOM 494 C THR A 37 -26.849 133.901 132.843 1.00 0.00 C ATOM 495 O THR A 37 -26.649 133.090 133.747 1.00 0.00 O ATOM 496 CB THR A 37 -28.135 135.987 133.266 1.00 0.00 C ATOM 497 OG1 THR A 37 -27.430 135.950 134.500 1.00 0.00 O ATOM 498 CG2 THR A 37 -29.550 136.518 133.500 1.00 0.00 C ATOM 0 H THR A 37 -29.068 133.646 134.373 1.00 0.00 H new ATOM 0 HA THR A 37 -28.461 134.617 131.625 1.00 0.00 H new ATOM 0 HB THR A 37 -27.615 136.643 132.568 1.00 0.00 H new ATOM 0 HG1 THR A 37 -27.776 135.219 135.053 1.00 0.00 H new ATOM 0 HG21 THR A 37 -29.497 137.525 133.915 1.00 0.00 H new ATOM 0 HG22 THR A 37 -30.090 136.543 132.554 1.00 0.00 H new ATOM 0 HG23 THR A 37 -30.073 135.865 134.199 1.00 0.00 H new ATOM 506 N VAL A 38 -25.907 134.254 131.959 1.00 0.00 N ATOM 507 CA VAL A 38 -24.545 133.695 131.998 1.00 0.00 C ATOM 508 C VAL A 38 -23.570 134.744 132.523 1.00 0.00 C ATOM 509 O VAL A 38 -23.537 135.874 132.034 1.00 0.00 O ATOM 510 CB VAL A 38 -24.121 133.276 130.588 1.00 0.00 C ATOM 511 CG1 VAL A 38 -22.736 132.628 130.641 1.00 0.00 C ATOM 512 CG2 VAL A 38 -25.131 132.270 130.032 1.00 0.00 C ATOM 0 H VAL A 38 -26.061 134.925 131.206 1.00 0.00 H new ATOM 0 HA VAL A 38 -24.536 132.827 132.658 1.00 0.00 H new ATOM 0 HB VAL A 38 -24.086 134.154 129.944 1.00 0.00 H new ATOM 0 HG11 VAL A 38 -22.435 132.330 129.637 1.00 0.00 H new ATOM 0 HG12 VAL A 38 -22.015 133.342 131.039 1.00 0.00 H new ATOM 0 HG13 VAL A 38 -22.770 131.749 131.285 1.00 0.00 H new ATOM 0 HG21 VAL A 38 -24.831 131.970 129.028 1.00 0.00 H new ATOM 0 HG22 VAL A 38 -25.164 131.393 130.678 1.00 0.00 H new ATOM 0 HG23 VAL A 38 -26.119 132.729 129.994 1.00 0.00 H new ATOM 522 N SER A 39 -22.777 134.365 133.526 1.00 0.00 N ATOM 523 CA SER A 39 -21.800 135.282 134.123 1.00 0.00 C ATOM 524 C SER A 39 -20.467 135.219 133.387 1.00 0.00 C ATOM 525 O SER A 39 -19.617 136.093 133.560 1.00 0.00 O ATOM 526 CB SER A 39 -21.578 134.918 135.592 1.00 0.00 C ATOM 527 OG SER A 39 -20.344 135.472 136.031 1.00 0.00 O ATOM 0 H SER A 39 -22.790 133.434 133.942 1.00 0.00 H new ATOM 0 HA SER A 39 -22.196 136.294 134.044 1.00 0.00 H new ATOM 0 HB2 SER A 39 -22.398 135.299 136.201 1.00 0.00 H new ATOM 0 HB3 SER A 39 -21.567 133.835 135.713 1.00 0.00 H new ATOM 0 HG SER A 39 -19.982 136.058 135.334 1.00 0.00 H new ATOM 533 N GLY A 40 -20.279 134.185 132.570 1.00 0.00 N ATOM 534 CA GLY A 40 -19.034 134.033 131.826 1.00 0.00 C ATOM 535 C GLY A 40 -18.824 132.582 131.421 1.00 0.00 C ATOM 536 O GLY A 40 -19.240 131.660 132.122 1.00 0.00 O ATOM 0 H GLY A 40 -20.965 133.448 132.408 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -19.056 134.664 130.938 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -18.196 134.370 132.436 1.00 0.00 H new ATOM 540 N VAL A 41 -18.170 132.393 130.275 1.00 0.00 N ATOM 541 CA VAL A 41 -17.885 131.055 129.740 1.00 0.00 C ATOM 542 C VAL A 41 -16.383 130.915 129.502 1.00 0.00 C ATOM 543 O VAL A 41 -15.765 131.769 128.867 1.00 0.00 O ATOM 544 CB VAL A 41 -18.652 130.897 128.424 1.00 0.00 C ATOM 545 CG1 VAL A 41 -18.550 129.453 127.904 1.00 0.00 C ATOM 546 CG2 VAL A 41 -20.123 131.271 128.670 1.00 0.00 C ATOM 0 H VAL A 41 -17.824 133.155 129.692 1.00 0.00 H new ATOM 0 HA VAL A 41 -18.197 130.282 130.443 1.00 0.00 H new ATOM 0 HB VAL A 41 -18.220 131.554 127.669 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -19.102 129.363 126.968 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -17.503 129.201 127.733 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -18.972 128.770 128.641 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -20.686 131.164 127.742 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -20.544 130.611 129.428 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -20.183 132.303 129.014 1.00 0.00 H new ATOM 556 N GLU A 42 -15.794 129.834 130.029 1.00 0.00 N ATOM 557 CA GLU A 42 -14.348 129.578 129.889 1.00 0.00 C ATOM 558 C GLU A 42 -14.099 128.209 129.267 1.00 0.00 C ATOM 559 O GLU A 42 -14.775 127.233 129.592 1.00 0.00 O ATOM 560 CB GLU A 42 -13.688 129.635 131.271 1.00 0.00 C ATOM 561 CG GLU A 42 -12.164 129.561 131.125 1.00 0.00 C ATOM 562 CD GLU A 42 -11.511 129.537 132.502 1.00 0.00 C ATOM 563 OE1 GLU A 42 -12.237 129.549 133.481 1.00 0.00 O ATOM 564 OE2 GLU A 42 -10.291 129.506 132.556 1.00 0.00 O1- ATOM 0 H GLU A 42 -16.294 129.119 130.558 1.00 0.00 H new ATOM 0 HA GLU A 42 -13.920 130.340 129.237 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -13.969 130.557 131.780 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -14.043 128.809 131.888 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -11.887 128.667 130.566 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -11.802 130.418 130.556 1.00 0.00 H new ATOM 571 N MET A 43 -13.106 128.145 128.372 1.00 0.00 N ATOM 572 CA MET A 43 -12.731 126.893 127.693 1.00 0.00 C ATOM 573 C MET A 43 -11.302 126.514 128.068 1.00 0.00 C ATOM 574 O MET A 43 -10.441 127.384 128.203 1.00 0.00 O ATOM 575 CB MET A 43 -12.826 127.087 126.180 1.00 0.00 C ATOM 576 CG MET A 43 -14.268 127.438 125.811 1.00 0.00 C ATOM 577 SD MET A 43 -14.443 127.493 124.014 1.00 0.00 S ATOM 578 CE MET A 43 -16.182 127.986 123.994 1.00 0.00 C ATOM 0 H MET A 43 -12.543 128.950 128.098 1.00 0.00 H new ATOM 0 HA MET A 43 -13.408 126.097 128.002 1.00 0.00 H new ATOM 0 HB2 MET A 43 -12.152 127.881 125.860 1.00 0.00 H new ATOM 0 HB3 MET A 43 -12.516 126.178 125.664 1.00 0.00 H new ATOM 0 HG2 MET A 43 -14.951 126.698 126.230 1.00 0.00 H new ATOM 0 HG3 MET A 43 -14.539 128.402 126.242 1.00 0.00 H new ATOM 0 HE1 MET A 43 -16.540 128.016 122.965 1.00 0.00 H new ATOM 0 HE2 MET A 43 -16.771 127.266 124.562 1.00 0.00 H new ATOM 0 HE3 MET A 43 -16.285 128.974 124.443 1.00 0.00 H new ATOM 588 N SER A 44 -11.046 125.220 128.233 1.00 0.00 N ATOM 589 CA SER A 44 -9.711 124.770 128.591 1.00 0.00 C ATOM 590 C SER A 44 -8.779 124.889 127.398 1.00 0.00 C ATOM 591 O SER A 44 -9.206 124.818 126.247 1.00 0.00 O ATOM 592 CB SER A 44 -9.742 123.319 129.073 1.00 0.00 C ATOM 593 OG SER A 44 -10.451 123.247 130.303 1.00 0.00 O ATOM 0 H SER A 44 -11.736 124.476 128.126 1.00 0.00 H new ATOM 0 HA SER A 44 -9.344 125.403 129.399 1.00 0.00 H new ATOM 0 HB2 SER A 44 -10.221 122.686 128.326 1.00 0.00 H new ATOM 0 HB3 SER A 44 -8.726 122.945 129.203 1.00 0.00 H new ATOM 0 HG SER A 44 -11.395 123.460 130.149 1.00 0.00 H new ATOM 599 N ARG A 45 -7.505 125.073 127.689 1.00 0.00 N ATOM 600 CA ARG A 45 -6.496 125.208 126.653 1.00 0.00 C ATOM 601 C ARG A 45 -6.443 123.972 125.758 1.00 0.00 C ATOM 602 O ARG A 45 -6.122 124.068 124.574 1.00 0.00 O ATOM 603 CB ARG A 45 -5.141 125.416 127.312 1.00 0.00 C ATOM 604 CG ARG A 45 -5.126 126.759 128.043 1.00 0.00 C ATOM 605 CD ARG A 45 -3.731 127.013 128.616 1.00 0.00 C ATOM 606 NE ARG A 45 -3.747 128.183 129.486 1.00 0.00 N ATOM 607 CZ ARG A 45 -4.200 128.106 130.734 1.00 0.00 C ATOM 608 NH1 ARG A 45 -4.205 129.167 131.493 1.00 0.00 N1+ ATOM 609 NH2 ARG A 45 -4.640 126.969 131.199 1.00 0.00 N ATOM 0 H ARG A 45 -7.142 125.133 128.640 1.00 0.00 H new ATOM 0 HA ARG A 45 -6.754 126.063 126.027 1.00 0.00 H new ATOM 0 HB2 ARG A 45 -4.939 124.607 128.013 1.00 0.00 H new ATOM 0 HB3 ARG A 45 -4.352 125.391 126.560 1.00 0.00 H new ATOM 0 HG2 ARG A 45 -5.401 127.561 127.358 1.00 0.00 H new ATOM 0 HG3 ARG A 45 -5.865 126.757 128.844 1.00 0.00 H new ATOM 0 HD2 ARG A 45 -3.396 126.140 129.176 1.00 0.00 H new ATOM 0 HD3 ARG A 45 -3.019 127.164 127.805 1.00 0.00 H new ATOM 0 HE ARG A 45 -3.405 129.076 129.131 1.00 0.00 H new ATOM 0 HH11 ARG A 45 -3.861 130.056 131.129 1.00 0.00 H new ATOM 0 HH12 ARG A 45 -4.553 129.108 132.450 1.00 0.00 H new ATOM 0 HH21 ARG A 45 -4.636 126.140 130.605 1.00 0.00 H new ATOM 0 HH22 ARG A 45 -4.987 126.910 132.156 1.00 0.00 H new ATOM 623 N ASP A 46 -6.741 122.807 126.333 1.00 0.00 N ATOM 624 CA ASP A 46 -6.701 121.556 125.574 1.00 0.00 C ATOM 625 C ASP A 46 -7.996 121.337 124.799 1.00 0.00 C ATOM 626 O ASP A 46 -8.122 120.364 124.056 1.00 0.00 O ATOM 627 CB ASP A 46 -6.479 120.381 126.529 1.00 0.00 C ATOM 628 CG ASP A 46 -5.092 120.473 127.156 1.00 0.00 C ATOM 629 OD1 ASP A 46 -4.295 121.257 126.669 1.00 0.00 O ATOM 630 OD2 ASP A 46 -4.847 119.757 128.112 1.00 0.00 O1- ATOM 0 H ASP A 46 -7.010 122.703 127.311 1.00 0.00 H new ATOM 0 HA ASP A 46 -5.879 121.620 124.861 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -7.241 120.387 127.309 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -6.582 119.439 125.990 1.00 0.00 H new ATOM 635 N LEU A 47 -8.960 122.234 124.983 1.00 0.00 N ATOM 636 CA LEU A 47 -10.241 122.115 124.301 1.00 0.00 C ATOM 637 C LEU A 47 -10.878 120.801 124.696 1.00 0.00 C ATOM 638 O LEU A 47 -11.625 120.196 123.927 1.00 0.00 O ATOM 639 CB LEU A 47 -10.052 122.162 122.779 1.00 0.00 C ATOM 640 CG LEU A 47 -9.161 123.349 122.393 1.00 0.00 C ATOM 641 CD1 LEU A 47 -9.001 123.380 120.870 1.00 0.00 C ATOM 642 CD2 LEU A 47 -9.802 124.662 122.870 1.00 0.00 C ATOM 0 H LEU A 47 -8.878 123.046 125.595 1.00 0.00 H new ATOM 0 HA LEU A 47 -10.882 122.948 124.590 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -9.602 121.232 122.432 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -11.021 122.250 122.287 1.00 0.00 H new ATOM 0 HG LEU A 47 -8.185 123.239 122.865 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -8.369 124.222 120.588 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -8.541 122.451 120.534 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -9.980 123.489 120.403 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -9.163 125.501 122.592 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -10.780 124.780 122.403 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -9.918 124.638 123.954 1.00 0.00 H new ATOM 654 N ALA A 48 -10.551 120.360 125.913 1.00 0.00 N ATOM 655 CA ALA A 48 -11.062 119.103 126.460 1.00 0.00 C ATOM 656 C ALA A 48 -12.156 119.360 127.495 1.00 0.00 C ATOM 657 O ALA A 48 -13.222 118.746 127.446 1.00 0.00 O ATOM 658 CB ALA A 48 -9.917 118.334 127.123 1.00 0.00 C ATOM 0 H ALA A 48 -9.927 120.863 126.544 1.00 0.00 H new ATOM 0 HA ALA A 48 -11.485 118.520 125.642 1.00 0.00 H new ATOM 0 HB1 ALA A 48 -10.296 117.397 127.531 1.00 0.00 H new ATOM 0 HB2 ALA A 48 -9.145 118.122 126.383 1.00 0.00 H new ATOM 0 HB3 ALA A 48 -9.493 118.935 127.928 1.00 0.00 H new ATOM 664 N TYR A 49 -11.878 120.263 128.444 1.00 0.00 N ATOM 665 CA TYR A 49 -12.834 120.601 129.518 1.00 0.00 C ATOM 666 C TYR A 49 -13.254 122.066 129.436 1.00 0.00 C ATOM 667 O TYR A 49 -12.456 122.933 129.089 1.00 0.00 O ATOM 668 CB TYR A 49 -12.173 120.353 130.878 1.00 0.00 C ATOM 669 CG TYR A 49 -11.760 118.905 130.987 1.00 0.00 C ATOM 670 CD1 TYR A 49 -10.507 118.496 130.520 1.00 0.00 C ATOM 671 CD2 TYR A 49 -12.631 117.970 131.562 1.00 0.00 C ATOM 672 CE1 TYR A 49 -10.122 117.153 130.626 1.00 0.00 C ATOM 673 CE2 TYR A 49 -12.247 116.629 131.668 1.00 0.00 C ATOM 674 CZ TYR A 49 -10.993 116.220 131.199 1.00 0.00 C ATOM 675 OH TYR A 49 -10.615 114.897 131.304 1.00 0.00 O ATOM 0 H TYR A 49 -10.998 120.776 128.494 1.00 0.00 H new ATOM 0 HA TYR A 49 -13.718 119.975 129.401 1.00 0.00 H new ATOM 0 HB2 TYR A 49 -11.303 120.999 130.993 1.00 0.00 H new ATOM 0 HB3 TYR A 49 -12.866 120.605 131.681 1.00 0.00 H new ATOM 0 HD1 TYR A 49 -9.835 119.216 130.077 1.00 0.00 H new ATOM 0 HD2 TYR A 49 -13.599 118.285 131.923 1.00 0.00 H new ATOM 0 HE1 TYR A 49 -9.154 116.838 130.266 1.00 0.00 H new ATOM 0 HE2 TYR A 49 -12.918 115.909 132.112 1.00 0.00 H new ATOM 0 HH TYR A 49 -11.335 114.384 131.726 1.00 0.00 H new ATOM 685 N ALA A 50 -14.522 122.341 129.768 1.00 0.00 N ATOM 686 CA ALA A 50 -15.059 123.716 129.746 1.00 0.00 C ATOM 687 C ALA A 50 -15.792 124.029 131.052 1.00 0.00 C ATOM 688 O ALA A 50 -16.490 123.177 131.603 1.00 0.00 O ATOM 689 CB ALA A 50 -16.028 123.868 128.575 1.00 0.00 C ATOM 0 H ALA A 50 -15.198 121.633 130.055 1.00 0.00 H new ATOM 0 HA ALA A 50 -14.228 124.412 129.633 1.00 0.00 H new ATOM 0 HB1 ALA A 50 -16.424 124.883 128.560 1.00 0.00 H new ATOM 0 HB2 ALA A 50 -15.503 123.669 127.640 1.00 0.00 H new ATOM 0 HB3 ALA A 50 -16.849 123.160 128.688 1.00 0.00 H new ATOM 695 N LYS A 51 -15.625 125.267 131.541 1.00 0.00 N ATOM 696 CA LYS A 51 -16.269 125.719 132.791 1.00 0.00 C ATOM 697 C LYS A 51 -17.129 126.951 132.530 1.00 0.00 C ATOM 698 O LYS A 51 -16.616 127.997 132.131 1.00 0.00 O ATOM 699 CB LYS A 51 -15.188 126.072 133.817 1.00 0.00 C ATOM 700 CG LYS A 51 -14.369 124.821 134.147 1.00 0.00 C ATOM 701 CD LYS A 51 -13.148 125.209 134.993 1.00 0.00 C ATOM 702 CE LYS A 51 -13.596 125.729 136.364 1.00 0.00 C ATOM 703 NZ LYS A 51 -12.448 125.668 137.312 1.00 0.00 N1+ ATOM 0 H LYS A 51 -15.048 125.978 131.091 1.00 0.00 H new ATOM 0 HA LYS A 51 -16.902 124.917 133.172 1.00 0.00 H new ATOM 0 HB2 LYS A 51 -14.537 126.852 133.422 1.00 0.00 H new ATOM 0 HB3 LYS A 51 -15.647 126.469 134.723 1.00 0.00 H new ATOM 0 HG2 LYS A 51 -14.985 124.104 134.689 1.00 0.00 H new ATOM 0 HG3 LYS A 51 -14.046 124.333 133.227 1.00 0.00 H new ATOM 0 HD2 LYS A 51 -12.495 124.345 135.119 1.00 0.00 H new ATOM 0 HD3 LYS A 51 -12.568 125.975 134.478 1.00 0.00 H new ATOM 0 HE2 LYS A 51 -13.957 126.754 136.277 1.00 0.00 H new ATOM 0 HE3 LYS A 51 -14.425 125.130 136.740 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 -12.748 126.020 138.244 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 -12.124 124.684 137.402 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 -11.670 126.257 136.953 1.00 0.00 H new ATOM 717 N VAL A 52 -18.447 126.832 132.764 1.00 0.00 N ATOM 718 CA VAL A 52 -19.388 127.964 132.557 1.00 0.00 C ATOM 719 C VAL A 52 -20.119 128.311 133.858 1.00 0.00 C ATOM 720 O VAL A 52 -20.583 127.424 134.574 1.00 0.00 O ATOM 721 CB VAL A 52 -20.381 127.630 131.417 1.00 0.00 C ATOM 722 CG1 VAL A 52 -19.634 126.885 130.300 1.00 0.00 C ATOM 723 CG2 VAL A 52 -21.536 126.750 131.915 1.00 0.00 C ATOM 0 H VAL A 52 -18.889 125.974 133.094 1.00 0.00 H new ATOM 0 HA VAL A 52 -18.818 128.845 132.261 1.00 0.00 H new ATOM 0 HB VAL A 52 -20.798 128.566 131.046 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -20.328 126.647 129.494 1.00 0.00 H new ATOM 0 HG12 VAL A 52 -18.833 127.516 129.915 1.00 0.00 H new ATOM 0 HG13 VAL A 52 -19.210 125.963 130.698 1.00 0.00 H new ATOM 0 HG21 VAL A 52 -22.213 126.536 131.088 1.00 0.00 H new ATOM 0 HG22 VAL A 52 -21.137 125.815 132.309 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -22.079 127.273 132.702 1.00 0.00 H new ATOM 733 N TYR A 53 -20.215 129.615 134.158 1.00 0.00 N ATOM 734 CA TYR A 53 -20.891 130.095 135.379 1.00 0.00 C ATOM 735 C TYR A 53 -22.185 130.820 135.017 1.00 0.00 C ATOM 736 O TYR A 53 -22.210 131.628 134.087 1.00 0.00 O ATOM 737 CB TYR A 53 -19.971 131.065 136.125 1.00 0.00 C ATOM 738 CG TYR A 53 -18.676 130.372 136.472 1.00 0.00 C ATOM 739 CD1 TYR A 53 -17.600 130.411 135.577 1.00 0.00 C ATOM 740 CD2 TYR A 53 -18.549 129.695 137.690 1.00 0.00 C ATOM 741 CE1 TYR A 53 -16.397 129.771 135.900 1.00 0.00 C ATOM 742 CE2 TYR A 53 -17.346 129.054 138.013 1.00 0.00 C ATOM 743 CZ TYR A 53 -16.270 129.092 137.118 1.00 0.00 C ATOM 744 OH TYR A 53 -15.085 128.461 137.436 1.00 0.00 O ATOM 0 H TYR A 53 -19.834 130.359 133.573 1.00 0.00 H new ATOM 0 HA TYR A 53 -21.122 129.238 136.011 1.00 0.00 H new ATOM 0 HB2 TYR A 53 -19.772 131.941 135.507 1.00 0.00 H new ATOM 0 HB3 TYR A 53 -20.460 131.420 137.033 1.00 0.00 H new ATOM 0 HD1 TYR A 53 -17.698 130.935 134.638 1.00 0.00 H new ATOM 0 HD2 TYR A 53 -19.378 129.667 138.381 1.00 0.00 H new ATOM 0 HE1 TYR A 53 -15.567 129.801 135.210 1.00 0.00 H new ATOM 0 HE2 TYR A 53 -17.249 128.530 138.953 1.00 0.00 H new ATOM 0 HH TYR A 53 -15.165 128.039 138.317 1.00 0.00 H new ATOM 754 N VAL A 54 -23.268 130.529 135.753 1.00 0.00 N ATOM 755 CA VAL A 54 -24.579 131.160 135.501 1.00 0.00 C ATOM 756 C VAL A 54 -25.220 131.652 136.800 1.00 0.00 C ATOM 757 O VAL A 54 -25.016 131.075 137.869 1.00 0.00 O ATOM 758 CB VAL A 54 -25.513 130.149 134.834 1.00 0.00 C ATOM 759 CG1 VAL A 54 -24.864 129.625 133.551 1.00 0.00 C ATOM 760 CG2 VAL A 54 -25.768 128.982 135.790 1.00 0.00 C ATOM 0 H VAL A 54 -23.266 129.863 136.526 1.00 0.00 H new ATOM 0 HA VAL A 54 -24.420 132.018 134.848 1.00 0.00 H new ATOM 0 HB VAL A 54 -26.459 130.633 134.591 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -25.529 128.904 133.075 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -24.682 130.456 132.870 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -23.918 129.141 133.793 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -26.434 128.261 135.315 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -24.822 128.497 136.033 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -26.230 129.355 136.704 1.00 0.00 H new ATOM 770 N THR A 55 -26.015 132.725 136.682 1.00 0.00 N ATOM 771 CA THR A 55 -26.725 133.318 137.827 1.00 0.00 C ATOM 772 C THR A 55 -28.195 133.540 137.471 1.00 0.00 C ATOM 773 O THR A 55 -28.543 133.661 136.297 1.00 0.00 O ATOM 774 CB THR A 55 -26.085 134.659 138.196 1.00 0.00 C ATOM 775 OG1 THR A 55 -26.490 135.648 137.260 1.00 0.00 O ATOM 776 CG2 THR A 55 -24.563 134.522 138.170 1.00 0.00 C ATOM 0 H THR A 55 -26.184 133.204 135.798 1.00 0.00 H new ATOM 0 HA THR A 55 -26.658 132.637 138.675 1.00 0.00 H new ATOM 0 HB THR A 55 -26.404 134.953 139.196 1.00 0.00 H new ATOM 0 HG1 THR A 55 -26.083 136.508 137.495 1.00 0.00 H new ATOM 0 HG21 THR A 55 -24.107 135.477 138.433 1.00 0.00 H new ATOM 0 HG22 THR A 55 -24.254 133.762 138.888 1.00 0.00 H new ATOM 0 HG23 THR A 55 -24.241 134.229 137.171 1.00 0.00 H new ATOM 784 N PHE A 56 -29.053 133.601 138.491 1.00 0.00 N ATOM 785 CA PHE A 56 -30.483 133.819 138.266 1.00 0.00 C ATOM 786 C PHE A 56 -31.174 134.394 139.508 1.00 0.00 C ATOM 787 O PHE A 56 -30.728 134.197 140.638 1.00 0.00 O ATOM 788 CB PHE A 56 -31.149 132.505 137.832 1.00 0.00 C ATOM 789 CG PHE A 56 -30.633 131.362 138.671 1.00 0.00 C ATOM 790 CD1 PHE A 56 -31.277 131.012 139.860 1.00 0.00 C ATOM 791 CD2 PHE A 56 -29.509 130.642 138.244 1.00 0.00 C ATOM 792 CE1 PHE A 56 -30.800 129.941 140.624 1.00 0.00 C ATOM 793 CE2 PHE A 56 -29.030 129.573 139.009 1.00 0.00 C ATOM 794 CZ PHE A 56 -29.675 129.222 140.200 1.00 0.00 C ATOM 0 H PHE A 56 -28.787 133.504 139.471 1.00 0.00 H new ATOM 0 HA PHE A 56 -30.591 134.555 137.469 1.00 0.00 H new ATOM 0 HB2 PHE A 56 -32.231 132.584 137.937 1.00 0.00 H new ATOM 0 HB3 PHE A 56 -30.944 132.315 136.778 1.00 0.00 H new ATOM 0 HD1 PHE A 56 -32.143 131.568 140.190 1.00 0.00 H new ATOM 0 HD2 PHE A 56 -29.012 130.912 137.324 1.00 0.00 H new ATOM 0 HE1 PHE A 56 -31.300 129.668 141.542 1.00 0.00 H new ATOM 0 HE2 PHE A 56 -28.163 129.019 138.680 1.00 0.00 H new ATOM 0 HZ PHE A 56 -29.306 128.397 140.792 1.00 0.00 H new ATOM 804 N LEU A 57 -32.269 135.116 139.265 1.00 0.00 N ATOM 805 CA LEU A 57 -33.053 135.746 140.330 1.00 0.00 C ATOM 806 C LEU A 57 -33.920 134.731 141.066 1.00 0.00 C ATOM 807 O LEU A 57 -34.475 135.031 142.125 1.00 0.00 O ATOM 808 CB LEU A 57 -33.944 136.845 139.748 1.00 0.00 C ATOM 809 CG LEU A 57 -33.100 137.876 138.985 1.00 0.00 C ATOM 810 CD1 LEU A 57 -34.034 138.962 138.437 1.00 0.00 C ATOM 811 CD2 LEU A 57 -32.045 138.513 139.921 1.00 0.00 C ATOM 0 H LEU A 57 -32.637 135.281 138.328 1.00 0.00 H new ATOM 0 HA LEU A 57 -32.350 136.177 141.043 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -34.683 136.405 139.079 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -34.493 137.338 140.550 1.00 0.00 H new ATOM 0 HG LEU A 57 -32.576 137.383 138.166 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -33.450 139.703 137.892 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -34.764 138.509 137.765 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -34.553 139.446 139.264 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -31.456 139.241 139.363 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -32.548 139.011 140.750 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -31.387 137.736 140.310 1.00 0.00 H new ATOM 823 N ASN A 58 -34.042 133.535 140.509 1.00 0.00 N ATOM 824 CA ASN A 58 -34.856 132.504 141.132 1.00 0.00 C ATOM 825 C ASN A 58 -34.043 131.877 142.241 1.00 0.00 C ATOM 826 O ASN A 58 -34.486 130.960 142.932 1.00 0.00 O ATOM 827 CB ASN A 58 -35.244 131.444 140.100 1.00 0.00 C ATOM 828 CG ASN A 58 -35.967 132.098 138.930 1.00 0.00 C ATOM 829 OD1 ASN A 58 -36.859 132.923 139.133 1.00 0.00 O ATOM 830 ND2 ASN A 58 -35.626 131.788 137.709 1.00 0.00 N ATOM 0 H ASN A 58 -33.593 133.257 139.636 1.00 0.00 H new ATOM 0 HA ASN A 58 -35.772 132.937 141.533 1.00 0.00 H new ATOM 0 HB2 ASN A 58 -34.353 130.927 139.745 1.00 0.00 H new ATOM 0 HB3 ASN A 58 -35.886 130.693 140.561 1.00 0.00 H new ATOM 0 HD21 ASN A 58 -36.098 132.229 136.920 1.00 0.00 H new ATOM 0 HD22 ASN A 58 -34.887 131.105 137.544 1.00 0.00 H new ATOM 837 N ASP A 59 -32.859 132.443 142.430 1.00 0.00 N ATOM 838 CA ASP A 59 -31.973 132.016 143.490 1.00 0.00 C ATOM 839 C ASP A 59 -32.629 132.359 144.810 1.00 0.00 C ATOM 840 O ASP A 59 -32.232 131.873 145.869 1.00 0.00 O ATOM 841 CB ASP A 59 -30.634 132.745 143.377 1.00 0.00 C ATOM 842 CG ASP A 59 -30.845 134.246 143.577 1.00 0.00 C ATOM 843 OD1 ASP A 59 -31.916 134.721 143.236 1.00 0.00 O ATOM 844 OD2 ASP A 59 -29.941 134.895 144.076 1.00 0.00 O1- ATOM 0 H ASP A 59 -32.493 133.203 141.856 1.00 0.00 H new ATOM 0 HA ASP A 59 -31.790 130.944 143.420 1.00 0.00 H new ATOM 0 HB2 ASP A 59 -29.937 132.363 144.123 1.00 0.00 H new ATOM 0 HB3 ASP A 59 -30.189 132.558 142.400 1.00 0.00 H new ATOM 849 N LYS A 60 -33.638 133.222 144.727 1.00 0.00 N ATOM 850 CA LYS A 60 -34.348 133.652 145.916 1.00 0.00 C ATOM 851 C LYS A 60 -35.140 132.491 146.513 1.00 0.00 C ATOM 852 O LYS A 60 -35.181 132.318 147.731 1.00 0.00 O ATOM 853 CB LYS A 60 -35.304 134.788 145.547 1.00 0.00 C ATOM 854 CG LYS A 60 -35.987 135.340 146.802 1.00 0.00 C ATOM 855 CD LYS A 60 -36.988 136.416 146.394 1.00 0.00 C ATOM 856 CE LYS A 60 -37.705 136.928 147.639 1.00 0.00 C ATOM 857 NZ LYS A 60 -36.756 137.726 148.465 1.00 0.00 N1+ ATOM 0 H LYS A 60 -33.976 133.631 143.856 1.00 0.00 H new ATOM 0 HA LYS A 60 -33.626 133.999 146.656 1.00 0.00 H new ATOM 0 HB2 LYS A 60 -34.756 135.584 145.044 1.00 0.00 H new ATOM 0 HB3 LYS A 60 -36.056 134.426 144.846 1.00 0.00 H new ATOM 0 HG2 LYS A 60 -36.495 134.538 147.337 1.00 0.00 H new ATOM 0 HG3 LYS A 60 -35.244 135.756 147.482 1.00 0.00 H new ATOM 0 HD2 LYS A 60 -36.475 137.236 145.892 1.00 0.00 H new ATOM 0 HD3 LYS A 60 -37.709 136.009 145.685 1.00 0.00 H new ATOM 0 HE2 LYS A 60 -38.560 137.541 147.353 1.00 0.00 H new ATOM 0 HE3 LYS A 60 -38.093 136.090 148.219 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 -37.289 138.293 149.155 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 -36.110 137.085 148.968 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 -36.206 138.358 147.849 1.00 0.00 H new ATOM 871 N ASP A 61 -35.750 131.685 145.647 1.00 0.00 N ATOM 872 CA ASP A 61 -36.528 130.520 146.089 1.00 0.00 C ATOM 873 C ASP A 61 -35.642 129.274 146.117 1.00 0.00 C ATOM 874 O ASP A 61 -35.156 128.822 145.081 1.00 0.00 O ATOM 875 CB ASP A 61 -37.709 130.298 145.144 1.00 0.00 C ATOM 876 CG ASP A 61 -38.563 129.134 145.638 1.00 0.00 C ATOM 877 OD1 ASP A 61 -38.280 128.634 146.715 1.00 0.00 O ATOM 878 OD2 ASP A 61 -39.485 128.760 144.932 1.00 0.00 O1- ATOM 0 H ASP A 61 -35.723 131.813 144.635 1.00 0.00 H new ATOM 0 HA ASP A 61 -36.904 130.706 147.095 1.00 0.00 H new ATOM 0 HB2 ASP A 61 -38.313 131.203 145.085 1.00 0.00 H new ATOM 0 HB3 ASP A 61 -37.346 130.091 144.137 1.00 0.00 H new ATOM 883 N GLU A 62 -35.432 128.733 147.313 1.00 0.00 N ATOM 884 CA GLU A 62 -34.594 127.548 147.471 1.00 0.00 C ATOM 885 C GLU A 62 -35.141 126.373 146.666 1.00 0.00 C ATOM 886 O GLU A 62 -34.380 125.564 146.137 1.00 0.00 O ATOM 887 CB GLU A 62 -34.512 127.166 148.956 1.00 0.00 C ATOM 888 CG GLU A 62 -33.495 126.033 149.158 1.00 0.00 C ATOM 889 CD GLU A 62 -34.091 124.687 148.746 1.00 0.00 C ATOM 890 OE1 GLU A 62 -35.300 124.608 148.601 1.00 0.00 O ATOM 891 OE2 GLU A 62 -33.326 123.751 148.581 1.00 0.00 O1- ATOM 0 H GLU A 62 -35.827 129.093 148.182 1.00 0.00 H new ATOM 0 HA GLU A 62 -33.598 127.783 147.096 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -34.221 128.035 149.547 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -35.493 126.852 149.313 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -32.599 126.234 148.571 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -33.189 125.995 150.203 1.00 0.00 H new ATOM 898 N ASP A 63 -36.461 126.290 146.572 1.00 0.00 N ATOM 899 CA ASP A 63 -37.094 125.216 145.824 1.00 0.00 C ATOM 900 C ASP A 63 -36.710 125.328 144.364 1.00 0.00 C ATOM 901 O ASP A 63 -36.467 124.329 143.687 1.00 0.00 O ATOM 902 CB ASP A 63 -38.614 125.296 145.968 1.00 0.00 C ATOM 903 CG ASP A 63 -39.261 124.050 145.372 1.00 0.00 C ATOM 904 OD1 ASP A 63 -38.529 123.158 144.979 1.00 0.00 O ATOM 905 OD2 ASP A 63 -40.479 124.008 145.317 1.00 0.00 O1- ATOM 0 H ASP A 63 -37.110 126.950 147.002 1.00 0.00 H new ATOM 0 HA ASP A 63 -36.756 124.258 146.218 1.00 0.00 H new ATOM 0 HB2 ASP A 63 -38.883 125.388 147.020 1.00 0.00 H new ATOM 0 HB3 ASP A 63 -38.989 126.187 145.464 1.00 0.00 H new ATOM 910 N ALA A 64 -36.650 126.562 143.896 1.00 0.00 N ATOM 911 CA ALA A 64 -36.286 126.827 142.521 1.00 0.00 C ATOM 912 C ALA A 64 -34.839 126.428 142.265 1.00 0.00 C ATOM 913 O ALA A 64 -34.495 125.956 141.183 1.00 0.00 O ATOM 914 CB ALA A 64 -36.467 128.308 142.191 1.00 0.00 C ATOM 0 H ALA A 64 -36.849 127.395 144.450 1.00 0.00 H new ATOM 0 HA ALA A 64 -36.941 126.235 141.882 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -36.188 128.486 141.153 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -37.510 128.589 142.340 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -35.833 128.907 142.845 1.00 0.00 H new ATOM 920 N VAL A 65 -33.994 126.627 143.269 1.00 0.00 N ATOM 921 CA VAL A 65 -32.587 126.287 143.143 1.00 0.00 C ATOM 922 C VAL A 65 -32.427 124.781 143.034 1.00 0.00 C ATOM 923 O VAL A 65 -31.693 124.275 142.187 1.00 0.00 O ATOM 924 CB VAL A 65 -31.825 126.796 144.375 1.00 0.00 C ATOM 925 CG1 VAL A 65 -30.373 126.316 144.328 1.00 0.00 C ATOM 926 CG2 VAL A 65 -31.856 128.328 144.402 1.00 0.00 C ATOM 0 H VAL A 65 -34.258 127.019 144.173 1.00 0.00 H new ATOM 0 HA VAL A 65 -32.184 126.755 142.245 1.00 0.00 H new ATOM 0 HB VAL A 65 -32.302 126.405 145.274 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -29.840 126.682 145.206 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -30.350 125.226 144.318 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -29.893 126.697 143.427 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -31.315 128.688 145.277 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -31.386 128.717 143.499 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -32.890 128.670 144.449 1.00 0.00 H new ATOM 936 N LYS A 66 -33.126 124.075 143.907 1.00 0.00 N ATOM 937 CA LYS A 66 -33.077 122.640 143.929 1.00 0.00 C ATOM 938 C LYS A 66 -33.722 122.047 142.688 1.00 0.00 C ATOM 939 O LYS A 66 -33.173 121.150 142.046 1.00 0.00 O ATOM 940 CB LYS A 66 -33.815 122.156 145.174 1.00 0.00 C ATOM 941 CG LYS A 66 -33.645 120.650 145.331 1.00 0.00 C ATOM 942 CD LYS A 66 -34.436 120.190 146.549 1.00 0.00 C ATOM 943 CE LYS A 66 -34.148 118.719 146.801 1.00 0.00 C ATOM 944 NZ LYS A 66 -34.159 117.981 145.506 1.00 0.00 N1+ ATOM 0 H LYS A 66 -33.737 124.486 144.613 1.00 0.00 H new ATOM 0 HA LYS A 66 -32.036 122.318 143.947 1.00 0.00 H new ATOM 0 HB2 LYS A 66 -33.430 122.667 146.056 1.00 0.00 H new ATOM 0 HB3 LYS A 66 -34.874 122.404 145.098 1.00 0.00 H new ATOM 0 HG2 LYS A 66 -33.996 120.135 144.437 1.00 0.00 H new ATOM 0 HG3 LYS A 66 -32.591 120.400 145.449 1.00 0.00 H new ATOM 0 HD2 LYS A 66 -34.161 120.782 147.422 1.00 0.00 H new ATOM 0 HD3 LYS A 66 -35.503 120.342 146.384 1.00 0.00 H new ATOM 0 HE2 LYS A 66 -33.180 118.605 147.288 1.00 0.00 H new ATOM 0 HE3 LYS A 66 -34.895 118.302 147.476 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 -34.319 116.969 145.684 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 -34.921 118.351 144.902 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 -33.245 118.107 145.027 1.00 0.00 H new ATOM 958 N ALA A 67 -34.906 122.549 142.377 1.00 0.00 N ATOM 959 CA ALA A 67 -35.657 122.071 141.238 1.00 0.00 C ATOM 960 C ALA A 67 -35.020 122.498 139.933 1.00 0.00 C ATOM 961 O ALA A 67 -34.903 121.710 138.994 1.00 0.00 O ATOM 962 CB ALA A 67 -37.091 122.599 141.304 1.00 0.00 C ATOM 0 H ALA A 67 -35.366 123.292 142.904 1.00 0.00 H new ATOM 0 HA ALA A 67 -35.660 120.982 141.273 1.00 0.00 H new ATOM 0 HB1 ALA A 67 -37.652 122.236 140.443 1.00 0.00 H new ATOM 0 HB2 ALA A 67 -37.566 122.249 142.221 1.00 0.00 H new ATOM 0 HB3 ALA A 67 -37.078 123.689 141.295 1.00 0.00 H new ATOM 968 N GLY A 68 -34.637 123.758 139.874 1.00 0.00 N ATOM 969 CA GLY A 68 -34.042 124.298 138.670 1.00 0.00 C ATOM 970 C GLY A 68 -32.737 123.596 138.317 1.00 0.00 C ATOM 971 O GLY A 68 -32.558 123.131 137.191 1.00 0.00 O ATOM 0 H GLY A 68 -34.727 124.423 140.642 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -34.744 124.198 137.842 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -33.856 125.364 138.803 1.00 0.00 H new ATOM 975 N ILE A 69 -31.828 123.515 139.281 1.00 0.00 N ATOM 976 CA ILE A 69 -30.543 122.864 139.039 1.00 0.00 C ATOM 977 C ILE A 69 -30.734 121.400 138.666 1.00 0.00 C ATOM 978 O ILE A 69 -29.991 120.860 137.850 1.00 0.00 O ATOM 979 CB ILE A 69 -29.636 122.985 140.270 1.00 0.00 C ATOM 980 CG1 ILE A 69 -29.309 124.465 140.505 1.00 0.00 C ATOM 981 CG2 ILE A 69 -28.336 122.205 140.030 1.00 0.00 C ATOM 982 CD1 ILE A 69 -28.589 124.635 141.846 1.00 0.00 C ATOM 0 H ILE A 69 -31.951 123.885 140.224 1.00 0.00 H new ATOM 0 HA ILE A 69 -30.064 123.370 138.201 1.00 0.00 H new ATOM 0 HB ILE A 69 -30.144 122.576 141.143 1.00 0.00 H new ATOM 0 HG12 ILE A 69 -28.682 124.841 139.696 1.00 0.00 H new ATOM 0 HG13 ILE A 69 -30.226 125.054 140.498 1.00 0.00 H new ATOM 0 HG21 ILE A 69 -27.693 122.292 140.906 1.00 0.00 H new ATOM 0 HG22 ILE A 69 -28.569 121.155 139.854 1.00 0.00 H new ATOM 0 HG23 ILE A 69 -27.822 122.614 139.160 1.00 0.00 H new ATOM 0 HD11 ILE A 69 -28.360 125.689 142.005 1.00 0.00 H new ATOM 0 HD12 ILE A 69 -29.230 124.277 142.651 1.00 0.00 H new ATOM 0 HD13 ILE A 69 -27.663 124.060 141.837 1.00 0.00 H new ATOM 994 N LYS A 70 -31.734 120.768 139.256 1.00 0.00 N ATOM 995 CA LYS A 70 -32.017 119.384 138.969 1.00 0.00 C ATOM 996 C LYS A 70 -32.430 119.249 137.521 1.00 0.00 C ATOM 997 O LYS A 70 -32.026 118.320 136.825 1.00 0.00 O ATOM 998 CB LYS A 70 -33.135 118.898 139.882 1.00 0.00 C ATOM 999 CG LYS A 70 -33.331 117.400 139.701 1.00 0.00 C ATOM 1000 CD LYS A 70 -34.486 116.941 140.584 1.00 0.00 C ATOM 1001 CE LYS A 70 -34.532 115.420 140.594 1.00 0.00 C ATOM 1002 NZ LYS A 70 -35.743 114.964 141.333 1.00 0.00 N1+ ATOM 0 H LYS A 70 -32.361 121.197 139.937 1.00 0.00 H new ATOM 0 HA LYS A 70 -31.127 118.779 139.144 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -32.891 119.120 140.921 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -34.061 119.426 139.652 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -33.542 117.171 138.656 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -32.419 116.866 139.967 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -34.358 117.320 141.598 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -35.428 117.343 140.210 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -34.551 115.039 139.573 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -33.634 115.022 141.066 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -35.775 113.925 141.340 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -35.706 115.316 142.311 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -36.595 115.333 140.865 1.00 0.00 H new ATOM 1016 N ALA A 71 -33.229 120.203 137.069 1.00 0.00 N ATOM 1017 CA ALA A 71 -33.681 120.199 135.697 1.00 0.00 C ATOM 1018 C ALA A 71 -32.501 120.445 134.773 1.00 0.00 C ATOM 1019 O ALA A 71 -32.364 119.815 133.726 1.00 0.00 O ATOM 1020 CB ALA A 71 -34.740 121.286 135.490 1.00 0.00 C ATOM 0 H ALA A 71 -33.573 120.982 137.631 1.00 0.00 H new ATOM 0 HA ALA A 71 -34.123 119.229 135.468 1.00 0.00 H new ATOM 0 HB1 ALA A 71 -35.075 121.275 134.453 1.00 0.00 H new ATOM 0 HB2 ALA A 71 -35.589 121.097 136.147 1.00 0.00 H new ATOM 0 HB3 ALA A 71 -34.311 122.261 135.723 1.00 0.00 H new ATOM 1026 N LEU A 72 -31.647 121.365 135.193 1.00 0.00 N ATOM 1027 CA LEU A 72 -30.456 121.714 134.433 1.00 0.00 C ATOM 1028 C LEU A 72 -29.473 120.550 134.424 1.00 0.00 C ATOM 1029 O LEU A 72 -28.790 120.303 133.430 1.00 0.00 O ATOM 1030 CB LEU A 72 -29.804 122.959 135.063 1.00 0.00 C ATOM 1031 CG LEU A 72 -28.665 123.535 134.153 1.00 0.00 C ATOM 1032 CD1 LEU A 72 -28.567 125.060 134.320 1.00 0.00 C ATOM 1033 CD2 LEU A 72 -27.295 122.933 134.526 1.00 0.00 C ATOM 0 H LEU A 72 -31.758 121.887 136.062 1.00 0.00 H new ATOM 0 HA LEU A 72 -30.735 121.932 133.402 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -30.562 123.725 135.226 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -29.395 122.702 136.040 1.00 0.00 H new ATOM 0 HG LEU A 72 -28.914 123.276 133.124 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -27.772 125.446 133.682 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -29.514 125.519 134.036 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -28.345 125.299 135.360 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -26.525 123.351 133.878 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -27.064 123.171 135.564 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -27.327 121.851 134.400 1.00 0.00 H new ATOM 1045 N GLN A 73 -29.404 119.849 135.548 1.00 0.00 N ATOM 1046 CA GLN A 73 -28.497 118.722 135.685 1.00 0.00 C ATOM 1047 C GLN A 73 -28.937 117.581 134.793 1.00 0.00 C ATOM 1048 O GLN A 73 -28.129 116.970 134.094 1.00 0.00 O ATOM 1049 CB GLN A 73 -28.460 118.257 137.145 1.00 0.00 C ATOM 1050 CG GLN A 73 -27.336 117.234 137.341 1.00 0.00 C ATOM 1051 CD GLN A 73 -25.980 117.922 137.227 1.00 0.00 C ATOM 1052 OE1 GLN A 73 -25.783 119.002 137.784 1.00 0.00 O ATOM 1053 NE2 GLN A 73 -25.029 117.358 136.535 1.00 0.00 N ATOM 0 H GLN A 73 -29.966 120.043 136.377 1.00 0.00 H new ATOM 0 HA GLN A 73 -27.498 119.038 135.383 1.00 0.00 H new ATOM 0 HB2 GLN A 73 -28.304 119.111 137.804 1.00 0.00 H new ATOM 0 HB3 GLN A 73 -29.418 117.814 137.419 1.00 0.00 H new ATOM 0 HG2 GLN A 73 -27.431 116.759 138.317 1.00 0.00 H new ATOM 0 HG3 GLN A 73 -27.417 116.445 136.594 1.00 0.00 H new ATOM 0 HE21 GLN A 73 -25.195 116.463 136.075 1.00 0.00 H new ATOM 0 HE22 GLN A 73 -24.119 117.812 136.454 1.00 0.00 H new ATOM 1062 N GLU A 74 -30.229 117.308 134.817 1.00 0.00 N ATOM 1063 CA GLU A 74 -30.779 116.246 133.999 1.00 0.00 C ATOM 1064 C GLU A 74 -30.746 116.640 132.536 1.00 0.00 C ATOM 1065 O GLU A 74 -30.495 115.819 131.655 1.00 0.00 O ATOM 1066 CB GLU A 74 -32.221 115.975 134.411 1.00 0.00 C ATOM 1067 CG GLU A 74 -32.259 115.378 135.819 1.00 0.00 C ATOM 1068 CD GLU A 74 -31.639 113.984 135.821 1.00 0.00 C ATOM 1069 OE1 GLU A 74 -31.494 113.421 134.748 1.00 0.00 O ATOM 1070 OE2 GLU A 74 -31.318 113.501 136.894 1.00 0.00 O1- ATOM 0 H GLU A 74 -30.912 117.804 135.390 1.00 0.00 H new ATOM 0 HA GLU A 74 -30.179 115.348 134.143 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -32.796 116.901 134.384 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -32.687 115.289 133.704 1.00 0.00 H new ATOM 0 HG2 GLU A 74 -31.718 116.025 136.510 1.00 0.00 H new ATOM 0 HG3 GLU A 74 -33.289 115.326 136.171 1.00 0.00 H new ATOM 1077 N ALA A 75 -30.995 117.911 132.302 1.00 0.00 N ATOM 1078 CA ALA A 75 -30.994 118.455 130.958 1.00 0.00 C ATOM 1079 C ALA A 75 -29.565 118.649 130.475 1.00 0.00 C ATOM 1080 O ALA A 75 -29.328 118.984 129.318 1.00 0.00 O ATOM 1081 CB ALA A 75 -31.719 119.799 130.951 1.00 0.00 C ATOM 0 H ALA A 75 -31.203 118.593 133.031 1.00 0.00 H new ATOM 0 HA ALA A 75 -31.505 117.759 130.293 1.00 0.00 H new ATOM 0 HB1 ALA A 75 -31.718 120.208 129.941 1.00 0.00 H new ATOM 0 HB2 ALA A 75 -32.747 119.660 131.285 1.00 0.00 H new ATOM 0 HB3 ALA A 75 -31.210 120.490 131.622 1.00 0.00 H new ATOM 1087 N SER A 76 -28.620 118.465 131.386 1.00 0.00 N ATOM 1088 CA SER A 76 -27.210 118.661 131.059 1.00 0.00 C ATOM 1089 C SER A 76 -26.767 117.821 129.862 1.00 0.00 C ATOM 1090 O SER A 76 -26.135 118.336 128.939 1.00 0.00 O ATOM 1091 CB SER A 76 -26.348 118.306 132.269 1.00 0.00 C ATOM 1092 OG SER A 76 -25.004 118.700 132.021 1.00 0.00 O ATOM 0 H SER A 76 -28.799 118.183 132.350 1.00 0.00 H new ATOM 0 HA SER A 76 -27.083 119.710 130.793 1.00 0.00 H new ATOM 0 HB2 SER A 76 -26.727 118.807 133.160 1.00 0.00 H new ATOM 0 HB3 SER A 76 -26.395 117.234 132.462 1.00 0.00 H new ATOM 0 HG SER A 76 -24.449 118.475 132.796 1.00 0.00 H new ATOM 1098 N GLY A 77 -27.096 116.535 129.874 1.00 0.00 N ATOM 1099 CA GLY A 77 -26.698 115.659 128.778 1.00 0.00 C ATOM 1100 C GLY A 77 -27.244 116.162 127.449 1.00 0.00 C ATOM 1101 O GLY A 77 -26.569 116.093 126.422 1.00 0.00 O ATOM 0 H GLY A 77 -27.628 116.081 130.616 1.00 0.00 H new ATOM 0 HA2 GLY A 77 -25.611 115.602 128.730 1.00 0.00 H new ATOM 0 HA3 GLY A 77 -27.062 114.649 128.965 1.00 0.00 H new ATOM 1105 N PHE A 78 -28.464 116.673 127.479 1.00 0.00 N ATOM 1106 CA PHE A 78 -29.092 117.193 126.273 1.00 0.00 C ATOM 1107 C PHE A 78 -28.355 118.422 125.750 1.00 0.00 C ATOM 1108 O PHE A 78 -28.154 118.566 124.545 1.00 0.00 O ATOM 1109 CB PHE A 78 -30.536 117.571 126.582 1.00 0.00 C ATOM 1110 CG PHE A 78 -31.350 116.318 126.809 1.00 0.00 C ATOM 1111 CD1 PHE A 78 -31.333 115.687 128.059 1.00 0.00 C ATOM 1112 CD2 PHE A 78 -32.124 115.790 125.769 1.00 0.00 C ATOM 1113 CE1 PHE A 78 -32.091 114.529 128.268 1.00 0.00 C ATOM 1114 CE2 PHE A 78 -32.882 114.631 125.978 1.00 0.00 C ATOM 1115 CZ PHE A 78 -32.865 114.001 127.228 1.00 0.00 C ATOM 0 H PHE A 78 -29.038 116.739 128.320 1.00 0.00 H new ATOM 0 HA PHE A 78 -29.056 116.418 125.507 1.00 0.00 H new ATOM 0 HB2 PHE A 78 -30.575 118.207 127.466 1.00 0.00 H new ATOM 0 HB3 PHE A 78 -30.957 118.146 125.757 1.00 0.00 H new ATOM 0 HD1 PHE A 78 -30.735 116.094 128.861 1.00 0.00 H new ATOM 0 HD2 PHE A 78 -32.137 116.277 124.805 1.00 0.00 H new ATOM 0 HE1 PHE A 78 -32.079 114.043 129.232 1.00 0.00 H new ATOM 0 HE2 PHE A 78 -33.479 114.224 125.176 1.00 0.00 H new ATOM 0 HZ PHE A 78 -33.449 113.107 127.390 1.00 0.00 H new ATOM 1125 N ILE A 79 -27.961 119.309 126.658 1.00 0.00 N ATOM 1126 CA ILE A 79 -27.256 120.521 126.261 1.00 0.00 C ATOM 1127 C ILE A 79 -25.945 120.175 125.581 1.00 0.00 C ATOM 1128 O ILE A 79 -25.564 120.773 124.576 1.00 0.00 O ATOM 1129 CB ILE A 79 -26.973 121.385 127.499 1.00 0.00 C ATOM 1130 CG1 ILE A 79 -28.303 121.862 128.101 1.00 0.00 C ATOM 1131 CG2 ILE A 79 -26.096 122.596 127.118 1.00 0.00 C ATOM 1132 CD1 ILE A 79 -28.057 122.509 129.470 1.00 0.00 C ATOM 0 H ILE A 79 -28.116 119.213 127.662 1.00 0.00 H new ATOM 0 HA ILE A 79 -27.883 121.073 125.561 1.00 0.00 H new ATOM 0 HB ILE A 79 -26.435 120.790 128.237 1.00 0.00 H new ATOM 0 HG12 ILE A 79 -28.779 122.578 127.431 1.00 0.00 H new ATOM 0 HG13 ILE A 79 -28.987 121.020 128.205 1.00 0.00 H new ATOM 0 HG21 ILE A 79 -25.904 123.199 128.005 1.00 0.00 H new ATOM 0 HG22 ILE A 79 -25.150 122.245 126.706 1.00 0.00 H new ATOM 0 HG23 ILE A 79 -26.614 123.201 126.374 1.00 0.00 H new ATOM 0 HD11 ILE A 79 -29.005 122.844 129.890 1.00 0.00 H new ATOM 0 HD12 ILE A 79 -27.601 121.780 130.140 1.00 0.00 H new ATOM 0 HD13 ILE A 79 -27.389 123.363 129.354 1.00 0.00 H new ATOM 1144 N ARG A 80 -25.264 119.209 126.160 1.00 0.00 N ATOM 1145 CA ARG A 80 -23.971 118.766 125.642 1.00 0.00 C ATOM 1146 C ARG A 80 -24.105 118.183 124.249 1.00 0.00 C ATOM 1147 O ARG A 80 -23.330 118.498 123.344 1.00 0.00 O ATOM 1148 CB ARG A 80 -23.389 117.704 126.576 1.00 0.00 C ATOM 1149 CG ARG A 80 -21.959 117.354 126.149 1.00 0.00 C ATOM 1150 CD ARG A 80 -21.408 116.257 127.061 1.00 0.00 C ATOM 1151 NE ARG A 80 -20.022 115.959 126.706 1.00 0.00 N ATOM 1152 CZ ARG A 80 -19.476 114.775 126.972 1.00 0.00 C ATOM 1153 NH1 ARG A 80 -18.238 114.537 126.634 1.00 0.00 N1+ ATOM 1154 NH2 ARG A 80 -20.178 113.851 127.571 1.00 0.00 N ATOM 0 H ARG A 80 -25.579 118.710 126.992 1.00 0.00 H new ATOM 0 HA ARG A 80 -23.310 119.631 125.590 1.00 0.00 H new ATOM 0 HB2 ARG A 80 -23.391 118.071 127.602 1.00 0.00 H new ATOM 0 HB3 ARG A 80 -24.012 116.810 126.556 1.00 0.00 H new ATOM 0 HG2 ARG A 80 -21.950 117.018 125.112 1.00 0.00 H new ATOM 0 HG3 ARG A 80 -21.325 118.239 126.203 1.00 0.00 H new ATOM 0 HD2 ARG A 80 -21.465 116.576 128.102 1.00 0.00 H new ATOM 0 HD3 ARG A 80 -22.017 115.357 126.970 1.00 0.00 H new ATOM 0 HE ARG A 80 -19.461 116.674 126.244 1.00 0.00 H new ATOM 0 HH11 ARG A 80 -17.689 115.258 126.166 1.00 0.00 H new ATOM 0 HH12 ARG A 80 -17.819 113.630 126.838 1.00 0.00 H new ATOM 0 HH21 ARG A 80 -21.146 114.037 127.835 1.00 0.00 H new ATOM 0 HH22 ARG A 80 -19.759 112.944 127.775 1.00 0.00 H new ATOM 1168 N SER A 81 -25.091 117.326 124.097 1.00 0.00 N ATOM 1169 CA SER A 81 -25.348 116.674 122.832 1.00 0.00 C ATOM 1170 C SER A 81 -25.885 117.666 121.829 1.00 0.00 C ATOM 1171 O SER A 81 -25.586 117.608 120.641 1.00 0.00 O ATOM 1172 CB SER A 81 -26.380 115.582 123.049 1.00 0.00 C ATOM 1173 OG SER A 81 -26.487 114.788 121.875 1.00 0.00 O ATOM 0 H SER A 81 -25.734 117.063 124.843 1.00 0.00 H new ATOM 0 HA SER A 81 -24.418 116.253 122.449 1.00 0.00 H new ATOM 0 HB2 SER A 81 -26.093 114.959 123.896 1.00 0.00 H new ATOM 0 HB3 SER A 81 -27.347 116.024 123.291 1.00 0.00 H new ATOM 0 HG SER A 81 -27.152 114.083 122.017 1.00 0.00 H new ATOM 1179 N LEU A 82 -26.694 118.570 122.331 1.00 0.00 N ATOM 1180 CA LEU A 82 -27.302 119.572 121.498 1.00 0.00 C ATOM 1181 C LEU A 82 -26.251 120.515 120.953 1.00 0.00 C ATOM 1182 O LEU A 82 -26.339 120.981 119.816 1.00 0.00 O ATOM 1183 CB LEU A 82 -28.353 120.340 122.305 1.00 0.00 C ATOM 1184 CG LEU A 82 -29.042 121.408 121.433 1.00 0.00 C ATOM 1185 CD1 LEU A 82 -29.730 120.755 120.211 1.00 0.00 C ATOM 1186 CD2 LEU A 82 -30.089 122.136 122.287 1.00 0.00 C ATOM 0 H LEU A 82 -26.945 118.629 123.318 1.00 0.00 H new ATOM 0 HA LEU A 82 -27.790 119.087 120.653 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -29.098 119.646 122.694 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -27.881 120.816 123.165 1.00 0.00 H new ATOM 0 HG LEU A 82 -28.295 122.112 121.068 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -30.210 121.526 119.609 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -28.985 120.236 119.608 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -30.480 120.042 120.554 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -30.586 122.896 121.684 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -30.827 121.419 122.648 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -29.599 122.611 123.137 1.00 0.00 H new ATOM 1198 N LEU A 83 -25.252 120.781 121.772 1.00 0.00 N ATOM 1199 CA LEU A 83 -24.174 121.661 121.369 1.00 0.00 C ATOM 1200 C LEU A 83 -23.349 121.004 120.279 1.00 0.00 C ATOM 1201 O LEU A 83 -23.070 121.595 119.237 1.00 0.00 O ATOM 1202 CB LEU A 83 -23.279 121.949 122.586 1.00 0.00 C ATOM 1203 CG LEU A 83 -23.918 123.044 123.484 1.00 0.00 C ATOM 1204 CD1 LEU A 83 -23.401 122.894 124.915 1.00 0.00 C ATOM 1205 CD2 LEU A 83 -23.525 124.440 122.972 1.00 0.00 C ATOM 0 H LEU A 83 -25.165 120.403 122.715 1.00 0.00 H new ATOM 0 HA LEU A 83 -24.591 122.592 120.986 1.00 0.00 H new ATOM 0 HB2 LEU A 83 -23.135 121.036 123.163 1.00 0.00 H new ATOM 0 HB3 LEU A 83 -22.294 122.274 122.252 1.00 0.00 H new ATOM 0 HG LEU A 83 -25.002 122.931 123.457 1.00 0.00 H new ATOM 0 HD11 LEU A 83 -23.849 123.662 125.546 1.00 0.00 H new ATOM 0 HD12 LEU A 83 -23.669 121.909 125.297 1.00 0.00 H new ATOM 0 HD13 LEU A 83 -22.317 123.004 124.924 1.00 0.00 H new ATOM 0 HD21 LEU A 83 -23.977 125.201 123.607 1.00 0.00 H new ATOM 0 HD22 LEU A 83 -22.440 124.545 122.997 1.00 0.00 H new ATOM 0 HD23 LEU A 83 -23.878 124.565 121.948 1.00 0.00 H new ATOM 1217 N GLY A 84 -22.957 119.776 120.552 1.00 0.00 N ATOM 1218 CA GLY A 84 -22.148 119.027 119.613 1.00 0.00 C ATOM 1219 C GLY A 84 -22.891 118.798 118.306 1.00 0.00 C ATOM 1220 O GLY A 84 -22.327 118.950 117.225 1.00 0.00 O ATOM 0 H GLY A 84 -23.184 119.278 121.412 1.00 0.00 H new ATOM 0 HA2 GLY A 84 -21.221 119.566 119.418 1.00 0.00 H new ATOM 0 HA3 GLY A 84 -21.873 118.067 120.051 1.00 0.00 H new ATOM 1224 N LYS A 85 -24.159 118.438 118.420 1.00 0.00 N ATOM 1225 CA LYS A 85 -24.990 118.196 117.239 1.00 0.00 C ATOM 1226 C LYS A 85 -25.312 119.488 116.503 1.00 0.00 C ATOM 1227 O LYS A 85 -25.311 119.538 115.274 1.00 0.00 O ATOM 1228 CB LYS A 85 -26.290 117.497 117.641 1.00 0.00 C ATOM 1229 CG LYS A 85 -25.988 116.057 118.054 1.00 0.00 C ATOM 1230 CD LYS A 85 -27.295 115.344 118.408 1.00 0.00 C ATOM 1231 CE LYS A 85 -26.985 113.936 118.922 1.00 0.00 C ATOM 1232 NZ LYS A 85 -26.524 113.085 117.789 1.00 0.00 N1+ ATOM 0 H LYS A 85 -24.639 118.306 119.310 1.00 0.00 H new ATOM 0 HA LYS A 85 -24.422 117.555 116.565 1.00 0.00 H new ATOM 0 HB2 LYS A 85 -26.763 118.031 118.465 1.00 0.00 H new ATOM 0 HB3 LYS A 85 -26.994 117.508 116.809 1.00 0.00 H new ATOM 0 HG2 LYS A 85 -25.483 115.533 117.243 1.00 0.00 H new ATOM 0 HG3 LYS A 85 -25.312 116.047 118.909 1.00 0.00 H new ATOM 0 HD2 LYS A 85 -27.836 115.909 119.167 1.00 0.00 H new ATOM 0 HD3 LYS A 85 -27.941 115.289 117.531 1.00 0.00 H new ATOM 0 HE2 LYS A 85 -26.217 113.980 119.694 1.00 0.00 H new ATOM 0 HE3 LYS A 85 -27.873 113.501 119.380 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 -26.492 112.091 118.092 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 -27.184 113.182 116.991 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 -25.574 113.387 117.492 1.00 0.00 H new ATOM 1246 N ALA A 86 -25.600 120.526 117.270 1.00 0.00 N ATOM 1247 CA ALA A 86 -25.942 121.823 116.693 1.00 0.00 C ATOM 1248 C ALA A 86 -24.776 122.362 115.881 1.00 0.00 C ATOM 1249 O ALA A 86 -24.956 122.873 114.776 1.00 0.00 O ATOM 1250 CB ALA A 86 -26.296 122.813 117.803 1.00 0.00 C ATOM 0 H ALA A 86 -25.605 120.500 118.290 1.00 0.00 H new ATOM 0 HA ALA A 86 -26.803 121.696 116.037 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -26.550 123.777 117.363 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -27.149 122.436 118.368 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -25.442 122.932 118.470 1.00 0.00 H new ATOM 1256 N MET A 87 -23.571 122.221 116.432 1.00 0.00 N ATOM 1257 CA MET A 87 -22.353 122.668 115.756 1.00 0.00 C ATOM 1258 C MET A 87 -21.757 121.495 114.987 1.00 0.00 C ATOM 1259 O MET A 87 -20.824 121.655 114.200 1.00 0.00 O ATOM 1260 CB MET A 87 -21.351 123.195 116.787 1.00 0.00 C ATOM 1261 CG MET A 87 -21.961 124.399 117.507 1.00 0.00 C ATOM 1262 SD MET A 87 -20.725 125.156 118.592 1.00 0.00 S ATOM 1263 CE MET A 87 -21.072 124.177 120.074 1.00 0.00 C ATOM 0 H MET A 87 -23.412 121.800 117.347 1.00 0.00 H new ATOM 0 HA MET A 87 -22.588 123.474 115.061 1.00 0.00 H new ATOM 0 HB2 MET A 87 -21.104 122.413 117.505 1.00 0.00 H new ATOM 0 HB3 MET A 87 -20.421 123.482 116.295 1.00 0.00 H new ATOM 0 HG2 MET A 87 -22.315 125.129 116.779 1.00 0.00 H new ATOM 0 HG3 MET A 87 -22.827 124.085 118.090 1.00 0.00 H new ATOM 0 HE1 MET A 87 -20.407 124.489 120.880 1.00 0.00 H new ATOM 0 HE2 MET A 87 -22.107 124.331 120.378 1.00 0.00 H new ATOM 0 HE3 MET A 87 -20.910 123.121 119.858 1.00 0.00 H new ATOM 1273 N ARG A 88 -22.323 120.313 115.226 1.00 0.00 N ATOM 1274 CA ARG A 88 -21.871 119.097 114.562 1.00 0.00 C ATOM 1275 C ARG A 88 -20.375 118.885 114.772 1.00 0.00 C ATOM 1276 O ARG A 88 -19.673 118.408 113.881 1.00 0.00 O ATOM 1277 CB ARG A 88 -22.179 119.184 113.070 1.00 0.00 C ATOM 1278 CG ARG A 88 -23.695 119.229 112.865 1.00 0.00 C ATOM 1279 CD ARG A 88 -24.008 119.213 111.368 1.00 0.00 C ATOM 1280 NE ARG A 88 -25.428 119.463 111.147 1.00 0.00 N ATOM 1281 CZ ARG A 88 -26.339 118.530 111.404 1.00 0.00 C ATOM 1282 NH1 ARG A 88 -27.603 118.777 111.199 1.00 0.00 N1+ ATOM 1283 NH2 ARG A 88 -25.967 117.366 111.864 1.00 0.00 N ATOM 0 H ARG A 88 -23.097 120.174 115.876 1.00 0.00 H new ATOM 0 HA ARG A 88 -22.400 118.248 114.996 1.00 0.00 H new ATOM 0 HB2 ARG A 88 -21.717 120.074 112.643 1.00 0.00 H new ATOM 0 HB3 ARG A 88 -21.756 118.325 112.550 1.00 0.00 H new ATOM 0 HG2 ARG A 88 -24.164 118.376 113.355 1.00 0.00 H new ATOM 0 HG3 ARG A 88 -24.108 120.127 113.324 1.00 0.00 H new ATOM 0 HD2 ARG A 88 -23.414 119.971 110.857 1.00 0.00 H new ATOM 0 HD3 ARG A 88 -23.730 118.249 110.941 1.00 0.00 H new ATOM 0 HE ARG A 88 -25.727 120.370 110.789 1.00 0.00 H new ATOM 0 HH11 ARG A 88 -27.893 119.687 110.841 1.00 0.00 H new ATOM 0 HH12 ARG A 88 -28.301 118.060 111.397 1.00 0.00 H new ATOM 0 HH21 ARG A 88 -24.978 117.174 112.026 1.00 0.00 H new ATOM 0 HH22 ARG A 88 -26.665 116.649 112.062 1.00 0.00 H new ATOM 1297 N LEU A 89 -19.893 119.249 115.963 1.00 0.00 N ATOM 1298 CA LEU A 89 -18.472 119.108 116.313 1.00 0.00 C ATOM 1299 C LEU A 89 -18.222 117.863 117.153 1.00 0.00 C ATOM 1300 O LEU A 89 -19.004 117.530 118.044 1.00 0.00 O ATOM 1301 CB LEU A 89 -18.024 120.330 117.113 1.00 0.00 C ATOM 1302 CG LEU A 89 -18.118 121.598 116.253 1.00 0.00 C ATOM 1303 CD1 LEU A 89 -17.903 122.819 117.157 1.00 0.00 C ATOM 1304 CD2 LEU A 89 -17.050 121.578 115.129 1.00 0.00 C ATOM 0 H LEU A 89 -20.467 119.646 116.707 1.00 0.00 H new ATOM 0 HA LEU A 89 -17.908 119.021 115.385 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -18.646 120.439 118.001 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -16.999 120.191 117.457 1.00 0.00 H new ATOM 0 HG LEU A 89 -19.101 121.646 115.784 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -17.967 123.729 116.561 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -18.670 122.838 117.931 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -16.919 122.758 117.622 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -17.134 122.486 114.531 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -16.056 121.526 115.573 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -17.209 120.708 114.492 1.00 0.00 H new ATOM 1316 N ARG A 90 -17.099 117.198 116.876 1.00 0.00 N ATOM 1317 CA ARG A 90 -16.695 116.001 117.618 1.00 0.00 C ATOM 1318 C ARG A 90 -15.685 116.391 118.692 1.00 0.00 C ATOM 1319 O ARG A 90 -15.349 115.592 119.567 1.00 0.00 O ATOM 1320 CB ARG A 90 -16.059 114.990 116.661 1.00 0.00 C ATOM 1321 CG ARG A 90 -17.092 114.548 115.623 1.00 0.00 C ATOM 1322 CD ARG A 90 -16.495 113.451 114.741 1.00 0.00 C ATOM 1323 NE ARG A 90 -15.271 113.926 114.105 1.00 0.00 N ATOM 1324 CZ ARG A 90 -14.444 113.084 113.492 1.00 0.00 C ATOM 1325 NH1 ARG A 90 -13.356 113.534 112.929 1.00 0.00 N1+ ATOM 1326 NH2 ARG A 90 -14.720 111.810 113.455 1.00 0.00 N ATOM 0 H ARG A 90 -16.449 117.470 116.138 1.00 0.00 H new ATOM 0 HA ARG A 90 -17.571 115.551 118.085 1.00 0.00 H new ATOM 0 HB2 ARG A 90 -15.197 115.436 116.165 1.00 0.00 H new ATOM 0 HB3 ARG A 90 -15.695 114.126 117.217 1.00 0.00 H new ATOM 0 HG2 ARG A 90 -17.989 114.180 116.121 1.00 0.00 H new ATOM 0 HG3 ARG A 90 -17.393 115.398 115.010 1.00 0.00 H new ATOM 0 HD2 ARG A 90 -16.282 112.567 115.342 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -17.217 113.153 113.980 1.00 0.00 H new ATOM 0 HE ARG A 90 -15.046 114.920 114.131 1.00 0.00 H new ATOM 0 HH11 ARG A 90 -13.141 114.531 112.959 1.00 0.00 H new ATOM 0 HH12 ARG A 90 -12.721 112.889 112.459 1.00 0.00 H new ATOM 0 HH21 ARG A 90 -15.570 111.459 113.896 1.00 0.00 H new ATOM 0 HH22 ARG A 90 -14.086 111.164 112.985 1.00 0.00 H new ATOM 1340 N ILE A 91 -15.205 117.637 118.610 1.00 0.00 N ATOM 1341 CA ILE A 91 -14.222 118.167 119.566 1.00 0.00 C ATOM 1342 C ILE A 91 -14.914 118.924 120.697 1.00 0.00 C ATOM 1343 O ILE A 91 -14.358 119.872 121.249 1.00 0.00 O ATOM 1344 CB ILE A 91 -13.237 119.092 118.836 1.00 0.00 C ATOM 1345 CG1 ILE A 91 -13.980 120.286 118.214 1.00 0.00 C ATOM 1346 CG2 ILE A 91 -12.531 118.307 117.728 1.00 0.00 C ATOM 1347 CD1 ILE A 91 -12.970 121.225 117.547 1.00 0.00 C ATOM 0 H ILE A 91 -15.482 118.302 117.888 1.00 0.00 H new ATOM 0 HA ILE A 91 -13.677 117.330 120.003 1.00 0.00 H new ATOM 0 HB ILE A 91 -12.507 119.465 119.555 1.00 0.00 H new ATOM 0 HG12 ILE A 91 -14.705 119.934 117.480 1.00 0.00 H new ATOM 0 HG13 ILE A 91 -14.538 120.821 118.982 1.00 0.00 H new ATOM 0 HG21 ILE A 91 -11.831 118.961 117.208 1.00 0.00 H new ATOM 0 HG22 ILE A 91 -11.988 117.469 118.165 1.00 0.00 H new ATOM 0 HG23 ILE A 91 -13.270 117.931 117.021 1.00 0.00 H new ATOM 0 HD11 ILE A 91 -13.496 122.071 117.106 1.00 0.00 H new ATOM 0 HD12 ILE A 91 -12.262 121.587 118.293 1.00 0.00 H new ATOM 0 HD13 ILE A 91 -12.432 120.686 116.767 1.00 0.00 H new ATOM 1359 N VAL A 92 -16.130 118.506 121.031 1.00 0.00 N ATOM 1360 CA VAL A 92 -16.880 119.159 122.084 1.00 0.00 C ATOM 1361 C VAL A 92 -16.273 118.789 123.455 1.00 0.00 C ATOM 1362 O VAL A 92 -16.245 117.610 123.805 1.00 0.00 O ATOM 1363 CB VAL A 92 -18.349 118.710 122.027 1.00 0.00 C ATOM 1364 CG1 VAL A 92 -18.453 117.179 122.132 1.00 0.00 C ATOM 1365 CG2 VAL A 92 -19.124 119.365 123.177 1.00 0.00 C ATOM 0 H VAL A 92 -16.610 117.723 120.588 1.00 0.00 H new ATOM 0 HA VAL A 92 -16.831 120.239 121.948 1.00 0.00 H new ATOM 0 HB VAL A 92 -18.776 119.018 121.073 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -19.501 116.882 122.090 1.00 0.00 H new ATOM 0 HG12 VAL A 92 -17.912 116.720 121.305 1.00 0.00 H new ATOM 0 HG13 VAL A 92 -18.020 116.849 123.076 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -20.166 119.049 123.140 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -18.687 119.063 124.129 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -19.070 120.449 123.081 1.00 0.00 H new ATOM 1375 N PRO A 93 -15.774 119.731 124.238 1.00 0.00 N ATOM 1376 CA PRO A 93 -15.169 119.404 125.566 1.00 0.00 C ATOM 1377 C PRO A 93 -16.233 119.141 126.624 1.00 0.00 C ATOM 1378 O PRO A 93 -17.387 119.539 126.467 1.00 0.00 O ATOM 1379 CB PRO A 93 -14.352 120.661 125.894 1.00 0.00 C ATOM 1380 CG PRO A 93 -15.126 121.772 125.261 1.00 0.00 C ATOM 1381 CD PRO A 93 -15.720 121.189 123.977 1.00 0.00 C ATOM 0 HA PRO A 93 -14.569 118.494 125.545 1.00 0.00 H new ATOM 0 HB2 PRO A 93 -14.256 120.805 126.970 1.00 0.00 H new ATOM 0 HB3 PRO A 93 -13.342 120.597 125.489 1.00 0.00 H new ATOM 0 HG2 PRO A 93 -15.911 122.130 125.927 1.00 0.00 H new ATOM 0 HG3 PRO A 93 -14.481 122.623 125.042 1.00 0.00 H new ATOM 0 HD2 PRO A 93 -16.711 121.595 123.775 1.00 0.00 H new ATOM 0 HD3 PRO A 93 -15.099 121.417 123.110 1.00 0.00 H new ATOM 1389 N GLU A 94 -15.837 118.493 127.713 1.00 0.00 N ATOM 1390 CA GLU A 94 -16.780 118.222 128.783 1.00 0.00 C ATOM 1391 C GLU A 94 -17.310 119.550 129.298 1.00 0.00 C ATOM 1392 O GLU A 94 -16.548 120.501 129.474 1.00 0.00 O ATOM 1393 CB GLU A 94 -16.087 117.472 129.922 1.00 0.00 C ATOM 1394 CG GLU A 94 -15.572 116.121 129.418 1.00 0.00 C ATOM 1395 CD GLU A 94 -16.740 115.229 129.011 1.00 0.00 C ATOM 1396 OE1 GLU A 94 -17.853 115.519 129.417 1.00 0.00 O ATOM 1397 OE2 GLU A 94 -16.501 114.265 128.302 1.00 0.00 O1- ATOM 0 H GLU A 94 -14.889 118.153 127.874 1.00 0.00 H new ATOM 0 HA GLU A 94 -17.596 117.605 128.408 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -15.259 118.065 130.309 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -16.784 117.321 130.747 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -14.907 116.272 128.568 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -14.987 115.633 130.198 1.00 0.00 H new ATOM 1404 N LEU A 95 -18.622 119.630 129.524 1.00 0.00 N ATOM 1405 CA LEU A 95 -19.245 120.872 130.003 1.00 0.00 C ATOM 1406 C LEU A 95 -19.528 120.801 131.493 1.00 0.00 C ATOM 1407 O LEU A 95 -20.123 119.842 131.985 1.00 0.00 O ATOM 1408 CB LEU A 95 -20.560 121.100 129.254 1.00 0.00 C ATOM 1409 CG LEU A 95 -20.329 120.998 127.741 1.00 0.00 C ATOM 1410 CD1 LEU A 95 -21.630 121.345 127.017 1.00 0.00 C ATOM 1411 CD2 LEU A 95 -19.215 121.967 127.301 1.00 0.00 C ATOM 0 H LEU A 95 -19.273 118.857 129.385 1.00 0.00 H new ATOM 0 HA LEU A 95 -18.555 121.696 129.819 1.00 0.00 H new ATOM 0 HB2 LEU A 95 -21.299 120.362 129.568 1.00 0.00 H new ATOM 0 HB3 LEU A 95 -20.964 122.081 129.503 1.00 0.00 H new ATOM 0 HG LEU A 95 -20.022 119.982 127.491 1.00 0.00 H new ATOM 0 HD11 LEU A 95 -21.477 121.276 125.940 1.00 0.00 H new ATOM 0 HD12 LEU A 95 -22.411 120.647 127.318 1.00 0.00 H new ATOM 0 HD13 LEU A 95 -21.931 122.360 127.276 1.00 0.00 H new ATOM 0 HD21 LEU A 95 -19.063 121.882 126.225 1.00 0.00 H new ATOM 0 HD22 LEU A 95 -19.503 122.989 127.548 1.00 0.00 H new ATOM 0 HD23 LEU A 95 -18.289 121.716 127.819 1.00 0.00 H new ATOM 1423 N THR A 96 -19.110 121.851 132.204 1.00 0.00 N ATOM 1424 CA THR A 96 -19.321 121.962 133.656 1.00 0.00 C ATOM 1425 C THR A 96 -20.134 123.222 133.947 1.00 0.00 C ATOM 1426 O THR A 96 -19.783 124.306 133.491 1.00 0.00 O ATOM 1427 CB THR A 96 -17.954 122.027 134.354 1.00 0.00 C ATOM 1428 OG1 THR A 96 -17.337 120.749 134.298 1.00 0.00 O ATOM 1429 CG2 THR A 96 -18.113 122.462 135.812 1.00 0.00 C ATOM 0 H THR A 96 -18.618 122.646 131.796 1.00 0.00 H new ATOM 0 HA THR A 96 -19.868 121.097 134.030 1.00 0.00 H new ATOM 0 HB THR A 96 -17.331 122.760 133.842 1.00 0.00 H new ATOM 0 HG1 THR A 96 -16.464 120.788 134.741 1.00 0.00 H new ATOM 0 HG21 THR A 96 -17.134 122.502 136.289 1.00 0.00 H new ATOM 0 HG22 THR A 96 -18.575 123.449 135.849 1.00 0.00 H new ATOM 0 HG23 THR A 96 -18.744 121.746 136.339 1.00 0.00 H new ATOM 1437 N PHE A 97 -21.225 123.071 134.712 1.00 0.00 N ATOM 1438 CA PHE A 97 -22.098 124.206 135.062 1.00 0.00 C ATOM 1439 C PHE A 97 -22.019 124.539 136.548 1.00 0.00 C ATOM 1440 O PHE A 97 -22.254 123.684 137.403 1.00 0.00 O ATOM 1441 CB PHE A 97 -23.548 123.856 134.713 1.00 0.00 C ATOM 1442 CG PHE A 97 -23.673 123.620 133.224 1.00 0.00 C ATOM 1443 CD1 PHE A 97 -23.487 122.335 132.702 1.00 0.00 C ATOM 1444 CD2 PHE A 97 -23.975 124.686 132.368 1.00 0.00 C ATOM 1445 CE1 PHE A 97 -23.603 122.115 131.324 1.00 0.00 C ATOM 1446 CE2 PHE A 97 -24.093 124.466 130.991 1.00 0.00 C ATOM 1447 CZ PHE A 97 -23.906 123.181 130.469 1.00 0.00 C ATOM 0 H PHE A 97 -21.525 122.177 135.100 1.00 0.00 H new ATOM 0 HA PHE A 97 -21.761 125.074 134.495 1.00 0.00 H new ATOM 0 HB2 PHE A 97 -23.858 122.965 135.259 1.00 0.00 H new ATOM 0 HB3 PHE A 97 -24.211 124.665 135.019 1.00 0.00 H new ATOM 0 HD1 PHE A 97 -23.254 121.513 133.362 1.00 0.00 H new ATOM 0 HD2 PHE A 97 -24.117 125.678 132.770 1.00 0.00 H new ATOM 0 HE1 PHE A 97 -23.459 121.123 130.921 1.00 0.00 H new ATOM 0 HE2 PHE A 97 -24.328 125.288 130.331 1.00 0.00 H new ATOM 0 HZ PHE A 97 -23.996 123.012 129.406 1.00 0.00 H new ATOM 1457 N PHE A 98 -21.727 125.812 136.847 1.00 0.00 N ATOM 1458 CA PHE A 98 -21.659 126.308 138.233 1.00 0.00 C ATOM 1459 C PHE A 98 -22.683 127.422 138.421 1.00 0.00 C ATOM 1460 O PHE A 98 -22.846 128.278 137.551 1.00 0.00 O ATOM 1461 CB PHE A 98 -20.257 126.851 138.549 1.00 0.00 C ATOM 1462 CG PHE A 98 -19.286 125.704 138.743 1.00 0.00 C ATOM 1463 CD1 PHE A 98 -19.438 124.847 139.840 1.00 0.00 C ATOM 1464 CD2 PHE A 98 -18.227 125.507 137.845 1.00 0.00 C ATOM 1465 CE1 PHE A 98 -18.537 123.795 140.039 1.00 0.00 C ATOM 1466 CE2 PHE A 98 -17.327 124.453 138.046 1.00 0.00 C ATOM 1467 CZ PHE A 98 -17.482 123.597 139.143 1.00 0.00 C ATOM 0 H PHE A 98 -21.532 126.524 136.143 1.00 0.00 H new ATOM 0 HA PHE A 98 -21.875 125.481 138.910 1.00 0.00 H new ATOM 0 HB2 PHE A 98 -19.916 127.493 137.737 1.00 0.00 H new ATOM 0 HB3 PHE A 98 -20.291 127.465 139.449 1.00 0.00 H new ATOM 0 HD1 PHE A 98 -20.252 124.998 140.534 1.00 0.00 H new ATOM 0 HD2 PHE A 98 -18.106 126.168 136.999 1.00 0.00 H new ATOM 0 HE1 PHE A 98 -18.657 123.135 140.886 1.00 0.00 H new ATOM 0 HE2 PHE A 98 -16.512 124.300 137.354 1.00 0.00 H new ATOM 0 HZ PHE A 98 -16.787 122.785 139.297 1.00 0.00 H new ATOM 1477 N TYR A 99 -23.368 127.414 139.568 1.00 0.00 N ATOM 1478 CA TYR A 99 -24.381 128.434 139.884 1.00 0.00 C ATOM 1479 C TYR A 99 -23.884 129.344 141.003 1.00 0.00 C ATOM 1480 O TYR A 99 -23.443 128.868 142.050 1.00 0.00 O ATOM 1481 CB TYR A 99 -25.684 127.745 140.311 1.00 0.00 C ATOM 1482 CG TYR A 99 -25.496 127.060 141.647 1.00 0.00 C ATOM 1483 CD1 TYR A 99 -24.961 125.768 141.701 1.00 0.00 C ATOM 1484 CD2 TYR A 99 -25.856 127.719 142.829 1.00 0.00 C ATOM 1485 CE1 TYR A 99 -24.785 125.133 142.937 1.00 0.00 C ATOM 1486 CE2 TYR A 99 -25.680 127.085 144.065 1.00 0.00 C ATOM 1487 CZ TYR A 99 -25.145 125.792 144.118 1.00 0.00 C ATOM 1488 OH TYR A 99 -24.972 125.167 145.337 1.00 0.00 O ATOM 0 H TYR A 99 -23.241 126.712 140.297 1.00 0.00 H new ATOM 0 HA TYR A 99 -24.564 129.041 138.997 1.00 0.00 H new ATOM 0 HB2 TYR A 99 -26.487 128.479 140.380 1.00 0.00 H new ATOM 0 HB3 TYR A 99 -25.982 127.015 139.558 1.00 0.00 H new ATOM 0 HD1 TYR A 99 -24.684 125.260 140.789 1.00 0.00 H new ATOM 0 HD2 TYR A 99 -26.269 128.716 142.787 1.00 0.00 H new ATOM 0 HE1 TYR A 99 -24.372 124.136 142.979 1.00 0.00 H new ATOM 0 HE2 TYR A 99 -25.957 127.593 144.977 1.00 0.00 H new ATOM 0 HH TYR A 99 -25.271 125.763 146.055 1.00 0.00 H new ATOM 1498 N ASP A 100 -23.971 130.661 140.784 1.00 0.00 N ATOM 1499 CA ASP A 100 -23.541 131.650 141.790 1.00 0.00 C ATOM 1500 C ASP A 100 -24.628 132.696 141.975 1.00 0.00 C ATOM 1501 O ASP A 100 -24.803 133.571 141.130 1.00 0.00 O ATOM 1502 CB ASP A 100 -22.252 132.333 141.325 1.00 0.00 C ATOM 1503 CG ASP A 100 -21.728 133.257 142.419 1.00 0.00 C ATOM 1504 OD1 ASP A 100 -22.302 133.252 143.496 1.00 0.00 O ATOM 1505 OD2 ASP A 100 -20.763 133.958 142.163 1.00 0.00 O1- ATOM 0 H ASP A 100 -24.334 131.070 139.923 1.00 0.00 H new ATOM 0 HA ASP A 100 -23.360 131.142 142.737 1.00 0.00 H new ATOM 0 HB2 ASP A 100 -21.500 131.582 141.081 1.00 0.00 H new ATOM 0 HB3 ASP A 100 -22.440 132.903 140.415 1.00 0.00 H new TER 1510 ASP A 100