USER MOD reduce.3.24.130724 H: found=0, std=0, add=808, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 804 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 76 THR OG1 : rot 180:sc= -0.925 USER MOD Set 1.2: A 79 GLN : amide:sc= -0.533 K(o=-1.5,f=-9.3!) USER MOD Set 2.1: A 31 ASN : amide:sc= -0.254 K(o=-1.3,f=-3!) USER MOD Set 2.2: A 44 SER OG : rot 180:sc= -1.09 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 56:sc= 0.383 USER MOD Single : A 18 LYS NZ :NH3+ -133:sc= -0.391 (180deg=-1.55!) USER MOD Single : A 22 HIS : no HD1:sc=-0.00381 X(o=-0.0038,f=-0.11) USER MOD Single : A 23 LYS NZ :NH3+ 176:sc= 0.135 (180deg=0.126) USER MOD Single : A 25 SER OG : rot 180:sc= 0 USER MOD Single : A 26 THR OG1 : rot 180:sc= -0.175 USER MOD Single : A 55 SER OG : rot -99:sc= 0.808 USER MOD Single : A 66 SER OG : rot 180:sc= -0.355 USER MOD Single : A 68 ASN : amide:sc= -0.125 K(o=-0.12,f=-0.63) USER MOD Single : A 71 ASN : amide:sc=-0.00275 X(o=-0.0028,f=0) USER MOD Single : A 74 ASN : amide:sc= -0.878 K(o=-0.88,f=-3.5!) USER MOD Single : A 77 HIS : no HE2:sc= -1.33 K(o=-1.3,f=-2.3!) USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 GLN : amide:sc= 0 K(o=0,f=-0.99) USER MOD Single : A 90 SER OG : rot 180:sc= 0.00678 USER MOD Single : A 92 THR OG1 : rot 180:sc= 0 USER MOD Single : A 96 GLN : amide:sc= -12.6! C(o=-13!,f=-13!) USER MOD Single : A 97 TYR OH : rot 180:sc= 0 USER MOD Single : A 102 TYR OH : rot -130:sc= -0.0919 USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD Single : A 111 SER OG : rot 43:sc= 0.304 USER MOD Single : A 112 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -7.394 6.755 -46.409 1.00 0.00 N ATOM 2 CA GLY A 1 -7.405 7.863 -45.469 1.00 0.00 C ATOM 3 C GLY A 1 -6.932 7.413 -44.086 1.00 0.00 C ATOM 4 O GLY A 1 -7.732 6.953 -43.272 1.00 0.00 O ATOM 0 H1 GLY A 1 -7.719 7.086 -47.340 1.00 0.00 H new ATOM 0 H2 GLY A 1 -6.427 6.380 -46.493 1.00 0.00 H new ATOM 0 H3 GLY A 1 -8.028 6.004 -46.068 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -6.760 8.662 -45.836 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -8.412 8.274 -45.397 1.00 0.00 H new ATOM 8 N SER A 2 -5.635 7.561 -43.861 1.00 0.00 N ATOM 9 CA SER A 2 -5.047 7.175 -42.590 1.00 0.00 C ATOM 10 C SER A 2 -4.186 8.316 -42.044 1.00 0.00 C ATOM 11 O SER A 2 -3.698 9.150 -42.806 1.00 0.00 O ATOM 12 CB SER A 2 -4.211 5.902 -42.734 1.00 0.00 C ATOM 13 OG SER A 2 -3.214 6.029 -43.743 1.00 0.00 O ATOM 0 H SER A 2 -4.975 7.943 -44.538 1.00 0.00 H new ATOM 0 HA SER A 2 -5.855 6.969 -41.888 1.00 0.00 H new ATOM 0 HB2 SER A 2 -3.735 5.671 -41.781 1.00 0.00 H new ATOM 0 HB3 SER A 2 -4.865 5.064 -42.974 1.00 0.00 H new ATOM 0 HG SER A 2 -2.701 5.196 -43.803 1.00 0.00 H new ATOM 19 N SER A 3 -4.025 8.317 -40.729 1.00 0.00 N ATOM 20 CA SER A 3 -3.232 9.342 -40.072 1.00 0.00 C ATOM 21 C SER A 3 -2.677 8.807 -38.751 1.00 0.00 C ATOM 22 O SER A 3 -1.464 8.685 -38.587 1.00 0.00 O ATOM 23 CB SER A 3 -4.058 10.606 -39.828 1.00 0.00 C ATOM 24 OG SER A 3 -3.483 11.749 -40.455 1.00 0.00 O ATOM 0 H SER A 3 -4.431 7.624 -40.100 1.00 0.00 H new ATOM 0 HA SER A 3 -2.402 9.605 -40.728 1.00 0.00 H new ATOM 0 HB2 SER A 3 -5.070 10.456 -40.205 1.00 0.00 H new ATOM 0 HB3 SER A 3 -4.140 10.784 -38.756 1.00 0.00 H new ATOM 0 HG SER A 3 -4.041 12.535 -40.277 1.00 0.00 H new ATOM 30 N GLY A 4 -3.591 8.502 -37.841 1.00 0.00 N ATOM 31 CA GLY A 4 -3.208 7.984 -36.539 1.00 0.00 C ATOM 32 C GLY A 4 -3.858 8.791 -35.414 1.00 0.00 C ATOM 33 O GLY A 4 -4.772 8.309 -34.747 1.00 0.00 O ATOM 0 H GLY A 4 -4.596 8.604 -37.980 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -3.504 6.938 -36.459 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -2.123 8.017 -36.435 1.00 0.00 H new ATOM 37 N SER A 5 -3.361 10.007 -35.238 1.00 0.00 N ATOM 38 CA SER A 5 -3.882 10.886 -34.205 1.00 0.00 C ATOM 39 C SER A 5 -3.752 10.218 -32.835 1.00 0.00 C ATOM 40 O SER A 5 -3.556 9.007 -32.747 1.00 0.00 O ATOM 41 CB SER A 5 -5.341 11.255 -34.480 1.00 0.00 C ATOM 42 OG SER A 5 -5.456 12.292 -35.451 1.00 0.00 O ATOM 0 H SER A 5 -2.603 10.404 -35.793 1.00 0.00 H new ATOM 0 HA SER A 5 -3.296 11.805 -34.211 1.00 0.00 H new ATOM 0 HB2 SER A 5 -5.879 10.373 -34.827 1.00 0.00 H new ATOM 0 HB3 SER A 5 -5.816 11.573 -33.552 1.00 0.00 H new ATOM 0 HG SER A 5 -6.403 12.497 -35.600 1.00 0.00 H new ATOM 48 N SER A 6 -3.867 11.037 -31.800 1.00 0.00 N ATOM 49 CA SER A 6 -3.766 10.540 -30.438 1.00 0.00 C ATOM 50 C SER A 6 -4.033 11.674 -29.446 1.00 0.00 C ATOM 51 O SER A 6 -4.068 12.843 -29.829 1.00 0.00 O ATOM 52 CB SER A 6 -2.391 9.922 -30.179 1.00 0.00 C ATOM 53 OG SER A 6 -2.439 8.498 -30.169 1.00 0.00 O ATOM 0 H SER A 6 -4.029 12.041 -31.877 1.00 0.00 H new ATOM 0 HA SER A 6 -4.517 9.762 -30.301 1.00 0.00 H new ATOM 0 HB2 SER A 6 -1.693 10.256 -30.947 1.00 0.00 H new ATOM 0 HB3 SER A 6 -2.008 10.279 -29.223 1.00 0.00 H new ATOM 0 HG SER A 6 -2.824 8.178 -31.011 1.00 0.00 H new ATOM 59 N GLY A 7 -4.215 11.290 -28.192 1.00 0.00 N ATOM 60 CA GLY A 7 -4.478 12.259 -27.142 1.00 0.00 C ATOM 61 C GLY A 7 -4.321 11.626 -25.758 1.00 0.00 C ATOM 62 O GLY A 7 -4.554 10.430 -25.589 1.00 0.00 O ATOM 0 H GLY A 7 -4.186 10.320 -27.879 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -3.793 13.101 -27.240 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -5.488 12.655 -27.252 1.00 0.00 H new ATOM 66 N ARG A 8 -3.928 12.456 -24.804 1.00 0.00 N ATOM 67 CA ARG A 8 -3.738 11.992 -23.440 1.00 0.00 C ATOM 68 C ARG A 8 -4.485 12.900 -22.461 1.00 0.00 C ATOM 69 O ARG A 8 -4.523 14.116 -22.642 1.00 0.00 O ATOM 70 CB ARG A 8 -2.253 11.966 -23.069 1.00 0.00 C ATOM 71 CG ARG A 8 -1.547 10.776 -23.720 1.00 0.00 C ATOM 72 CD ARG A 8 -0.048 11.044 -23.871 1.00 0.00 C ATOM 73 NE ARG A 8 0.570 9.997 -24.716 1.00 0.00 N ATOM 74 CZ ARG A 8 0.367 9.879 -26.035 1.00 0.00 C ATOM 75 NH1 ARG A 8 -0.439 10.742 -26.669 1.00 0.00 N ATOM 76 NH2 ARG A 8 0.970 8.899 -26.721 1.00 0.00 N ATOM 0 H ARG A 8 -3.736 13.447 -24.948 1.00 0.00 H new ATOM 0 HA ARG A 8 -4.135 10.979 -23.376 1.00 0.00 H new ATOM 0 HB2 ARG A 8 -1.778 12.894 -23.388 1.00 0.00 H new ATOM 0 HB3 ARG A 8 -2.146 11.909 -21.986 1.00 0.00 H new ATOM 0 HG2 ARG A 8 -1.701 9.882 -23.116 1.00 0.00 H new ATOM 0 HG3 ARG A 8 -1.985 10.579 -24.698 1.00 0.00 H new ATOM 0 HD2 ARG A 8 0.111 12.025 -24.318 1.00 0.00 H new ATOM 0 HD3 ARG A 8 0.428 11.060 -22.890 1.00 0.00 H new ATOM 0 HE ARG A 8 1.189 9.323 -24.266 1.00 0.00 H new ATOM 0 HH11 ARG A 8 -0.898 11.489 -26.147 1.00 0.00 H new ATOM 0 HH12 ARG A 8 -0.593 10.652 -27.673 1.00 0.00 H new ATOM 0 HH21 ARG A 8 1.584 8.242 -26.239 1.00 0.00 H new ATOM 0 HH22 ARG A 8 0.815 8.810 -27.725 1.00 0.00 H new ATOM 90 N PRO A 9 -5.075 12.258 -21.418 1.00 0.00 N ATOM 91 CA PRO A 9 -5.819 12.994 -20.410 1.00 0.00 C ATOM 92 C PRO A 9 -4.874 13.736 -19.463 1.00 0.00 C ATOM 93 O PRO A 9 -3.665 13.769 -19.688 1.00 0.00 O ATOM 94 CB PRO A 9 -6.667 11.948 -19.704 1.00 0.00 C ATOM 95 CG PRO A 9 -6.027 10.608 -20.025 1.00 0.00 C ATOM 96 CD PRO A 9 -5.051 10.819 -21.171 1.00 0.00 C ATOM 0 HA PRO A 9 -6.448 13.774 -20.839 1.00 0.00 H new ATOM 0 HB2 PRO A 9 -6.688 12.123 -18.628 1.00 0.00 H new ATOM 0 HB3 PRO A 9 -7.699 11.982 -20.053 1.00 0.00 H new ATOM 0 HG2 PRO A 9 -5.509 10.213 -19.151 1.00 0.00 H new ATOM 0 HG3 PRO A 9 -6.788 9.878 -20.301 1.00 0.00 H new ATOM 0 HD2 PRO A 9 -4.050 10.479 -20.906 1.00 0.00 H new ATOM 0 HD3 PRO A 9 -5.353 10.260 -22.057 1.00 0.00 H new ATOM 104 N GLY A 10 -5.460 14.312 -18.424 1.00 0.00 N ATOM 105 CA GLY A 10 -4.685 15.051 -17.442 1.00 0.00 C ATOM 106 C GLY A 10 -5.111 14.685 -16.019 1.00 0.00 C ATOM 107 O GLY A 10 -5.363 13.518 -15.724 1.00 0.00 O ATOM 0 H GLY A 10 -6.463 14.282 -18.241 1.00 0.00 H new ATOM 0 HA2 GLY A 10 -3.625 14.837 -17.574 1.00 0.00 H new ATOM 0 HA3 GLY A 10 -4.816 16.121 -17.601 1.00 0.00 H new ATOM 111 N GLY A 11 -5.178 15.704 -15.175 1.00 0.00 N ATOM 112 CA GLY A 11 -5.569 15.504 -13.790 1.00 0.00 C ATOM 113 C GLY A 11 -4.482 16.004 -12.836 1.00 0.00 C ATOM 114 O GLY A 11 -3.328 16.162 -13.232 1.00 0.00 O ATOM 0 H GLY A 11 -4.968 16.671 -15.424 1.00 0.00 H new ATOM 0 HA2 GLY A 11 -6.502 16.031 -13.592 1.00 0.00 H new ATOM 0 HA3 GLY A 11 -5.757 14.445 -13.611 1.00 0.00 H new ATOM 118 N ASP A 12 -4.890 16.239 -11.597 1.00 0.00 N ATOM 119 CA ASP A 12 -3.965 16.718 -10.583 1.00 0.00 C ATOM 120 C ASP A 12 -3.461 15.533 -9.758 1.00 0.00 C ATOM 121 O ASP A 12 -3.050 15.700 -8.611 1.00 0.00 O ATOM 122 CB ASP A 12 -4.652 17.699 -9.631 1.00 0.00 C ATOM 123 CG ASP A 12 -4.386 19.177 -9.922 1.00 0.00 C ATOM 124 OD1 ASP A 12 -3.197 19.513 -10.109 1.00 0.00 O ATOM 125 OD2 ASP A 12 -5.377 19.938 -9.951 1.00 0.00 O ATOM 0 H ASP A 12 -5.848 16.107 -11.272 1.00 0.00 H new ATOM 0 HA ASP A 12 -3.142 17.223 -11.089 1.00 0.00 H new ATOM 0 HB2 ASP A 12 -5.727 17.525 -9.668 1.00 0.00 H new ATOM 0 HB3 ASP A 12 -4.329 17.481 -8.613 1.00 0.00 H new ATOM 130 N ALA A 13 -3.508 14.361 -10.375 1.00 0.00 N ATOM 131 CA ALA A 13 -3.061 13.148 -9.712 1.00 0.00 C ATOM 132 C ALA A 13 -4.071 12.762 -8.629 1.00 0.00 C ATOM 133 O ALA A 13 -3.883 13.084 -7.457 1.00 0.00 O ATOM 134 CB ALA A 13 -1.655 13.362 -9.148 1.00 0.00 C ATOM 0 H ALA A 13 -3.849 14.226 -11.327 1.00 0.00 H new ATOM 0 HA ALA A 13 -3.005 12.322 -10.421 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -1.320 12.452 -8.651 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -0.970 13.605 -9.960 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -1.672 14.182 -8.430 1.00 0.00 H new ATOM 140 N ARG A 14 -5.121 12.077 -9.060 1.00 0.00 N ATOM 141 CA ARG A 14 -6.160 11.644 -8.142 1.00 0.00 C ATOM 142 C ARG A 14 -6.408 10.142 -8.291 1.00 0.00 C ATOM 143 O ARG A 14 -6.309 9.394 -7.320 1.00 0.00 O ATOM 144 CB ARG A 14 -7.468 12.397 -8.396 1.00 0.00 C ATOM 145 CG ARG A 14 -7.306 13.890 -8.103 1.00 0.00 C ATOM 146 CD ARG A 14 -6.671 14.617 -9.290 1.00 0.00 C ATOM 147 NE ARG A 14 -7.579 15.679 -9.778 1.00 0.00 N ATOM 148 CZ ARG A 14 -8.547 15.483 -10.684 1.00 0.00 C ATOM 149 NH1 ARG A 14 -8.738 14.264 -11.206 1.00 0.00 N ATOM 150 NH2 ARG A 14 -9.322 16.506 -11.067 1.00 0.00 N ATOM 0 H ARG A 14 -5.274 11.812 -10.033 1.00 0.00 H new ATOM 0 HA ARG A 14 -5.819 11.861 -7.130 1.00 0.00 H new ATOM 0 HB2 ARG A 14 -7.777 12.257 -9.432 1.00 0.00 H new ATOM 0 HB3 ARG A 14 -8.258 11.983 -7.769 1.00 0.00 H new ATOM 0 HG2 ARG A 14 -8.279 14.328 -7.882 1.00 0.00 H new ATOM 0 HG3 ARG A 14 -6.687 14.025 -7.216 1.00 0.00 H new ATOM 0 HD2 ARG A 14 -5.717 15.051 -8.993 1.00 0.00 H new ATOM 0 HD3 ARG A 14 -6.463 13.909 -10.092 1.00 0.00 H new ATOM 0 HE ARG A 14 -7.461 16.619 -9.401 1.00 0.00 H new ATOM 0 HH11 ARG A 14 -8.147 13.486 -10.914 1.00 0.00 H new ATOM 0 HH12 ARG A 14 -9.475 14.114 -11.896 1.00 0.00 H new ATOM 0 HH21 ARG A 14 -9.175 17.434 -10.669 1.00 0.00 H new ATOM 0 HH22 ARG A 14 -10.059 16.357 -11.756 1.00 0.00 H new ATOM 164 N GLU A 15 -6.724 9.745 -9.515 1.00 0.00 N ATOM 165 CA GLU A 15 -6.987 8.346 -9.803 1.00 0.00 C ATOM 166 C GLU A 15 -5.894 7.464 -9.195 1.00 0.00 C ATOM 167 O GLU A 15 -4.907 7.971 -8.664 1.00 0.00 O ATOM 168 CB GLU A 15 -7.106 8.109 -11.310 1.00 0.00 C ATOM 169 CG GLU A 15 -8.545 7.768 -11.700 1.00 0.00 C ATOM 170 CD GLU A 15 -8.665 7.535 -13.207 1.00 0.00 C ATOM 171 OE1 GLU A 15 -8.112 8.370 -13.956 1.00 0.00 O ATOM 172 OE2 GLU A 15 -9.307 6.528 -13.577 1.00 0.00 O ATOM 0 H GLU A 15 -6.804 10.368 -10.319 1.00 0.00 H new ATOM 0 HA GLU A 15 -7.940 8.075 -9.349 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -6.781 8.999 -11.848 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -6.443 7.297 -11.607 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -8.869 6.876 -11.164 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -9.209 8.579 -11.400 1.00 0.00 H new ATOM 179 N PRO A 16 -6.113 6.126 -9.295 1.00 0.00 N ATOM 180 CA PRO A 16 -5.159 5.169 -8.761 1.00 0.00 C ATOM 181 C PRO A 16 -3.923 5.069 -9.657 1.00 0.00 C ATOM 182 O PRO A 16 -4.020 4.646 -10.808 1.00 0.00 O ATOM 183 CB PRO A 16 -5.927 3.862 -8.659 1.00 0.00 C ATOM 184 CG PRO A 16 -7.135 4.016 -9.569 1.00 0.00 C ATOM 185 CD PRO A 16 -7.271 5.490 -9.917 1.00 0.00 C ATOM 0 HA PRO A 16 -4.769 5.463 -7.786 1.00 0.00 H new ATOM 0 HB2 PRO A 16 -5.308 3.020 -8.970 1.00 0.00 H new ATOM 0 HB3 PRO A 16 -6.234 3.669 -7.631 1.00 0.00 H new ATOM 0 HG2 PRO A 16 -7.010 3.420 -10.473 1.00 0.00 H new ATOM 0 HG3 PRO A 16 -8.036 3.656 -9.072 1.00 0.00 H new ATOM 0 HD2 PRO A 16 -7.275 5.643 -10.996 1.00 0.00 H new ATOM 0 HD3 PRO A 16 -8.204 5.903 -9.533 1.00 0.00 H new ATOM 193 N ARG A 17 -2.790 5.465 -9.096 1.00 0.00 N ATOM 194 CA ARG A 17 -1.537 5.424 -9.830 1.00 0.00 C ATOM 195 C ARG A 17 -0.846 4.074 -9.628 1.00 0.00 C ATOM 196 O ARG A 17 -1.298 3.255 -8.829 1.00 0.00 O ATOM 197 CB ARG A 17 -0.597 6.543 -9.377 1.00 0.00 C ATOM 198 CG ARG A 17 -0.599 6.677 -7.852 1.00 0.00 C ATOM 199 CD ARG A 17 0.810 6.952 -7.324 1.00 0.00 C ATOM 200 NE ARG A 17 1.352 8.182 -7.944 1.00 0.00 N ATOM 201 CZ ARG A 17 0.899 9.416 -7.687 1.00 0.00 C ATOM 202 NH1 ARG A 17 -0.108 9.593 -6.820 1.00 0.00 N ATOM 203 NH2 ARG A 17 1.452 10.473 -8.297 1.00 0.00 N ATOM 0 H ARG A 17 -2.714 5.816 -8.141 1.00 0.00 H new ATOM 0 HA ARG A 17 -1.767 5.563 -10.886 1.00 0.00 H new ATOM 0 HB2 ARG A 17 0.415 6.337 -9.726 1.00 0.00 H new ATOM 0 HB3 ARG A 17 -0.904 7.486 -9.829 1.00 0.00 H new ATOM 0 HG2 ARG A 17 -1.267 7.486 -7.555 1.00 0.00 H new ATOM 0 HG3 ARG A 17 -0.987 5.763 -7.404 1.00 0.00 H new ATOM 0 HD2 ARG A 17 0.786 7.062 -6.240 1.00 0.00 H new ATOM 0 HD3 ARG A 17 1.461 6.106 -7.545 1.00 0.00 H new ATOM 0 HE ARG A 17 2.119 8.084 -8.609 1.00 0.00 H new ATOM 0 HH11 ARG A 17 -0.529 8.788 -6.356 1.00 0.00 H new ATOM 0 HH12 ARG A 17 -0.453 10.533 -6.624 1.00 0.00 H new ATOM 0 HH21 ARG A 17 2.218 10.338 -8.957 1.00 0.00 H new ATOM 0 HH22 ARG A 17 1.107 11.413 -8.101 1.00 0.00 H new ATOM 217 N LYS A 18 0.237 3.883 -10.366 1.00 0.00 N ATOM 218 CA LYS A 18 0.995 2.646 -10.278 1.00 0.00 C ATOM 219 C LYS A 18 2.347 2.927 -9.619 1.00 0.00 C ATOM 220 O LYS A 18 3.117 3.754 -10.103 1.00 0.00 O ATOM 221 CB LYS A 18 1.106 1.987 -11.654 1.00 0.00 C ATOM 222 CG LYS A 18 2.063 0.794 -11.614 1.00 0.00 C ATOM 223 CD LYS A 18 1.904 -0.078 -12.862 1.00 0.00 C ATOM 224 CE LYS A 18 0.547 -0.785 -12.867 1.00 0.00 C ATOM 225 NZ LYS A 18 -0.413 -0.056 -13.726 1.00 0.00 N ATOM 0 H LYS A 18 0.608 4.564 -11.028 1.00 0.00 H new ATOM 0 HA LYS A 18 0.476 1.925 -9.646 1.00 0.00 H new ATOM 0 HB2 LYS A 18 0.121 1.657 -11.984 1.00 0.00 H new ATOM 0 HB3 LYS A 18 1.458 2.716 -12.383 1.00 0.00 H new ATOM 0 HG2 LYS A 18 3.091 1.150 -11.543 1.00 0.00 H new ATOM 0 HG3 LYS A 18 1.870 0.198 -10.722 1.00 0.00 H new ATOM 0 HD2 LYS A 18 2.000 0.539 -13.756 1.00 0.00 H new ATOM 0 HD3 LYS A 18 2.704 -0.818 -12.898 1.00 0.00 H new ATOM 0 HE2 LYS A 18 0.664 -1.807 -13.228 1.00 0.00 H new ATOM 0 HE3 LYS A 18 0.159 -0.848 -11.850 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 -1.316 0.055 -13.221 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 -0.029 0.882 -13.958 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 -0.570 -0.592 -14.603 1.00 0.00 H new ATOM 239 N ILE A 19 2.593 2.222 -8.524 1.00 0.00 N ATOM 240 CA ILE A 19 3.839 2.385 -7.794 1.00 0.00 C ATOM 241 C ILE A 19 4.577 1.045 -7.747 1.00 0.00 C ATOM 242 O ILE A 19 4.223 0.166 -6.963 1.00 0.00 O ATOM 243 CB ILE A 19 3.576 2.991 -6.414 1.00 0.00 C ATOM 244 CG1 ILE A 19 2.864 4.340 -6.535 1.00 0.00 C ATOM 245 CG2 ILE A 19 4.871 3.097 -5.606 1.00 0.00 C ATOM 246 CD1 ILE A 19 1.545 4.335 -5.759 1.00 0.00 C ATOM 0 H ILE A 19 1.951 1.537 -8.125 1.00 0.00 H new ATOM 0 HA ILE A 19 4.492 3.091 -8.308 1.00 0.00 H new ATOM 0 HB ILE A 19 2.910 2.323 -5.868 1.00 0.00 H new ATOM 0 HG12 ILE A 19 3.510 5.132 -6.156 1.00 0.00 H new ATOM 0 HG13 ILE A 19 2.672 4.561 -7.585 1.00 0.00 H new ATOM 0 HG21 ILE A 19 4.656 3.531 -4.629 1.00 0.00 H new ATOM 0 HG22 ILE A 19 5.301 2.104 -5.475 1.00 0.00 H new ATOM 0 HG23 ILE A 19 5.580 3.732 -6.137 1.00 0.00 H new ATOM 0 HD11 ILE A 19 1.059 5.305 -5.861 1.00 0.00 H new ATOM 0 HD12 ILE A 19 0.892 3.558 -6.157 1.00 0.00 H new ATOM 0 HD13 ILE A 19 1.743 4.138 -4.705 1.00 0.00 H new ATOM 258 N ILE A 20 5.588 0.932 -8.596 1.00 0.00 N ATOM 259 CA ILE A 20 6.378 -0.285 -8.661 1.00 0.00 C ATOM 260 C ILE A 20 7.594 -0.148 -7.742 1.00 0.00 C ATOM 261 O ILE A 20 8.587 0.477 -8.110 1.00 0.00 O ATOM 262 CB ILE A 20 6.737 -0.614 -10.111 1.00 0.00 C ATOM 263 CG1 ILE A 20 5.564 -1.287 -10.827 1.00 0.00 C ATOM 264 CG2 ILE A 20 8.012 -1.457 -10.183 1.00 0.00 C ATOM 265 CD1 ILE A 20 5.390 -0.727 -12.241 1.00 0.00 C ATOM 0 H ILE A 20 5.878 1.664 -9.245 1.00 0.00 H new ATOM 0 HA ILE A 20 5.799 -1.135 -8.300 1.00 0.00 H new ATOM 0 HB ILE A 20 6.940 0.321 -10.633 1.00 0.00 H new ATOM 0 HG12 ILE A 20 5.732 -2.363 -10.876 1.00 0.00 H new ATOM 0 HG13 ILE A 20 4.648 -1.133 -10.256 1.00 0.00 H new ATOM 0 HG21 ILE A 20 8.245 -1.677 -11.225 1.00 0.00 H new ATOM 0 HG22 ILE A 20 8.839 -0.905 -9.735 1.00 0.00 H new ATOM 0 HG23 ILE A 20 7.862 -2.390 -9.640 1.00 0.00 H new ATOM 0 HD11 ILE A 20 4.550 -1.222 -12.728 1.00 0.00 H new ATOM 0 HD12 ILE A 20 5.198 0.345 -12.187 1.00 0.00 H new ATOM 0 HD13 ILE A 20 6.298 -0.904 -12.817 1.00 0.00 H new ATOM 277 N LEU A 21 7.476 -0.744 -6.565 1.00 0.00 N ATOM 278 CA LEU A 21 8.553 -0.697 -5.591 1.00 0.00 C ATOM 279 C LEU A 21 9.352 -1.999 -5.657 1.00 0.00 C ATOM 280 O LEU A 21 8.776 -3.086 -5.656 1.00 0.00 O ATOM 281 CB LEU A 21 8.003 -0.383 -4.198 1.00 0.00 C ATOM 282 CG LEU A 21 7.023 0.789 -4.112 1.00 0.00 C ATOM 283 CD1 LEU A 21 6.513 0.974 -2.682 1.00 0.00 C ATOM 284 CD2 LEU A 21 7.650 2.070 -4.667 1.00 0.00 C ATOM 0 H LEU A 21 6.651 -1.262 -6.264 1.00 0.00 H new ATOM 0 HA LEU A 21 9.243 0.113 -5.826 1.00 0.00 H new ATOM 0 HB2 LEU A 21 7.506 -1.275 -3.816 1.00 0.00 H new ATOM 0 HB3 LEU A 21 8.843 -0.177 -3.535 1.00 0.00 H new ATOM 0 HG LEU A 21 6.159 0.557 -4.734 1.00 0.00 H new ATOM 0 HD11 LEU A 21 5.818 1.813 -2.649 1.00 0.00 H new ATOM 0 HD12 LEU A 21 6.002 0.067 -2.358 1.00 0.00 H new ATOM 0 HD13 LEU A 21 7.355 1.173 -2.019 1.00 0.00 H new ATOM 0 HD21 LEU A 21 6.933 2.887 -4.594 1.00 0.00 H new ATOM 0 HD22 LEU A 21 8.542 2.318 -4.091 1.00 0.00 H new ATOM 0 HD23 LEU A 21 7.923 1.919 -5.711 1.00 0.00 H new ATOM 296 N HIS A 22 10.667 -1.847 -5.713 1.00 0.00 N ATOM 297 CA HIS A 22 11.552 -2.998 -5.779 1.00 0.00 C ATOM 298 C HIS A 22 12.044 -3.349 -4.374 1.00 0.00 C ATOM 299 O HIS A 22 12.891 -2.652 -3.817 1.00 0.00 O ATOM 300 CB HIS A 22 12.696 -2.748 -6.764 1.00 0.00 C ATOM 301 CG HIS A 22 12.249 -2.587 -8.197 1.00 0.00 C ATOM 302 ND1 HIS A 22 13.090 -2.132 -9.198 1.00 0.00 N ATOM 303 CD2 HIS A 22 11.043 -2.827 -8.787 1.00 0.00 C ATOM 304 CE1 HIS A 22 12.409 -2.102 -10.334 1.00 0.00 C ATOM 305 NE2 HIS A 22 11.141 -2.532 -10.077 1.00 0.00 N ATOM 0 H HIS A 22 11.141 -0.944 -5.714 1.00 0.00 H new ATOM 0 HA HIS A 22 11.005 -3.861 -6.160 1.00 0.00 H new ATOM 0 HB2 HIS A 22 13.234 -1.851 -6.459 1.00 0.00 H new ATOM 0 HB3 HIS A 22 13.400 -3.578 -6.705 1.00 0.00 H new ATOM 0 HD2 HIS A 22 10.158 -3.195 -8.289 1.00 0.00 H new ATOM 0 HE1 HIS A 22 12.791 -1.791 -11.295 1.00 0.00 H new ATOM 0 HE2 HIS A 22 10.391 -2.614 -10.763 1.00 0.00 H new ATOM 313 N LYS A 23 11.493 -4.429 -3.841 1.00 0.00 N ATOM 314 CA LYS A 23 11.866 -4.881 -2.511 1.00 0.00 C ATOM 315 C LYS A 23 13.383 -4.770 -2.346 1.00 0.00 C ATOM 316 O LYS A 23 14.135 -5.520 -2.966 1.00 0.00 O ATOM 317 CB LYS A 23 11.320 -6.286 -2.250 1.00 0.00 C ATOM 318 CG LYS A 23 10.026 -6.229 -1.437 1.00 0.00 C ATOM 319 CD LYS A 23 9.828 -7.514 -0.630 1.00 0.00 C ATOM 320 CE LYS A 23 8.982 -8.525 -1.406 1.00 0.00 C ATOM 321 NZ LYS A 23 9.296 -9.905 -0.973 1.00 0.00 N ATOM 0 H LYS A 23 10.791 -5.005 -4.306 1.00 0.00 H new ATOM 0 HA LYS A 23 11.415 -4.243 -1.751 1.00 0.00 H new ATOM 0 HB2 LYS A 23 11.136 -6.790 -3.199 1.00 0.00 H new ATOM 0 HB3 LYS A 23 12.064 -6.876 -1.715 1.00 0.00 H new ATOM 0 HG2 LYS A 23 10.053 -5.373 -0.763 1.00 0.00 H new ATOM 0 HG3 LYS A 23 9.178 -6.081 -2.106 1.00 0.00 H new ATOM 0 HD2 LYS A 23 10.798 -7.952 -0.393 1.00 0.00 H new ATOM 0 HD3 LYS A 23 9.343 -7.281 0.318 1.00 0.00 H new ATOM 0 HE2 LYS A 23 7.923 -8.320 -1.247 1.00 0.00 H new ATOM 0 HE3 LYS A 23 9.170 -8.421 -2.475 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 8.666 -10.574 -1.460 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 10.284 -10.126 -1.209 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 9.159 -9.986 0.055 1.00 0.00 H new ATOM 335 N GLY A 24 13.787 -3.827 -1.507 1.00 0.00 N ATOM 336 CA GLY A 24 15.201 -3.608 -1.252 1.00 0.00 C ATOM 337 C GLY A 24 15.780 -4.723 -0.379 1.00 0.00 C ATOM 338 O GLY A 24 16.684 -5.442 -0.803 1.00 0.00 O ATOM 0 H GLY A 24 13.160 -3.206 -0.995 1.00 0.00 H new ATOM 0 HA2 GLY A 24 15.742 -3.563 -2.197 1.00 0.00 H new ATOM 0 HA3 GLY A 24 15.341 -2.646 -0.759 1.00 0.00 H new ATOM 342 N SER A 25 15.236 -4.833 0.824 1.00 0.00 N ATOM 343 CA SER A 25 15.688 -5.848 1.760 1.00 0.00 C ATOM 344 C SER A 25 14.612 -6.099 2.818 1.00 0.00 C ATOM 345 O SER A 25 14.155 -7.229 2.988 1.00 0.00 O ATOM 346 CB SER A 25 17.002 -5.437 2.426 1.00 0.00 C ATOM 347 OG SER A 25 18.031 -6.401 2.218 1.00 0.00 O ATOM 0 H SER A 25 14.486 -4.236 1.172 1.00 0.00 H new ATOM 0 HA SER A 25 15.866 -6.770 1.206 1.00 0.00 H new ATOM 0 HB2 SER A 25 17.323 -4.473 2.030 1.00 0.00 H new ATOM 0 HB3 SER A 25 16.840 -5.305 3.496 1.00 0.00 H new ATOM 0 HG SER A 25 18.854 -6.101 2.657 1.00 0.00 H new ATOM 353 N THR A 26 14.238 -5.028 3.502 1.00 0.00 N ATOM 354 CA THR A 26 13.225 -5.119 4.539 1.00 0.00 C ATOM 355 C THR A 26 11.846 -5.353 3.919 1.00 0.00 C ATOM 356 O THR A 26 11.133 -6.275 4.313 1.00 0.00 O ATOM 357 CB THR A 26 13.301 -3.847 5.387 1.00 0.00 C ATOM 358 OG1 THR A 26 13.049 -2.796 4.459 1.00 0.00 O ATOM 359 CG2 THR A 26 14.717 -3.565 5.894 1.00 0.00 C ATOM 0 H THR A 26 14.618 -4.093 3.358 1.00 0.00 H new ATOM 0 HA THR A 26 13.403 -5.974 5.191 1.00 0.00 H new ATOM 0 HB THR A 26 12.623 -3.935 6.236 1.00 0.00 H new ATOM 0 HG1 THR A 26 13.078 -1.934 4.925 1.00 0.00 H new ATOM 0 HG21 THR A 26 14.715 -2.652 6.490 1.00 0.00 H new ATOM 0 HG22 THR A 26 15.056 -4.399 6.509 1.00 0.00 H new ATOM 0 HG23 THR A 26 15.390 -3.443 5.045 1.00 0.00 H new ATOM 367 N GLY A 27 11.512 -4.504 2.959 1.00 0.00 N ATOM 368 CA GLY A 27 10.232 -4.607 2.280 1.00 0.00 C ATOM 369 C GLY A 27 10.118 -3.568 1.163 1.00 0.00 C ATOM 370 O GLY A 27 11.062 -3.363 0.402 1.00 0.00 O ATOM 0 H GLY A 27 12.106 -3.741 2.635 1.00 0.00 H new ATOM 0 HA2 GLY A 27 10.117 -5.608 1.864 1.00 0.00 H new ATOM 0 HA3 GLY A 27 9.424 -4.465 2.997 1.00 0.00 H new ATOM 374 N LEU A 28 8.954 -2.938 1.100 1.00 0.00 N ATOM 375 CA LEU A 28 8.704 -1.925 0.089 1.00 0.00 C ATOM 376 C LEU A 28 9.032 -0.546 0.663 1.00 0.00 C ATOM 377 O LEU A 28 9.073 0.442 -0.069 1.00 0.00 O ATOM 378 CB LEU A 28 7.277 -2.044 -0.448 1.00 0.00 C ATOM 379 CG LEU A 28 7.003 -3.237 -1.367 1.00 0.00 C ATOM 380 CD1 LEU A 28 8.149 -3.438 -2.360 1.00 0.00 C ATOM 381 CD2 LEU A 28 6.720 -4.502 -0.554 1.00 0.00 C ATOM 0 H LEU A 28 8.173 -3.110 1.733 1.00 0.00 H new ATOM 0 HA LEU A 28 9.357 -2.076 -0.771 1.00 0.00 H new ATOM 0 HB2 LEU A 28 6.594 -2.100 0.400 1.00 0.00 H new ATOM 0 HB3 LEU A 28 7.037 -1.130 -0.991 1.00 0.00 H new ATOM 0 HG LEU A 28 6.107 -3.022 -1.949 1.00 0.00 H new ATOM 0 HD11 LEU A 28 7.929 -4.292 -3.001 1.00 0.00 H new ATOM 0 HD12 LEU A 28 8.261 -2.543 -2.973 1.00 0.00 H new ATOM 0 HD13 LEU A 28 9.075 -3.622 -1.815 1.00 0.00 H new ATOM 0 HD21 LEU A 28 6.529 -5.334 -1.231 1.00 0.00 H new ATOM 0 HD22 LEU A 28 7.583 -4.733 0.071 1.00 0.00 H new ATOM 0 HD23 LEU A 28 5.847 -4.340 0.078 1.00 0.00 H new ATOM 393 N GLY A 29 9.256 -0.522 1.969 1.00 0.00 N ATOM 394 CA GLY A 29 9.579 0.720 2.650 1.00 0.00 C ATOM 395 C GLY A 29 8.320 1.557 2.890 1.00 0.00 C ATOM 396 O GLY A 29 8.317 2.763 2.649 1.00 0.00 O ATOM 0 H GLY A 29 9.220 -1.343 2.573 1.00 0.00 H new ATOM 0 HA2 GLY A 29 10.062 0.502 3.602 1.00 0.00 H new ATOM 0 HA3 GLY A 29 10.292 1.291 2.055 1.00 0.00 H new ATOM 400 N PHE A 30 7.282 0.883 3.362 1.00 0.00 N ATOM 401 CA PHE A 30 6.020 1.549 3.638 1.00 0.00 C ATOM 402 C PHE A 30 5.074 0.632 4.415 1.00 0.00 C ATOM 403 O PHE A 30 5.097 -0.585 4.236 1.00 0.00 O ATOM 404 CB PHE A 30 5.388 1.887 2.286 1.00 0.00 C ATOM 405 CG PHE A 30 4.728 0.694 1.593 1.00 0.00 C ATOM 406 CD1 PHE A 30 3.598 0.145 2.113 1.00 0.00 C ATOM 407 CD2 PHE A 30 5.270 0.183 0.455 1.00 0.00 C ATOM 408 CE1 PHE A 30 2.984 -0.962 1.470 1.00 0.00 C ATOM 409 CE2 PHE A 30 4.657 -0.924 -0.189 1.00 0.00 C ATOM 410 CZ PHE A 30 3.527 -1.473 0.332 1.00 0.00 C ATOM 0 H PHE A 30 7.289 -0.117 3.560 1.00 0.00 H new ATOM 0 HA PHE A 30 6.194 2.441 4.240 1.00 0.00 H new ATOM 0 HB2 PHE A 30 4.642 2.669 2.430 1.00 0.00 H new ATOM 0 HB3 PHE A 30 6.156 2.296 1.630 1.00 0.00 H new ATOM 0 HD1 PHE A 30 3.167 0.551 3.016 1.00 0.00 H new ATOM 0 HD2 PHE A 30 6.167 0.619 0.041 1.00 0.00 H new ATOM 0 HE1 PHE A 30 2.087 -1.398 1.884 1.00 0.00 H new ATOM 0 HE2 PHE A 30 5.088 -1.330 -1.092 1.00 0.00 H new ATOM 0 HZ PHE A 30 3.061 -2.315 -0.158 1.00 0.00 H new ATOM 420 N ASN A 31 4.264 1.251 5.261 1.00 0.00 N ATOM 421 CA ASN A 31 3.311 0.505 6.066 1.00 0.00 C ATOM 422 C ASN A 31 1.920 0.621 5.439 1.00 0.00 C ATOM 423 O ASN A 31 1.732 1.350 4.467 1.00 0.00 O ATOM 424 CB ASN A 31 3.237 1.062 7.489 1.00 0.00 C ATOM 425 CG ASN A 31 3.429 -0.048 8.523 1.00 0.00 C ATOM 426 OD1 ASN A 31 3.321 -1.228 8.233 1.00 0.00 O ATOM 427 ND2 ASN A 31 3.720 0.394 9.743 1.00 0.00 N ATOM 0 H ASN A 31 4.248 2.260 5.407 1.00 0.00 H new ATOM 0 HA ASN A 31 3.640 -0.534 6.102 1.00 0.00 H new ATOM 0 HB2 ASN A 31 4.002 1.826 7.624 1.00 0.00 H new ATOM 0 HB3 ASN A 31 2.273 1.546 7.644 1.00 0.00 H new ATOM 0 HD21 ASN A 31 3.868 -0.269 10.504 1.00 0.00 H new ATOM 0 HD22 ASN A 31 3.796 1.396 9.918 1.00 0.00 H new ATOM 434 N ILE A 32 0.981 -0.111 6.022 1.00 0.00 N ATOM 435 CA ILE A 32 -0.387 -0.099 5.533 1.00 0.00 C ATOM 436 C ILE A 32 -1.349 -0.059 6.723 1.00 0.00 C ATOM 437 O ILE A 32 -0.980 -0.429 7.836 1.00 0.00 O ATOM 438 CB ILE A 32 -0.628 -1.277 4.587 1.00 0.00 C ATOM 439 CG1 ILE A 32 -0.374 -2.610 5.296 1.00 0.00 C ATOM 440 CG2 ILE A 32 0.207 -1.137 3.313 1.00 0.00 C ATOM 441 CD1 ILE A 32 -1.276 -3.710 4.733 1.00 0.00 C ATOM 0 H ILE A 32 1.141 -0.716 6.828 1.00 0.00 H new ATOM 0 HA ILE A 32 -0.573 0.798 4.942 1.00 0.00 H new ATOM 0 HB ILE A 32 -1.676 -1.266 4.287 1.00 0.00 H new ATOM 0 HG12 ILE A 32 0.671 -2.896 5.178 1.00 0.00 H new ATOM 0 HG13 ILE A 32 -0.555 -2.498 6.365 1.00 0.00 H new ATOM 0 HG21 ILE A 32 0.017 -1.987 2.658 1.00 0.00 H new ATOM 0 HG22 ILE A 32 -0.065 -0.215 2.799 1.00 0.00 H new ATOM 0 HG23 ILE A 32 1.265 -1.109 3.573 1.00 0.00 H new ATOM 0 HD11 ILE A 32 -1.076 -4.647 5.253 1.00 0.00 H new ATOM 0 HD12 ILE A 32 -2.320 -3.432 4.875 1.00 0.00 H new ATOM 0 HD13 ILE A 32 -1.075 -3.836 3.669 1.00 0.00 H new ATOM 453 N VAL A 33 -2.563 0.394 6.446 1.00 0.00 N ATOM 454 CA VAL A 33 -3.580 0.488 7.479 1.00 0.00 C ATOM 455 C VAL A 33 -4.942 0.130 6.882 1.00 0.00 C ATOM 456 O VAL A 33 -5.052 -0.119 5.682 1.00 0.00 O ATOM 457 CB VAL A 33 -3.553 1.879 8.116 1.00 0.00 C ATOM 458 CG1 VAL A 33 -2.129 2.274 8.511 1.00 0.00 C ATOM 459 CG2 VAL A 33 -4.172 2.921 7.182 1.00 0.00 C ATOM 0 H VAL A 33 -2.865 0.700 5.521 1.00 0.00 H new ATOM 0 HA VAL A 33 -3.378 -0.225 8.279 1.00 0.00 H new ATOM 0 HB VAL A 33 -4.154 1.843 9.024 1.00 0.00 H new ATOM 0 HG11 VAL A 33 -2.138 3.267 8.961 1.00 0.00 H new ATOM 0 HG12 VAL A 33 -1.738 1.554 9.229 1.00 0.00 H new ATOM 0 HG13 VAL A 33 -1.495 2.284 7.624 1.00 0.00 H new ATOM 0 HG21 VAL A 33 -4.141 3.901 7.658 1.00 0.00 H new ATOM 0 HG22 VAL A 33 -3.610 2.953 6.249 1.00 0.00 H new ATOM 0 HG23 VAL A 33 -5.207 2.652 6.973 1.00 0.00 H new ATOM 469 N GLY A 34 -5.946 0.115 7.746 1.00 0.00 N ATOM 470 CA GLY A 34 -7.297 -0.208 7.319 1.00 0.00 C ATOM 471 C GLY A 34 -7.679 -1.629 7.738 1.00 0.00 C ATOM 472 O GLY A 34 -7.056 -2.207 8.627 1.00 0.00 O ATOM 0 H GLY A 34 -5.851 0.321 8.740 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -7.999 0.504 7.752 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -7.373 -0.111 6.236 1.00 0.00 H new ATOM 476 N GLY A 35 -8.703 -2.151 7.078 1.00 0.00 N ATOM 477 CA GLY A 35 -9.176 -3.493 7.372 1.00 0.00 C ATOM 478 C GLY A 35 -10.387 -3.456 8.306 1.00 0.00 C ATOM 479 O GLY A 35 -10.598 -4.380 9.091 1.00 0.00 O ATOM 0 H GLY A 35 -9.218 -1.669 6.341 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -9.443 -3.999 6.445 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -8.375 -4.072 7.832 1.00 0.00 H new ATOM 483 N GLU A 36 -11.149 -2.379 8.192 1.00 0.00 N ATOM 484 CA GLU A 36 -12.333 -2.209 9.017 1.00 0.00 C ATOM 485 C GLU A 36 -13.568 -2.004 8.138 1.00 0.00 C ATOM 486 O GLU A 36 -13.586 -1.121 7.282 1.00 0.00 O ATOM 487 CB GLU A 36 -12.158 -1.045 9.995 1.00 0.00 C ATOM 488 CG GLU A 36 -11.160 -1.403 11.099 1.00 0.00 C ATOM 489 CD GLU A 36 -11.573 -0.780 12.434 1.00 0.00 C ATOM 490 OE1 GLU A 36 -12.106 0.350 12.392 1.00 0.00 O ATOM 491 OE2 GLU A 36 -11.347 -1.448 13.466 1.00 0.00 O ATOM 0 H GLU A 36 -10.970 -1.615 7.541 1.00 0.00 H new ATOM 0 HA GLU A 36 -12.475 -3.116 9.604 1.00 0.00 H new ATOM 0 HB2 GLU A 36 -11.811 -0.163 9.458 1.00 0.00 H new ATOM 0 HB3 GLU A 36 -13.120 -0.790 10.438 1.00 0.00 H new ATOM 0 HG2 GLU A 36 -11.100 -2.486 11.202 1.00 0.00 H new ATOM 0 HG3 GLU A 36 -10.165 -1.053 10.823 1.00 0.00 H new ATOM 498 N ASP A 37 -14.571 -2.836 8.378 1.00 0.00 N ATOM 499 CA ASP A 37 -15.807 -2.758 7.619 1.00 0.00 C ATOM 500 C ASP A 37 -15.480 -2.530 6.142 1.00 0.00 C ATOM 501 O ASP A 37 -16.243 -1.884 5.426 1.00 0.00 O ATOM 502 CB ASP A 37 -16.674 -1.590 8.096 1.00 0.00 C ATOM 503 CG ASP A 37 -17.327 -1.787 9.466 1.00 0.00 C ATOM 504 OD1 ASP A 37 -17.312 -2.944 9.940 1.00 0.00 O ATOM 505 OD2 ASP A 37 -17.825 -0.777 10.008 1.00 0.00 O ATOM 0 H ASP A 37 -14.552 -3.568 9.088 1.00 0.00 H new ATOM 0 HA ASP A 37 -16.350 -3.693 7.762 1.00 0.00 H new ATOM 0 HB2 ASP A 37 -16.059 -0.691 8.129 1.00 0.00 H new ATOM 0 HB3 ASP A 37 -17.457 -1.414 7.359 1.00 0.00 H new ATOM 510 N GLY A 38 -14.344 -3.074 5.730 1.00 0.00 N ATOM 511 CA GLY A 38 -13.906 -2.938 4.351 1.00 0.00 C ATOM 512 C GLY A 38 -13.978 -1.480 3.894 1.00 0.00 C ATOM 513 O GLY A 38 -14.633 -1.168 2.901 1.00 0.00 O ATOM 0 H GLY A 38 -13.714 -3.610 6.327 1.00 0.00 H new ATOM 0 HA2 GLY A 38 -12.884 -3.304 4.253 1.00 0.00 H new ATOM 0 HA3 GLY A 38 -14.529 -3.556 3.705 1.00 0.00 H new ATOM 517 N GLU A 39 -13.294 -0.625 4.641 1.00 0.00 N ATOM 518 CA GLU A 39 -13.272 0.793 4.324 1.00 0.00 C ATOM 519 C GLU A 39 -12.216 1.082 3.256 1.00 0.00 C ATOM 520 O GLU A 39 -12.411 1.946 2.403 1.00 0.00 O ATOM 521 CB GLU A 39 -13.025 1.631 5.580 1.00 0.00 C ATOM 522 CG GLU A 39 -11.639 1.350 6.163 1.00 0.00 C ATOM 523 CD GLU A 39 -11.647 1.486 7.687 1.00 0.00 C ATOM 524 OE1 GLU A 39 -12.760 1.627 8.239 1.00 0.00 O ATOM 525 OE2 GLU A 39 -10.540 1.446 8.266 1.00 0.00 O ATOM 0 H GLU A 39 -12.751 -0.887 5.464 1.00 0.00 H new ATOM 0 HA GLU A 39 -14.248 1.072 3.927 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -13.114 2.690 5.338 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -13.789 1.409 6.325 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -11.321 0.345 5.886 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -10.914 2.043 5.736 1.00 0.00 H new ATOM 532 N GLY A 40 -11.120 0.342 3.338 1.00 0.00 N ATOM 533 CA GLY A 40 -10.032 0.508 2.388 1.00 0.00 C ATOM 534 C GLY A 40 -8.677 0.492 3.098 1.00 0.00 C ATOM 535 O GLY A 40 -8.603 0.701 4.308 1.00 0.00 O ATOM 0 H GLY A 40 -10.962 -0.374 4.047 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -10.067 -0.290 1.646 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -10.154 1.448 1.851 1.00 0.00 H new ATOM 539 N ILE A 41 -7.638 0.240 2.316 1.00 0.00 N ATOM 540 CA ILE A 41 -6.289 0.193 2.854 1.00 0.00 C ATOM 541 C ILE A 41 -5.576 1.512 2.547 1.00 0.00 C ATOM 542 O ILE A 41 -5.810 2.120 1.504 1.00 0.00 O ATOM 543 CB ILE A 41 -5.549 -1.042 2.338 1.00 0.00 C ATOM 544 CG1 ILE A 41 -6.364 -2.313 2.584 1.00 0.00 C ATOM 545 CG2 ILE A 41 -4.147 -1.134 2.944 1.00 0.00 C ATOM 546 CD1 ILE A 41 -6.246 -2.767 4.040 1.00 0.00 C ATOM 0 H ILE A 41 -7.703 0.066 1.313 1.00 0.00 H new ATOM 0 HA ILE A 41 -6.314 0.089 3.939 1.00 0.00 H new ATOM 0 HB ILE A 41 -5.428 -0.941 1.259 1.00 0.00 H new ATOM 0 HG12 ILE A 41 -7.411 -2.131 2.340 1.00 0.00 H new ATOM 0 HG13 ILE A 41 -6.016 -3.106 1.923 1.00 0.00 H new ATOM 0 HG21 ILE A 41 -3.642 -2.021 2.561 1.00 0.00 H new ATOM 0 HG22 ILE A 41 -3.575 -0.246 2.674 1.00 0.00 H new ATOM 0 HG23 ILE A 41 -4.223 -1.201 4.029 1.00 0.00 H new ATOM 0 HD11 ILE A 41 -6.835 -3.672 4.188 1.00 0.00 H new ATOM 0 HD12 ILE A 41 -5.201 -2.971 4.274 1.00 0.00 H new ATOM 0 HD13 ILE A 41 -6.618 -1.981 4.697 1.00 0.00 H new ATOM 558 N PHE A 42 -4.720 1.914 3.475 1.00 0.00 N ATOM 559 CA PHE A 42 -3.970 3.149 3.316 1.00 0.00 C ATOM 560 C PHE A 42 -2.554 3.007 3.877 1.00 0.00 C ATOM 561 O PHE A 42 -2.279 2.094 4.654 1.00 0.00 O ATOM 562 CB PHE A 42 -4.714 4.228 4.106 1.00 0.00 C ATOM 563 CG PHE A 42 -6.035 4.665 3.471 1.00 0.00 C ATOM 564 CD1 PHE A 42 -7.121 3.849 3.531 1.00 0.00 C ATOM 565 CD2 PHE A 42 -6.124 5.870 2.847 1.00 0.00 C ATOM 566 CE1 PHE A 42 -8.348 4.255 2.941 1.00 0.00 C ATOM 567 CE2 PHE A 42 -7.350 6.276 2.257 1.00 0.00 C ATOM 568 CZ PHE A 42 -8.436 5.460 2.317 1.00 0.00 C ATOM 0 H PHE A 42 -4.529 1.407 4.339 1.00 0.00 H new ATOM 0 HA PHE A 42 -3.889 3.402 2.259 1.00 0.00 H new ATOM 0 HB2 PHE A 42 -4.912 3.856 5.111 1.00 0.00 H new ATOM 0 HB3 PHE A 42 -4.067 5.099 4.210 1.00 0.00 H new ATOM 0 HD1 PHE A 42 -7.051 2.892 4.027 1.00 0.00 H new ATOM 0 HD2 PHE A 42 -5.262 6.519 2.800 1.00 0.00 H new ATOM 0 HE1 PHE A 42 -9.211 3.607 2.988 1.00 0.00 H new ATOM 0 HE2 PHE A 42 -7.420 7.233 1.761 1.00 0.00 H new ATOM 0 HZ PHE A 42 -9.369 5.769 1.869 1.00 0.00 H new ATOM 578 N VAL A 43 -1.693 3.924 3.461 1.00 0.00 N ATOM 579 CA VAL A 43 -0.312 3.913 3.913 1.00 0.00 C ATOM 580 C VAL A 43 -0.229 4.545 5.304 1.00 0.00 C ATOM 581 O VAL A 43 -0.803 5.606 5.542 1.00 0.00 O ATOM 582 CB VAL A 43 0.581 4.612 2.885 1.00 0.00 C ATOM 583 CG1 VAL A 43 1.974 4.875 3.458 1.00 0.00 C ATOM 584 CG2 VAL A 43 0.665 3.800 1.590 1.00 0.00 C ATOM 0 H VAL A 43 -1.925 4.679 2.816 1.00 0.00 H new ATOM 0 HA VAL A 43 0.053 2.889 3.999 1.00 0.00 H new ATOM 0 HB VAL A 43 0.129 5.575 2.648 1.00 0.00 H new ATOM 0 HG11 VAL A 43 2.588 5.372 2.707 1.00 0.00 H new ATOM 0 HG12 VAL A 43 1.891 5.512 4.339 1.00 0.00 H new ATOM 0 HG13 VAL A 43 2.437 3.929 3.737 1.00 0.00 H new ATOM 0 HG21 VAL A 43 1.305 4.318 0.876 1.00 0.00 H new ATOM 0 HG22 VAL A 43 1.082 2.816 1.804 1.00 0.00 H new ATOM 0 HG23 VAL A 43 -0.333 3.687 1.166 1.00 0.00 H new ATOM 594 N SER A 44 0.490 3.866 6.186 1.00 0.00 N ATOM 595 CA SER A 44 0.655 4.347 7.546 1.00 0.00 C ATOM 596 C SER A 44 1.979 5.103 7.677 1.00 0.00 C ATOM 597 O SER A 44 2.138 5.933 8.571 1.00 0.00 O ATOM 598 CB SER A 44 0.601 3.193 8.550 1.00 0.00 C ATOM 599 OG SER A 44 1.845 3.009 9.218 1.00 0.00 O ATOM 0 H SER A 44 0.965 2.986 5.984 1.00 0.00 H new ATOM 0 HA SER A 44 -0.168 5.026 7.770 1.00 0.00 H new ATOM 0 HB2 SER A 44 -0.180 3.388 9.285 1.00 0.00 H new ATOM 0 HB3 SER A 44 0.328 2.274 8.032 1.00 0.00 H new ATOM 0 HG SER A 44 1.769 2.265 9.851 1.00 0.00 H new ATOM 605 N PHE A 45 2.895 4.788 6.773 1.00 0.00 N ATOM 606 CA PHE A 45 4.200 5.427 6.776 1.00 0.00 C ATOM 607 C PHE A 45 5.054 4.935 5.606 1.00 0.00 C ATOM 608 O PHE A 45 4.711 3.950 4.954 1.00 0.00 O ATOM 609 CB PHE A 45 4.884 5.040 8.089 1.00 0.00 C ATOM 610 CG PHE A 45 6.354 5.456 8.171 1.00 0.00 C ATOM 611 CD1 PHE A 45 6.680 6.757 8.398 1.00 0.00 C ATOM 612 CD2 PHE A 45 7.334 4.526 8.016 1.00 0.00 C ATOM 613 CE1 PHE A 45 8.045 7.144 8.474 1.00 0.00 C ATOM 614 CE2 PHE A 45 8.698 4.913 8.093 1.00 0.00 C ATOM 615 CZ PHE A 45 9.025 6.213 8.320 1.00 0.00 C ATOM 0 H PHE A 45 2.759 4.099 6.034 1.00 0.00 H new ATOM 0 HA PHE A 45 4.086 6.507 6.679 1.00 0.00 H new ATOM 0 HB2 PHE A 45 4.341 5.495 8.917 1.00 0.00 H new ATOM 0 HB3 PHE A 45 4.815 3.960 8.218 1.00 0.00 H new ATOM 0 HD1 PHE A 45 5.902 7.496 8.520 1.00 0.00 H new ATOM 0 HD2 PHE A 45 7.075 3.493 7.834 1.00 0.00 H new ATOM 0 HE1 PHE A 45 8.304 8.177 8.654 1.00 0.00 H new ATOM 0 HE2 PHE A 45 9.476 4.174 7.971 1.00 0.00 H new ATOM 0 HZ PHE A 45 10.063 6.507 8.378 1.00 0.00 H new ATOM 625 N ILE A 46 6.149 5.644 5.375 1.00 0.00 N ATOM 626 CA ILE A 46 7.054 5.292 4.294 1.00 0.00 C ATOM 627 C ILE A 46 8.494 5.323 4.810 1.00 0.00 C ATOM 628 O ILE A 46 8.969 6.359 5.274 1.00 0.00 O ATOM 629 CB ILE A 46 6.816 6.193 3.081 1.00 0.00 C ATOM 630 CG1 ILE A 46 5.387 6.041 2.557 1.00 0.00 C ATOM 631 CG2 ILE A 46 7.857 5.931 1.990 1.00 0.00 C ATOM 632 CD1 ILE A 46 5.326 5.021 1.418 1.00 0.00 C ATOM 0 H ILE A 46 6.430 6.461 5.918 1.00 0.00 H new ATOM 0 HA ILE A 46 6.860 4.276 3.950 1.00 0.00 H new ATOM 0 HB ILE A 46 6.935 7.229 3.397 1.00 0.00 H new ATOM 0 HG12 ILE A 46 4.730 5.726 3.368 1.00 0.00 H new ATOM 0 HG13 ILE A 46 5.020 7.006 2.206 1.00 0.00 H new ATOM 0 HG21 ILE A 46 7.665 6.585 1.139 1.00 0.00 H new ATOM 0 HG22 ILE A 46 8.854 6.131 2.383 1.00 0.00 H new ATOM 0 HG23 ILE A 46 7.795 4.891 1.670 1.00 0.00 H new ATOM 0 HD11 ILE A 46 4.299 4.932 1.064 1.00 0.00 H new ATOM 0 HD12 ILE A 46 5.965 5.351 0.599 1.00 0.00 H new ATOM 0 HD13 ILE A 46 5.671 4.052 1.779 1.00 0.00 H new ATOM 644 N LEU A 47 9.149 4.176 4.712 1.00 0.00 N ATOM 645 CA LEU A 47 10.525 4.059 5.164 1.00 0.00 C ATOM 646 C LEU A 47 11.379 5.118 4.463 1.00 0.00 C ATOM 647 O LEU A 47 11.222 5.355 3.266 1.00 0.00 O ATOM 648 CB LEU A 47 11.034 2.630 4.967 1.00 0.00 C ATOM 649 CG LEU A 47 12.482 2.369 5.387 1.00 0.00 C ATOM 650 CD1 LEU A 47 13.459 2.834 4.305 1.00 0.00 C ATOM 651 CD2 LEU A 47 12.783 3.010 6.744 1.00 0.00 C ATOM 0 H LEU A 47 8.752 3.319 4.326 1.00 0.00 H new ATOM 0 HA LEU A 47 10.592 4.252 6.235 1.00 0.00 H new ATOM 0 HB2 LEU A 47 10.387 1.955 5.527 1.00 0.00 H new ATOM 0 HB3 LEU A 47 10.930 2.371 3.913 1.00 0.00 H new ATOM 0 HG LEU A 47 12.616 1.293 5.501 1.00 0.00 H new ATOM 0 HD11 LEU A 47 14.481 2.637 4.629 1.00 0.00 H new ATOM 0 HD12 LEU A 47 13.261 2.294 3.379 1.00 0.00 H new ATOM 0 HD13 LEU A 47 13.332 3.903 4.135 1.00 0.00 H new ATOM 0 HD21 LEU A 47 13.818 2.810 7.019 1.00 0.00 H new ATOM 0 HD22 LEU A 47 12.626 4.087 6.681 1.00 0.00 H new ATOM 0 HD23 LEU A 47 12.119 2.591 7.500 1.00 0.00 H new ATOM 663 N ALA A 48 12.265 5.726 5.238 1.00 0.00 N ATOM 664 CA ALA A 48 13.144 6.754 4.706 1.00 0.00 C ATOM 665 C ALA A 48 14.287 6.092 3.934 1.00 0.00 C ATOM 666 O ALA A 48 15.071 5.337 4.505 1.00 0.00 O ATOM 667 CB ALA A 48 13.648 7.637 5.850 1.00 0.00 C ATOM 0 H ALA A 48 12.393 5.527 6.230 1.00 0.00 H new ATOM 0 HA ALA A 48 12.605 7.397 4.010 1.00 0.00 H new ATOM 0 HB1 ALA A 48 14.307 8.408 5.451 1.00 0.00 H new ATOM 0 HB2 ALA A 48 12.800 8.107 6.348 1.00 0.00 H new ATOM 0 HB3 ALA A 48 14.196 7.026 6.567 1.00 0.00 H new ATOM 673 N GLY A 49 14.344 6.399 2.646 1.00 0.00 N ATOM 674 CA GLY A 49 15.378 5.844 1.790 1.00 0.00 C ATOM 675 C GLY A 49 14.892 4.566 1.102 1.00 0.00 C ATOM 676 O GLY A 49 15.543 4.063 0.187 1.00 0.00 O ATOM 0 H GLY A 49 13.691 7.025 2.175 1.00 0.00 H new ATOM 0 HA2 GLY A 49 15.666 6.579 1.038 1.00 0.00 H new ATOM 0 HA3 GLY A 49 16.267 5.627 2.382 1.00 0.00 H new ATOM 680 N GLY A 50 13.752 4.078 1.568 1.00 0.00 N ATOM 681 CA GLY A 50 13.171 2.869 1.010 1.00 0.00 C ATOM 682 C GLY A 50 12.780 3.075 -0.455 1.00 0.00 C ATOM 683 O GLY A 50 12.985 4.153 -1.011 1.00 0.00 O ATOM 0 H GLY A 50 13.215 4.498 2.326 1.00 0.00 H new ATOM 0 HA2 GLY A 50 13.885 2.049 1.088 1.00 0.00 H new ATOM 0 HA3 GLY A 50 12.292 2.583 1.588 1.00 0.00 H new ATOM 687 N PRO A 51 12.210 1.995 -1.055 1.00 0.00 N ATOM 688 CA PRO A 51 11.789 2.047 -2.444 1.00 0.00 C ATOM 689 C PRO A 51 10.499 2.856 -2.597 1.00 0.00 C ATOM 690 O PRO A 51 10.265 3.467 -3.638 1.00 0.00 O ATOM 691 CB PRO A 51 11.631 0.594 -2.862 1.00 0.00 C ATOM 692 CG PRO A 51 11.518 -0.201 -1.571 1.00 0.00 C ATOM 693 CD PRO A 51 11.953 0.702 -0.428 1.00 0.00 C ATOM 0 HA PRO A 51 12.511 2.556 -3.083 1.00 0.00 H new ATOM 0 HB2 PRO A 51 10.745 0.460 -3.482 1.00 0.00 H new ATOM 0 HB3 PRO A 51 12.486 0.262 -3.452 1.00 0.00 H new ATOM 0 HG2 PRO A 51 10.493 -0.541 -1.420 1.00 0.00 H new ATOM 0 HG3 PRO A 51 12.146 -1.091 -1.615 1.00 0.00 H new ATOM 0 HD2 PRO A 51 11.177 0.778 0.334 1.00 0.00 H new ATOM 0 HD3 PRO A 51 12.846 0.316 0.064 1.00 0.00 H new ATOM 701 N ALA A 52 9.696 2.834 -1.543 1.00 0.00 N ATOM 702 CA ALA A 52 8.437 3.558 -1.546 1.00 0.00 C ATOM 703 C ALA A 52 8.716 5.059 -1.461 1.00 0.00 C ATOM 704 O ALA A 52 7.970 5.866 -2.014 1.00 0.00 O ATOM 705 CB ALA A 52 7.559 3.061 -0.395 1.00 0.00 C ATOM 0 H ALA A 52 9.893 2.326 -0.681 1.00 0.00 H new ATOM 0 HA ALA A 52 7.893 3.377 -2.473 1.00 0.00 H new ATOM 0 HB1 ALA A 52 6.614 3.604 -0.397 1.00 0.00 H new ATOM 0 HB2 ALA A 52 7.365 1.996 -0.519 1.00 0.00 H new ATOM 0 HB3 ALA A 52 8.072 3.229 0.552 1.00 0.00 H new ATOM 711 N ASP A 53 9.793 5.390 -0.764 1.00 0.00 N ATOM 712 CA ASP A 53 10.180 6.780 -0.599 1.00 0.00 C ATOM 713 C ASP A 53 10.994 7.227 -1.816 1.00 0.00 C ATOM 714 O ASP A 53 10.620 8.176 -2.502 1.00 0.00 O ATOM 715 CB ASP A 53 11.051 6.966 0.646 1.00 0.00 C ATOM 716 CG ASP A 53 11.224 8.415 1.104 1.00 0.00 C ATOM 717 OD1 ASP A 53 10.275 9.199 0.879 1.00 0.00 O ATOM 718 OD2 ASP A 53 12.300 8.708 1.668 1.00 0.00 O ATOM 0 H ASP A 53 10.410 4.719 -0.307 1.00 0.00 H new ATOM 0 HA ASP A 53 9.271 7.372 -0.495 1.00 0.00 H new ATOM 0 HB2 ASP A 53 10.616 6.392 1.464 1.00 0.00 H new ATOM 0 HB3 ASP A 53 12.036 6.543 0.448 1.00 0.00 H new ATOM 723 N LEU A 54 12.091 6.520 -2.045 1.00 0.00 N ATOM 724 CA LEU A 54 12.960 6.831 -3.167 1.00 0.00 C ATOM 725 C LEU A 54 12.112 7.031 -4.424 1.00 0.00 C ATOM 726 O LEU A 54 12.261 8.030 -5.126 1.00 0.00 O ATOM 727 CB LEU A 54 14.043 5.761 -3.320 1.00 0.00 C ATOM 728 CG LEU A 54 15.135 5.754 -2.249 1.00 0.00 C ATOM 729 CD1 LEU A 54 16.276 4.811 -2.635 1.00 0.00 C ATOM 730 CD2 LEU A 54 15.635 7.173 -1.967 1.00 0.00 C ATOM 0 H LEU A 54 12.398 5.733 -1.473 1.00 0.00 H new ATOM 0 HA LEU A 54 13.491 7.766 -2.988 1.00 0.00 H new ATOM 0 HB2 LEU A 54 13.561 4.783 -3.326 1.00 0.00 H new ATOM 0 HB3 LEU A 54 14.517 5.889 -4.293 1.00 0.00 H new ATOM 0 HG LEU A 54 14.703 5.374 -1.323 1.00 0.00 H new ATOM 0 HD11 LEU A 54 17.039 4.825 -1.856 1.00 0.00 H new ATOM 0 HD12 LEU A 54 15.889 3.798 -2.746 1.00 0.00 H new ATOM 0 HD13 LEU A 54 16.714 5.137 -3.578 1.00 0.00 H new ATOM 0 HD21 LEU A 54 16.411 7.140 -1.202 1.00 0.00 H new ATOM 0 HD22 LEU A 54 16.045 7.603 -2.881 1.00 0.00 H new ATOM 0 HD23 LEU A 54 14.806 7.788 -1.617 1.00 0.00 H new ATOM 742 N SER A 55 11.240 6.064 -4.671 1.00 0.00 N ATOM 743 CA SER A 55 10.367 6.122 -5.831 1.00 0.00 C ATOM 744 C SER A 55 9.690 7.491 -5.910 1.00 0.00 C ATOM 745 O SER A 55 9.619 8.092 -6.981 1.00 0.00 O ATOM 746 CB SER A 55 9.315 5.011 -5.785 1.00 0.00 C ATOM 747 OG SER A 55 8.538 5.062 -4.591 1.00 0.00 O ATOM 0 H SER A 55 11.120 5.236 -4.087 1.00 0.00 H new ATOM 0 HA SER A 55 10.975 5.973 -6.723 1.00 0.00 H new ATOM 0 HB2 SER A 55 8.657 5.098 -6.650 1.00 0.00 H new ATOM 0 HB3 SER A 55 9.808 4.041 -5.856 1.00 0.00 H new ATOM 0 HG SER A 55 8.885 4.410 -3.947 1.00 0.00 H new ATOM 753 N GLY A 56 9.209 7.945 -4.761 1.00 0.00 N ATOM 754 CA GLY A 56 8.540 9.233 -4.687 1.00 0.00 C ATOM 755 C GLY A 56 7.046 9.092 -4.983 1.00 0.00 C ATOM 756 O GLY A 56 6.256 9.972 -4.644 1.00 0.00 O ATOM 0 H GLY A 56 9.269 7.444 -3.875 1.00 0.00 H new ATOM 0 HA2 GLY A 56 8.679 9.663 -3.695 1.00 0.00 H new ATOM 0 HA3 GLY A 56 8.992 9.923 -5.399 1.00 0.00 H new ATOM 760 N GLU A 57 6.702 7.978 -5.613 1.00 0.00 N ATOM 761 CA GLU A 57 5.316 7.711 -5.959 1.00 0.00 C ATOM 762 C GLU A 57 4.514 7.360 -4.704 1.00 0.00 C ATOM 763 O GLU A 57 3.478 7.966 -4.436 1.00 0.00 O ATOM 764 CB GLU A 57 5.217 6.596 -7.002 1.00 0.00 C ATOM 765 CG GLU A 57 6.185 6.842 -8.161 1.00 0.00 C ATOM 766 CD GLU A 57 5.985 8.237 -8.756 1.00 0.00 C ATOM 767 OE1 GLU A 57 5.117 8.355 -9.648 1.00 0.00 O ATOM 768 OE2 GLU A 57 6.705 9.155 -8.307 1.00 0.00 O ATOM 0 H GLU A 57 7.359 7.250 -5.893 1.00 0.00 H new ATOM 0 HA GLU A 57 4.891 8.614 -6.398 1.00 0.00 H new ATOM 0 HB2 GLU A 57 5.439 5.636 -6.536 1.00 0.00 H new ATOM 0 HB3 GLU A 57 4.197 6.538 -7.382 1.00 0.00 H new ATOM 0 HG2 GLU A 57 7.212 6.736 -7.811 1.00 0.00 H new ATOM 0 HG3 GLU A 57 6.032 6.088 -8.933 1.00 0.00 H new ATOM 775 N LEU A 58 5.024 6.383 -3.968 1.00 0.00 N ATOM 776 CA LEU A 58 4.368 5.944 -2.748 1.00 0.00 C ATOM 777 C LEU A 58 4.690 6.926 -1.620 1.00 0.00 C ATOM 778 O LEU A 58 5.857 7.157 -1.308 1.00 0.00 O ATOM 779 CB LEU A 58 4.743 4.496 -2.429 1.00 0.00 C ATOM 780 CG LEU A 58 3.855 3.782 -1.408 1.00 0.00 C ATOM 781 CD1 LEU A 58 2.479 4.445 -1.320 1.00 0.00 C ATOM 782 CD2 LEU A 58 3.753 2.288 -1.719 1.00 0.00 C ATOM 0 H LEU A 58 5.884 5.883 -4.193 1.00 0.00 H new ATOM 0 HA LEU A 58 3.285 5.947 -2.875 1.00 0.00 H new ATOM 0 HB2 LEU A 58 4.727 3.925 -3.357 1.00 0.00 H new ATOM 0 HB3 LEU A 58 5.769 4.480 -2.062 1.00 0.00 H new ATOM 0 HG LEU A 58 4.320 3.875 -0.427 1.00 0.00 H new ATOM 0 HD11 LEU A 58 1.868 3.918 -0.587 1.00 0.00 H new ATOM 0 HD12 LEU A 58 2.595 5.485 -1.015 1.00 0.00 H new ATOM 0 HD13 LEU A 58 1.993 4.405 -2.295 1.00 0.00 H new ATOM 0 HD21 LEU A 58 3.116 1.805 -0.978 1.00 0.00 H new ATOM 0 HD22 LEU A 58 3.323 2.151 -2.711 1.00 0.00 H new ATOM 0 HD23 LEU A 58 4.747 1.842 -1.690 1.00 0.00 H new ATOM 794 N ARG A 59 3.634 7.478 -1.039 1.00 0.00 N ATOM 795 CA ARG A 59 3.790 8.429 0.047 1.00 0.00 C ATOM 796 C ARG A 59 2.685 8.232 1.088 1.00 0.00 C ATOM 797 O ARG A 59 1.570 7.841 0.747 1.00 0.00 O ATOM 798 CB ARG A 59 3.743 9.868 -0.470 1.00 0.00 C ATOM 799 CG ARG A 59 4.599 10.027 -1.728 1.00 0.00 C ATOM 800 CD ARG A 59 5.239 11.415 -1.785 1.00 0.00 C ATOM 801 NE ARG A 59 6.687 11.294 -2.066 1.00 0.00 N ATOM 802 CZ ARG A 59 7.550 12.317 -2.014 1.00 0.00 C ATOM 803 NH1 ARG A 59 7.118 13.543 -1.692 1.00 0.00 N ATOM 804 NH2 ARG A 59 8.847 12.114 -2.284 1.00 0.00 N ATOM 0 H ARG A 59 2.667 7.284 -1.301 1.00 0.00 H new ATOM 0 HA ARG A 59 4.763 8.251 0.506 1.00 0.00 H new ATOM 0 HB2 ARG A 59 2.712 10.146 -0.690 1.00 0.00 H new ATOM 0 HB3 ARG A 59 4.098 10.548 0.304 1.00 0.00 H new ATOM 0 HG2 ARG A 59 5.377 9.263 -1.742 1.00 0.00 H new ATOM 0 HG3 ARG A 59 3.983 9.870 -2.613 1.00 0.00 H new ATOM 0 HD2 ARG A 59 4.759 12.014 -2.559 1.00 0.00 H new ATOM 0 HD3 ARG A 59 5.086 11.934 -0.839 1.00 0.00 H new ATOM 0 HE ARG A 59 7.050 10.374 -2.315 1.00 0.00 H new ATOM 0 HH11 ARG A 59 6.131 13.698 -1.486 1.00 0.00 H new ATOM 0 HH12 ARG A 59 7.776 14.322 -1.653 1.00 0.00 H new ATOM 0 HH21 ARG A 59 9.177 11.180 -2.529 1.00 0.00 H new ATOM 0 HH22 ARG A 59 9.504 12.893 -2.244 1.00 0.00 H new ATOM 818 N ARG A 60 3.034 8.513 2.335 1.00 0.00 N ATOM 819 CA ARG A 60 2.086 8.371 3.427 1.00 0.00 C ATOM 820 C ARG A 60 0.813 9.167 3.131 1.00 0.00 C ATOM 821 O ARG A 60 0.875 10.364 2.856 1.00 0.00 O ATOM 822 CB ARG A 60 2.688 8.858 4.746 1.00 0.00 C ATOM 823 CG ARG A 60 1.712 8.649 5.905 1.00 0.00 C ATOM 824 CD ARG A 60 2.213 9.339 7.176 1.00 0.00 C ATOM 825 NE ARG A 60 2.300 10.800 6.958 1.00 0.00 N ATOM 826 CZ ARG A 60 3.383 11.425 6.478 1.00 0.00 C ATOM 827 NH1 ARG A 60 4.478 10.721 6.161 1.00 0.00 N ATOM 828 NH2 ARG A 60 3.371 12.755 6.313 1.00 0.00 N ATOM 0 H ARG A 60 3.960 8.838 2.613 1.00 0.00 H new ATOM 0 HA ARG A 60 1.844 7.312 3.520 1.00 0.00 H new ATOM 0 HB2 ARG A 60 3.616 8.322 4.946 1.00 0.00 H new ATOM 0 HB3 ARG A 60 2.942 9.915 4.666 1.00 0.00 H new ATOM 0 HG2 ARG A 60 0.732 9.043 5.635 1.00 0.00 H new ATOM 0 HG3 ARG A 60 1.586 7.582 6.091 1.00 0.00 H new ATOM 0 HD2 ARG A 60 1.538 9.126 8.005 1.00 0.00 H new ATOM 0 HD3 ARG A 60 3.191 8.945 7.452 1.00 0.00 H new ATOM 0 HE ARG A 60 1.484 11.367 7.188 1.00 0.00 H new ATOM 0 HH11 ARG A 60 4.487 9.709 6.285 1.00 0.00 H new ATOM 0 HH12 ARG A 60 5.303 11.197 5.795 1.00 0.00 H new ATOM 0 HH21 ARG A 60 2.537 13.291 6.553 1.00 0.00 H new ATOM 0 HH22 ARG A 60 4.196 13.231 5.947 1.00 0.00 H new ATOM 842 N GLY A 61 -0.312 8.470 3.198 1.00 0.00 N ATOM 843 CA GLY A 61 -1.597 9.097 2.940 1.00 0.00 C ATOM 844 C GLY A 61 -2.325 8.402 1.788 1.00 0.00 C ATOM 845 O GLY A 61 -3.549 8.477 1.686 1.00 0.00 O ATOM 0 H GLY A 61 -0.360 7.477 3.427 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -2.212 9.058 3.839 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -1.450 10.150 2.699 1.00 0.00 H new ATOM 849 N ASP A 62 -1.542 7.741 0.948 1.00 0.00 N ATOM 850 CA ASP A 62 -2.097 7.033 -0.193 1.00 0.00 C ATOM 851 C ASP A 62 -3.091 5.980 0.300 1.00 0.00 C ATOM 852 O ASP A 62 -3.066 5.595 1.468 1.00 0.00 O ATOM 853 CB ASP A 62 -1.000 6.315 -0.982 1.00 0.00 C ATOM 854 CG ASP A 62 -0.529 7.042 -2.243 1.00 0.00 C ATOM 855 OD1 ASP A 62 -0.030 8.177 -2.091 1.00 0.00 O ATOM 856 OD2 ASP A 62 -0.680 6.445 -3.331 1.00 0.00 O ATOM 0 H ASP A 62 -0.527 7.681 1.035 1.00 0.00 H new ATOM 0 HA ASP A 62 -2.586 7.763 -0.838 1.00 0.00 H new ATOM 0 HB2 ASP A 62 -0.142 6.163 -0.327 1.00 0.00 H new ATOM 0 HB3 ASP A 62 -1.364 5.327 -1.265 1.00 0.00 H new ATOM 861 N ARG A 63 -3.944 5.543 -0.616 1.00 0.00 N ATOM 862 CA ARG A 63 -4.945 4.542 -0.289 1.00 0.00 C ATOM 863 C ARG A 63 -4.710 3.270 -1.106 1.00 0.00 C ATOM 864 O ARG A 63 -5.153 3.171 -2.249 1.00 0.00 O ATOM 865 CB ARG A 63 -6.356 5.063 -0.565 1.00 0.00 C ATOM 866 CG ARG A 63 -7.402 3.978 -0.306 1.00 0.00 C ATOM 867 CD ARG A 63 -8.760 4.374 -0.891 1.00 0.00 C ATOM 868 NE ARG A 63 -9.715 3.251 -0.760 1.00 0.00 N ATOM 869 CZ ARG A 63 -10.868 3.162 -1.436 1.00 0.00 C ATOM 870 NH1 ARG A 63 -11.217 4.130 -2.294 1.00 0.00 N ATOM 871 NH2 ARG A 63 -11.673 2.106 -1.253 1.00 0.00 N ATOM 0 H ARG A 63 -3.962 5.864 -1.584 1.00 0.00 H new ATOM 0 HA ARG A 63 -4.854 4.318 0.774 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -6.559 5.927 0.068 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -6.427 5.402 -1.599 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -7.072 3.037 -0.747 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -7.499 3.810 0.767 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -9.146 5.252 -0.374 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -8.648 4.646 -1.941 1.00 0.00 H new ATOM 0 HE ARG A 63 -9.480 2.497 -0.114 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -10.605 4.934 -2.432 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -12.095 4.063 -2.809 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -11.408 1.370 -0.599 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -12.551 2.039 -1.768 1.00 0.00 H new ATOM 885 N ILE A 64 -4.012 2.328 -0.488 1.00 0.00 N ATOM 886 CA ILE A 64 -3.713 1.066 -1.144 1.00 0.00 C ATOM 887 C ILE A 64 -5.010 0.451 -1.672 1.00 0.00 C ATOM 888 O ILE A 64 -5.976 0.295 -0.926 1.00 0.00 O ATOM 889 CB ILE A 64 -2.933 0.145 -0.204 1.00 0.00 C ATOM 890 CG1 ILE A 64 -1.592 0.770 0.188 1.00 0.00 C ATOM 891 CG2 ILE A 64 -2.760 -1.245 -0.818 1.00 0.00 C ATOM 892 CD1 ILE A 64 -0.621 0.770 -0.995 1.00 0.00 C ATOM 0 H ILE A 64 -3.645 2.413 0.460 1.00 0.00 H new ATOM 0 HA ILE A 64 -3.064 1.228 -2.004 1.00 0.00 H new ATOM 0 HB ILE A 64 -3.511 0.023 0.712 1.00 0.00 H new ATOM 0 HG12 ILE A 64 -1.750 1.792 0.534 1.00 0.00 H new ATOM 0 HG13 ILE A 64 -1.158 0.216 1.020 1.00 0.00 H new ATOM 0 HG21 ILE A 64 -2.202 -1.880 -0.130 1.00 0.00 H new ATOM 0 HG22 ILE A 64 -3.740 -1.685 -1.005 1.00 0.00 H new ATOM 0 HG23 ILE A 64 -2.214 -1.162 -1.758 1.00 0.00 H new ATOM 0 HD11 ILE A 64 0.324 1.219 -0.690 1.00 0.00 H new ATOM 0 HD12 ILE A 64 -0.447 -0.255 -1.323 1.00 0.00 H new ATOM 0 HD13 ILE A 64 -1.048 1.346 -1.816 1.00 0.00 H new ATOM 904 N LEU A 65 -4.991 0.116 -2.954 1.00 0.00 N ATOM 905 CA LEU A 65 -6.154 -0.479 -3.590 1.00 0.00 C ATOM 906 C LEU A 65 -5.835 -1.925 -3.974 1.00 0.00 C ATOM 907 O LEU A 65 -6.621 -2.831 -3.702 1.00 0.00 O ATOM 908 CB LEU A 65 -6.620 0.381 -4.766 1.00 0.00 C ATOM 909 CG LEU A 65 -7.498 1.583 -4.411 1.00 0.00 C ATOM 910 CD1 LEU A 65 -7.650 2.523 -5.608 1.00 0.00 C ATOM 911 CD2 LEU A 65 -8.852 1.130 -3.862 1.00 0.00 C ATOM 0 H LEU A 65 -4.188 0.245 -3.570 1.00 0.00 H new ATOM 0 HA LEU A 65 -6.994 -0.511 -2.896 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -5.740 0.743 -5.297 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -7.171 -0.254 -5.459 1.00 0.00 H new ATOM 0 HG LEU A 65 -7.003 2.146 -3.620 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -8.278 3.369 -5.329 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -6.668 2.885 -5.913 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -8.112 1.986 -6.436 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -9.456 2.004 -3.618 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -9.367 0.531 -4.613 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -8.699 0.532 -2.964 1.00 0.00 H new ATOM 923 N SER A 66 -4.680 -2.097 -4.601 1.00 0.00 N ATOM 924 CA SER A 66 -4.247 -3.417 -5.025 1.00 0.00 C ATOM 925 C SER A 66 -2.721 -3.510 -4.973 1.00 0.00 C ATOM 926 O SER A 66 -2.029 -2.508 -5.145 1.00 0.00 O ATOM 927 CB SER A 66 -4.751 -3.735 -6.435 1.00 0.00 C ATOM 928 OG SER A 66 -4.497 -2.669 -7.345 1.00 0.00 O ATOM 0 H SER A 66 -4.031 -1.343 -4.825 1.00 0.00 H new ATOM 0 HA SER A 66 -4.672 -4.152 -4.342 1.00 0.00 H new ATOM 0 HB2 SER A 66 -4.268 -4.643 -6.796 1.00 0.00 H new ATOM 0 HB3 SER A 66 -5.822 -3.935 -6.401 1.00 0.00 H new ATOM 0 HG SER A 66 -4.832 -2.911 -8.234 1.00 0.00 H new ATOM 934 N VAL A 67 -2.242 -4.722 -4.736 1.00 0.00 N ATOM 935 CA VAL A 67 -0.810 -4.959 -4.659 1.00 0.00 C ATOM 936 C VAL A 67 -0.426 -6.061 -5.648 1.00 0.00 C ATOM 937 O VAL A 67 -0.838 -7.210 -5.493 1.00 0.00 O ATOM 938 CB VAL A 67 -0.409 -5.281 -3.218 1.00 0.00 C ATOM 939 CG1 VAL A 67 0.913 -6.049 -3.176 1.00 0.00 C ATOM 940 CG2 VAL A 67 -0.332 -4.009 -2.373 1.00 0.00 C ATOM 0 H VAL A 67 -2.820 -5.551 -4.595 1.00 0.00 H new ATOM 0 HA VAL A 67 -0.259 -4.062 -4.942 1.00 0.00 H new ATOM 0 HB VAL A 67 -1.181 -5.920 -2.790 1.00 0.00 H new ATOM 0 HG11 VAL A 67 1.175 -6.265 -2.140 1.00 0.00 H new ATOM 0 HG12 VAL A 67 0.808 -6.984 -3.727 1.00 0.00 H new ATOM 0 HG13 VAL A 67 1.699 -5.446 -3.631 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -0.045 -4.266 -1.353 1.00 0.00 H new ATOM 0 HG22 VAL A 67 0.410 -3.333 -2.799 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -1.306 -3.519 -2.363 1.00 0.00 H new ATOM 950 N ASN A 68 0.359 -5.673 -6.643 1.00 0.00 N ATOM 951 CA ASN A 68 0.803 -6.615 -7.656 1.00 0.00 C ATOM 952 C ASN A 68 -0.413 -7.154 -8.413 1.00 0.00 C ATOM 953 O ASN A 68 -0.511 -8.354 -8.663 1.00 0.00 O ATOM 954 CB ASN A 68 1.530 -7.803 -7.024 1.00 0.00 C ATOM 955 CG ASN A 68 2.618 -8.340 -7.957 1.00 0.00 C ATOM 956 OD1 ASN A 68 2.577 -8.168 -9.164 1.00 0.00 O ATOM 957 ND2 ASN A 68 3.589 -8.999 -7.332 1.00 0.00 N ATOM 0 H ASN A 68 0.699 -4.719 -6.769 1.00 0.00 H new ATOM 0 HA ASN A 68 1.484 -6.091 -8.327 1.00 0.00 H new ATOM 0 HB2 ASN A 68 1.976 -7.499 -6.077 1.00 0.00 H new ATOM 0 HB3 ASN A 68 0.815 -8.594 -6.800 1.00 0.00 H new ATOM 0 HD21 ASN A 68 4.361 -9.397 -7.866 1.00 0.00 H new ATOM 0 HD22 ASN A 68 3.562 -9.106 -6.318 1.00 0.00 H new ATOM 964 N GLY A 69 -1.309 -6.240 -8.757 1.00 0.00 N ATOM 965 CA GLY A 69 -2.514 -6.608 -9.480 1.00 0.00 C ATOM 966 C GLY A 69 -3.393 -7.540 -8.643 1.00 0.00 C ATOM 967 O GLY A 69 -3.880 -8.553 -9.141 1.00 0.00 O ATOM 0 H GLY A 69 -1.224 -5.245 -8.548 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -3.075 -5.710 -9.740 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -2.245 -7.099 -10.416 1.00 0.00 H new ATOM 971 N VAL A 70 -3.568 -7.163 -7.385 1.00 0.00 N ATOM 972 CA VAL A 70 -4.380 -7.952 -6.474 1.00 0.00 C ATOM 973 C VAL A 70 -5.454 -7.058 -5.850 1.00 0.00 C ATOM 974 O VAL A 70 -5.137 -6.089 -5.161 1.00 0.00 O ATOM 975 CB VAL A 70 -3.488 -8.630 -5.432 1.00 0.00 C ATOM 976 CG1 VAL A 70 -4.329 -9.360 -4.383 1.00 0.00 C ATOM 977 CG2 VAL A 70 -2.495 -9.584 -6.099 1.00 0.00 C ATOM 0 H VAL A 70 -3.162 -6.322 -6.975 1.00 0.00 H new ATOM 0 HA VAL A 70 -4.893 -8.749 -7.012 1.00 0.00 H new ATOM 0 HB VAL A 70 -2.917 -7.854 -4.923 1.00 0.00 H new ATOM 0 HG11 VAL A 70 -3.671 -9.833 -3.654 1.00 0.00 H new ATOM 0 HG12 VAL A 70 -4.978 -8.646 -3.876 1.00 0.00 H new ATOM 0 HG13 VAL A 70 -4.938 -10.121 -4.870 1.00 0.00 H new ATOM 0 HG21 VAL A 70 -1.873 -10.053 -5.337 1.00 0.00 H new ATOM 0 HG22 VAL A 70 -3.041 -10.353 -6.646 1.00 0.00 H new ATOM 0 HG23 VAL A 70 -1.863 -9.026 -6.790 1.00 0.00 H new ATOM 987 N ASN A 71 -6.702 -7.414 -6.114 1.00 0.00 N ATOM 988 CA ASN A 71 -7.824 -6.657 -5.588 1.00 0.00 C ATOM 989 C ASN A 71 -7.845 -6.777 -4.063 1.00 0.00 C ATOM 990 O ASN A 71 -8.043 -7.866 -3.525 1.00 0.00 O ATOM 991 CB ASN A 71 -9.153 -7.196 -6.122 1.00 0.00 C ATOM 992 CG ASN A 71 -10.189 -6.077 -6.244 1.00 0.00 C ATOM 993 OD1 ASN A 71 -11.115 -5.965 -5.457 1.00 0.00 O ATOM 994 ND2 ASN A 71 -9.984 -5.259 -7.272 1.00 0.00 N ATOM 0 H ASN A 71 -6.961 -8.218 -6.686 1.00 0.00 H new ATOM 0 HA ASN A 71 -7.705 -5.619 -5.899 1.00 0.00 H new ATOM 0 HB2 ASN A 71 -8.997 -7.659 -7.096 1.00 0.00 H new ATOM 0 HB3 ASN A 71 -9.528 -7.973 -5.456 1.00 0.00 H new ATOM 0 HD21 ASN A 71 -10.622 -4.481 -7.440 1.00 0.00 H new ATOM 0 HD22 ASN A 71 -9.189 -5.409 -7.893 1.00 0.00 H new ATOM 1001 N LEU A 72 -7.638 -5.644 -3.408 1.00 0.00 N ATOM 1002 CA LEU A 72 -7.630 -5.609 -1.956 1.00 0.00 C ATOM 1003 C LEU A 72 -8.401 -4.378 -1.475 1.00 0.00 C ATOM 1004 O LEU A 72 -8.247 -3.952 -0.332 1.00 0.00 O ATOM 1005 CB LEU A 72 -6.196 -5.682 -1.426 1.00 0.00 C ATOM 1006 CG LEU A 72 -5.381 -6.901 -1.863 1.00 0.00 C ATOM 1007 CD1 LEU A 72 -3.881 -6.611 -1.792 1.00 0.00 C ATOM 1008 CD2 LEU A 72 -5.765 -8.138 -1.049 1.00 0.00 C ATOM 0 H LEU A 72 -7.474 -4.743 -3.857 1.00 0.00 H new ATOM 0 HA LEU A 72 -8.140 -6.483 -1.551 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -5.667 -4.783 -1.742 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -6.231 -5.665 -0.337 1.00 0.00 H new ATOM 0 HG LEU A 72 -5.619 -7.115 -2.905 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -3.324 -7.493 -2.108 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -3.640 -5.776 -2.450 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -3.608 -6.357 -0.768 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -5.171 -8.990 -1.380 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -5.575 -7.951 0.008 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -6.823 -8.355 -1.194 1.00 0.00 H new ATOM 1020 N ARG A 73 -9.214 -3.840 -2.373 1.00 0.00 N ATOM 1021 CA ARG A 73 -10.009 -2.667 -2.055 1.00 0.00 C ATOM 1022 C ARG A 73 -10.576 -2.778 -0.639 1.00 0.00 C ATOM 1023 O ARG A 73 -10.162 -2.046 0.259 1.00 0.00 O ATOM 1024 CB ARG A 73 -11.161 -2.497 -3.047 1.00 0.00 C ATOM 1025 CG ARG A 73 -10.667 -1.896 -4.364 1.00 0.00 C ATOM 1026 CD ARG A 73 -11.670 -2.148 -5.492 1.00 0.00 C ATOM 1027 NE ARG A 73 -12.401 -0.901 -5.808 1.00 0.00 N ATOM 1028 CZ ARG A 73 -11.869 0.134 -6.472 1.00 0.00 C ATOM 1029 NH1 ARG A 73 -10.598 0.077 -6.894 1.00 0.00 N ATOM 1030 NH2 ARG A 73 -12.607 1.226 -6.713 1.00 0.00 N ATOM 0 H ARG A 73 -9.339 -4.196 -3.321 1.00 0.00 H new ATOM 0 HA ARG A 73 -9.357 -1.796 -2.121 1.00 0.00 H new ATOM 0 HB2 ARG A 73 -11.628 -3.464 -3.237 1.00 0.00 H new ATOM 0 HB3 ARG A 73 -11.926 -1.853 -2.614 1.00 0.00 H new ATOM 0 HG2 ARG A 73 -10.512 -0.824 -4.243 1.00 0.00 H new ATOM 0 HG3 ARG A 73 -9.702 -2.330 -4.627 1.00 0.00 H new ATOM 0 HD2 ARG A 73 -11.149 -2.508 -6.379 1.00 0.00 H new ATOM 0 HD3 ARG A 73 -12.373 -2.927 -5.197 1.00 0.00 H new ATOM 0 HE ARG A 73 -13.371 -0.824 -5.501 1.00 0.00 H new ATOM 0 HH11 ARG A 73 -10.036 -0.754 -6.710 1.00 0.00 H new ATOM 0 HH12 ARG A 73 -10.193 0.865 -7.400 1.00 0.00 H new ATOM 0 HH21 ARG A 73 -13.574 1.269 -6.391 1.00 0.00 H new ATOM 0 HH22 ARG A 73 -12.202 2.014 -7.218 1.00 0.00 H new ATOM 1044 N ASN A 74 -11.515 -3.699 -0.482 1.00 0.00 N ATOM 1045 CA ASN A 74 -12.143 -3.916 0.810 1.00 0.00 C ATOM 1046 C ASN A 74 -11.578 -5.190 1.440 1.00 0.00 C ATOM 1047 O ASN A 74 -12.332 -6.078 1.836 1.00 0.00 O ATOM 1048 CB ASN A 74 -13.656 -4.091 0.664 1.00 0.00 C ATOM 1049 CG ASN A 74 -14.259 -2.970 -0.185 1.00 0.00 C ATOM 1050 OD1 ASN A 74 -13.846 -2.713 -1.303 1.00 0.00 O ATOM 1051 ND2 ASN A 74 -15.256 -2.319 0.408 1.00 0.00 N ATOM 0 H ASN A 74 -11.856 -4.304 -1.229 1.00 0.00 H new ATOM 0 HA ASN A 74 -11.939 -3.046 1.434 1.00 0.00 H new ATOM 0 HB2 ASN A 74 -13.871 -5.056 0.205 1.00 0.00 H new ATOM 0 HB3 ASN A 74 -14.122 -4.096 1.649 1.00 0.00 H new ATOM 0 HD21 ASN A 74 -15.724 -1.553 -0.076 1.00 0.00 H new ATOM 0 HD22 ASN A 74 -15.552 -2.586 1.347 1.00 0.00 H new ATOM 1058 N ALA A 75 -10.256 -5.240 1.513 1.00 0.00 N ATOM 1059 CA ALA A 75 -9.582 -6.391 2.089 1.00 0.00 C ATOM 1060 C ALA A 75 -9.074 -6.033 3.487 1.00 0.00 C ATOM 1061 O ALA A 75 -8.713 -4.886 3.746 1.00 0.00 O ATOM 1062 CB ALA A 75 -8.454 -6.840 1.157 1.00 0.00 C ATOM 0 H ALA A 75 -9.634 -4.502 1.183 1.00 0.00 H new ATOM 0 HA ALA A 75 -10.273 -7.228 2.194 1.00 0.00 H new ATOM 0 HB1 ALA A 75 -7.948 -7.704 1.588 1.00 0.00 H new ATOM 0 HB2 ALA A 75 -8.870 -7.111 0.186 1.00 0.00 H new ATOM 0 HB3 ALA A 75 -7.740 -6.026 1.032 1.00 0.00 H new ATOM 1068 N THR A 76 -9.064 -7.036 4.353 1.00 0.00 N ATOM 1069 CA THR A 76 -8.607 -6.842 5.718 1.00 0.00 C ATOM 1070 C THR A 76 -7.120 -6.479 5.737 1.00 0.00 C ATOM 1071 O THR A 76 -6.406 -6.723 4.765 1.00 0.00 O ATOM 1072 CB THR A 76 -8.933 -8.109 6.511 1.00 0.00 C ATOM 1073 OG1 THR A 76 -8.281 -9.149 5.787 1.00 0.00 O ATOM 1074 CG2 THR A 76 -10.416 -8.478 6.440 1.00 0.00 C ATOM 0 H THR A 76 -9.365 -7.986 4.135 1.00 0.00 H new ATOM 0 HA THR A 76 -9.120 -6.004 6.191 1.00 0.00 H new ATOM 0 HB THR A 76 -8.643 -7.970 7.553 1.00 0.00 H new ATOM 0 HG1 THR A 76 -8.439 -10.007 6.233 1.00 0.00 H new ATOM 0 HG21 THR A 76 -10.594 -9.384 7.019 1.00 0.00 H new ATOM 0 HG22 THR A 76 -11.014 -7.663 6.849 1.00 0.00 H new ATOM 0 HG23 THR A 76 -10.699 -8.650 5.401 1.00 0.00 H new ATOM 1082 N HIS A 77 -6.698 -5.903 6.853 1.00 0.00 N ATOM 1083 CA HIS A 77 -5.310 -5.505 7.011 1.00 0.00 C ATOM 1084 C HIS A 77 -4.395 -6.670 6.628 1.00 0.00 C ATOM 1085 O HIS A 77 -3.338 -6.464 6.033 1.00 0.00 O ATOM 1086 CB HIS A 77 -5.051 -4.988 8.427 1.00 0.00 C ATOM 1087 CG HIS A 77 -3.694 -4.350 8.610 1.00 0.00 C ATOM 1088 ND1 HIS A 77 -3.168 -4.051 9.854 1.00 0.00 N ATOM 1089 CD2 HIS A 77 -2.762 -3.960 7.693 1.00 0.00 C ATOM 1090 CE1 HIS A 77 -1.973 -3.504 9.682 1.00 0.00 C ATOM 1091 NE2 HIS A 77 -1.724 -3.448 8.342 1.00 0.00 N ATOM 0 H HIS A 77 -7.293 -5.702 7.657 1.00 0.00 H new ATOM 0 HA HIS A 77 -5.087 -4.677 6.338 1.00 0.00 H new ATOM 0 HB2 HIS A 77 -5.821 -4.260 8.683 1.00 0.00 H new ATOM 0 HB3 HIS A 77 -5.149 -5.816 9.129 1.00 0.00 H new ATOM 0 HD1 HIS A 77 -3.622 -4.222 10.751 1.00 0.00 H new ATOM 0 HD2 HIS A 77 -2.854 -4.052 6.621 1.00 0.00 H new ATOM 0 HE1 HIS A 77 -1.312 -3.163 10.465 1.00 0.00 H new ATOM 1099 N GLU A 78 -4.835 -7.868 6.984 1.00 0.00 N ATOM 1100 CA GLU A 78 -4.069 -9.066 6.686 1.00 0.00 C ATOM 1101 C GLU A 78 -4.117 -9.366 5.186 1.00 0.00 C ATOM 1102 O GLU A 78 -3.078 -9.520 4.547 1.00 0.00 O ATOM 1103 CB GLU A 78 -4.575 -10.257 7.501 1.00 0.00 C ATOM 1104 CG GLU A 78 -4.134 -11.580 6.870 1.00 0.00 C ATOM 1105 CD GLU A 78 -4.582 -12.770 7.722 1.00 0.00 C ATOM 1106 OE1 GLU A 78 -3.972 -12.961 8.796 1.00 0.00 O ATOM 1107 OE2 GLU A 78 -5.524 -13.461 7.279 1.00 0.00 O ATOM 0 H GLU A 78 -5.713 -8.035 7.476 1.00 0.00 H new ATOM 0 HA GLU A 78 -3.031 -8.891 6.968 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -4.196 -10.192 8.521 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -5.663 -10.224 7.563 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -4.554 -11.667 5.868 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -3.049 -11.592 6.763 1.00 0.00 H new ATOM 1114 N GLN A 79 -5.335 -9.441 4.669 1.00 0.00 N ATOM 1115 CA GLN A 79 -5.532 -9.721 3.257 1.00 0.00 C ATOM 1116 C GLN A 79 -4.640 -8.815 2.407 1.00 0.00 C ATOM 1117 O GLN A 79 -4.131 -9.236 1.369 1.00 0.00 O ATOM 1118 CB GLN A 79 -7.003 -9.564 2.867 1.00 0.00 C ATOM 1119 CG GLN A 79 -7.836 -10.738 3.386 1.00 0.00 C ATOM 1120 CD GLN A 79 -9.322 -10.375 3.440 1.00 0.00 C ATOM 1121 OE1 GLN A 79 -9.757 -9.355 2.932 1.00 0.00 O ATOM 1122 NE2 GLN A 79 -10.073 -11.265 4.082 1.00 0.00 N ATOM 0 H GLN A 79 -6.195 -9.313 5.203 1.00 0.00 H new ATOM 0 HA GLN A 79 -5.249 -10.757 3.069 1.00 0.00 H new ATOM 0 HB2 GLN A 79 -7.393 -8.630 3.272 1.00 0.00 H new ATOM 0 HB3 GLN A 79 -7.091 -9.503 1.782 1.00 0.00 H new ATOM 0 HG2 GLN A 79 -7.693 -11.604 2.740 1.00 0.00 H new ATOM 0 HG3 GLN A 79 -7.491 -11.022 4.380 1.00 0.00 H new ATOM 0 HE21 GLN A 79 -9.644 -12.099 4.484 1.00 0.00 H new ATOM 0 HE22 GLN A 79 -11.078 -11.114 4.172 1.00 0.00 H new ATOM 1131 N ALA A 80 -4.477 -7.587 2.878 1.00 0.00 N ATOM 1132 CA ALA A 80 -3.655 -6.618 2.174 1.00 0.00 C ATOM 1133 C ALA A 80 -2.179 -6.962 2.380 1.00 0.00 C ATOM 1134 O ALA A 80 -1.345 -6.674 1.523 1.00 0.00 O ATOM 1135 CB ALA A 80 -3.998 -5.208 2.660 1.00 0.00 C ATOM 0 H ALA A 80 -4.901 -7.241 3.739 1.00 0.00 H new ATOM 0 HA ALA A 80 -3.855 -6.652 1.103 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -3.381 -4.481 2.132 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -5.050 -5.002 2.464 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -3.807 -5.136 3.731 1.00 0.00 H new ATOM 1141 N ALA A 81 -1.901 -7.575 3.521 1.00 0.00 N ATOM 1142 CA ALA A 81 -0.539 -7.962 3.850 1.00 0.00 C ATOM 1143 C ALA A 81 -0.197 -9.269 3.132 1.00 0.00 C ATOM 1144 O ALA A 81 0.943 -9.475 2.719 1.00 0.00 O ATOM 1145 CB ALA A 81 -0.394 -8.077 5.369 1.00 0.00 C ATOM 0 H ALA A 81 -2.595 -7.813 4.229 1.00 0.00 H new ATOM 0 HA ALA A 81 0.168 -7.205 3.511 1.00 0.00 H new ATOM 0 HB1 ALA A 81 0.627 -8.367 5.616 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -0.620 -7.115 5.830 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -1.086 -8.831 5.745 1.00 0.00 H new ATOM 1151 N ALA A 82 -1.206 -10.119 3.004 1.00 0.00 N ATOM 1152 CA ALA A 82 -1.027 -11.400 2.343 1.00 0.00 C ATOM 1153 C ALA A 82 -0.420 -11.173 0.956 1.00 0.00 C ATOM 1154 O ALA A 82 0.164 -12.085 0.374 1.00 0.00 O ATOM 1155 CB ALA A 82 -2.368 -12.134 2.279 1.00 0.00 C ATOM 0 H ALA A 82 -2.151 -9.945 3.347 1.00 0.00 H new ATOM 0 HA ALA A 82 -0.338 -12.029 2.906 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -2.233 -13.095 1.783 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -2.742 -12.297 3.290 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -3.085 -11.534 1.719 1.00 0.00 H new ATOM 1161 N ALA A 83 -0.580 -9.951 0.469 1.00 0.00 N ATOM 1162 CA ALA A 83 -0.055 -9.593 -0.838 1.00 0.00 C ATOM 1163 C ALA A 83 1.426 -9.233 -0.707 1.00 0.00 C ATOM 1164 O ALA A 83 2.256 -9.717 -1.475 1.00 0.00 O ATOM 1165 CB ALA A 83 -0.884 -8.448 -1.425 1.00 0.00 C ATOM 0 H ALA A 83 -1.065 -9.197 0.955 1.00 0.00 H new ATOM 0 HA ALA A 83 -0.130 -10.436 -1.526 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -0.490 -8.179 -2.405 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -1.922 -8.765 -1.525 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -0.831 -7.584 -0.763 1.00 0.00 H new ATOM 1171 N LEU A 84 1.712 -8.387 0.272 1.00 0.00 N ATOM 1172 CA LEU A 84 3.079 -7.957 0.513 1.00 0.00 C ATOM 1173 C LEU A 84 3.957 -9.184 0.771 1.00 0.00 C ATOM 1174 O LEU A 84 5.181 -9.105 0.681 1.00 0.00 O ATOM 1175 CB LEU A 84 3.124 -6.921 1.638 1.00 0.00 C ATOM 1176 CG LEU A 84 2.888 -5.468 1.221 1.00 0.00 C ATOM 1177 CD1 LEU A 84 3.688 -5.122 -0.036 1.00 0.00 C ATOM 1178 CD2 LEU A 84 1.395 -5.183 1.047 1.00 0.00 C ATOM 0 H LEU A 84 1.021 -7.988 0.907 1.00 0.00 H new ATOM 0 HA LEU A 84 3.482 -7.456 -0.367 1.00 0.00 H new ATOM 0 HB2 LEU A 84 2.376 -7.190 2.383 1.00 0.00 H new ATOM 0 HB3 LEU A 84 4.097 -6.985 2.125 1.00 0.00 H new ATOM 0 HG LEU A 84 3.248 -4.820 2.020 1.00 0.00 H new ATOM 0 HD11 LEU A 84 3.502 -4.084 -0.311 1.00 0.00 H new ATOM 0 HD12 LEU A 84 4.751 -5.261 0.160 1.00 0.00 H new ATOM 0 HD13 LEU A 84 3.381 -5.774 -0.854 1.00 0.00 H new ATOM 0 HD21 LEU A 84 1.255 -4.143 0.751 1.00 0.00 H new ATOM 0 HD22 LEU A 84 0.987 -5.838 0.277 1.00 0.00 H new ATOM 0 HD23 LEU A 84 0.878 -5.364 1.989 1.00 0.00 H new ATOM 1190 N LYS A 85 3.297 -10.288 1.087 1.00 0.00 N ATOM 1191 CA LYS A 85 4.002 -11.529 1.359 1.00 0.00 C ATOM 1192 C LYS A 85 4.339 -12.219 0.035 1.00 0.00 C ATOM 1193 O LYS A 85 5.459 -12.691 -0.155 1.00 0.00 O ATOM 1194 CB LYS A 85 3.195 -12.404 2.320 1.00 0.00 C ATOM 1195 CG LYS A 85 3.641 -12.184 3.767 1.00 0.00 C ATOM 1196 CD LYS A 85 2.491 -11.645 4.620 1.00 0.00 C ATOM 1197 CE LYS A 85 3.003 -11.113 5.960 1.00 0.00 C ATOM 1198 NZ LYS A 85 2.262 -11.732 7.081 1.00 0.00 N ATOM 0 H LYS A 85 2.282 -10.349 1.161 1.00 0.00 H new ATOM 0 HA LYS A 85 4.947 -11.328 1.864 1.00 0.00 H new ATOM 0 HB2 LYS A 85 2.134 -12.174 2.224 1.00 0.00 H new ATOM 0 HB3 LYS A 85 3.319 -13.454 2.053 1.00 0.00 H new ATOM 0 HG2 LYS A 85 4.001 -13.123 4.187 1.00 0.00 H new ATOM 0 HG3 LYS A 85 4.476 -11.484 3.791 1.00 0.00 H new ATOM 0 HD2 LYS A 85 1.977 -10.849 4.082 1.00 0.00 H new ATOM 0 HD3 LYS A 85 1.761 -12.436 4.794 1.00 0.00 H new ATOM 0 HE2 LYS A 85 4.068 -11.325 6.059 1.00 0.00 H new ATOM 0 HE3 LYS A 85 2.889 -10.030 5.995 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 2.622 -11.360 7.983 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 1.250 -11.509 6.994 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 2.392 -12.764 7.056 1.00 0.00 H new ATOM 1212 N ARG A 86 3.350 -12.256 -0.845 1.00 0.00 N ATOM 1213 CA ARG A 86 3.528 -12.881 -2.145 1.00 0.00 C ATOM 1214 C ARG A 86 4.145 -11.887 -3.131 1.00 0.00 C ATOM 1215 O ARG A 86 4.499 -12.256 -4.250 1.00 0.00 O ATOM 1216 CB ARG A 86 2.194 -13.381 -2.703 1.00 0.00 C ATOM 1217 CG ARG A 86 1.401 -12.236 -3.336 1.00 0.00 C ATOM 1218 CD ARG A 86 -0.104 -12.453 -3.167 1.00 0.00 C ATOM 1219 NE ARG A 86 -0.639 -13.209 -4.322 1.00 0.00 N ATOM 1220 CZ ARG A 86 -0.720 -14.545 -4.372 1.00 0.00 C ATOM 1221 NH1 ARG A 86 -0.301 -15.282 -3.334 1.00 0.00 N ATOM 1222 NH2 ARG A 86 -1.219 -15.146 -5.461 1.00 0.00 N ATOM 0 H ARG A 86 2.422 -11.863 -0.684 1.00 0.00 H new ATOM 0 HA ARG A 86 4.196 -13.732 -2.015 1.00 0.00 H new ATOM 0 HB2 ARG A 86 2.375 -14.157 -3.446 1.00 0.00 H new ATOM 0 HB3 ARG A 86 1.609 -13.835 -1.904 1.00 0.00 H new ATOM 0 HG2 ARG A 86 1.690 -11.291 -2.876 1.00 0.00 H new ATOM 0 HG3 ARG A 86 1.645 -12.162 -4.396 1.00 0.00 H new ATOM 0 HD2 ARG A 86 -0.300 -12.997 -2.243 1.00 0.00 H new ATOM 0 HD3 ARG A 86 -0.611 -11.492 -3.084 1.00 0.00 H new ATOM 0 HE ARG A 86 -0.966 -12.679 -5.130 1.00 0.00 H new ATOM 0 HH11 ARG A 86 0.080 -14.826 -2.505 1.00 0.00 H new ATOM 0 HH12 ARG A 86 -0.363 -16.299 -3.373 1.00 0.00 H new ATOM 0 HH21 ARG A 86 -1.537 -14.586 -6.252 1.00 0.00 H new ATOM 0 HH22 ARG A 86 -1.281 -16.163 -5.499 1.00 0.00 H new ATOM 1236 N ALA A 87 4.255 -10.646 -2.681 1.00 0.00 N ATOM 1237 CA ALA A 87 4.823 -9.596 -3.509 1.00 0.00 C ATOM 1238 C ALA A 87 6.311 -9.875 -3.729 1.00 0.00 C ATOM 1239 O ALA A 87 7.107 -9.788 -2.794 1.00 0.00 O ATOM 1240 CB ALA A 87 4.575 -8.237 -2.853 1.00 0.00 C ATOM 0 H ALA A 87 3.960 -10.344 -1.753 1.00 0.00 H new ATOM 0 HA ALA A 87 4.343 -9.577 -4.487 1.00 0.00 H new ATOM 0 HB1 ALA A 87 5.001 -7.450 -3.475 1.00 0.00 H new ATOM 0 HB2 ALA A 87 3.502 -8.075 -2.747 1.00 0.00 H new ATOM 0 HB3 ALA A 87 5.044 -8.217 -1.869 1.00 0.00 H new ATOM 1246 N GLY A 88 6.643 -10.204 -4.968 1.00 0.00 N ATOM 1247 CA GLY A 88 8.022 -10.496 -5.322 1.00 0.00 C ATOM 1248 C GLY A 88 8.862 -9.217 -5.355 1.00 0.00 C ATOM 1249 O GLY A 88 8.469 -8.197 -4.790 1.00 0.00 O ATOM 0 H GLY A 88 5.981 -10.275 -5.740 1.00 0.00 H new ATOM 0 HA2 GLY A 88 8.446 -11.195 -4.601 1.00 0.00 H new ATOM 0 HA3 GLY A 88 8.056 -10.983 -6.297 1.00 0.00 H new ATOM 1253 N GLN A 89 10.003 -9.314 -6.022 1.00 0.00 N ATOM 1254 CA GLN A 89 10.901 -8.178 -6.135 1.00 0.00 C ATOM 1255 C GLN A 89 10.165 -6.976 -6.730 1.00 0.00 C ATOM 1256 O GLN A 89 10.192 -5.884 -6.164 1.00 0.00 O ATOM 1257 CB GLN A 89 12.133 -8.534 -6.970 1.00 0.00 C ATOM 1258 CG GLN A 89 13.145 -9.329 -6.143 1.00 0.00 C ATOM 1259 CD GLN A 89 14.356 -9.726 -6.991 1.00 0.00 C ATOM 1260 OE1 GLN A 89 14.356 -9.620 -8.206 1.00 0.00 O ATOM 1261 NE2 GLN A 89 15.383 -10.187 -6.284 1.00 0.00 N ATOM 0 H GLN A 89 10.326 -10.161 -6.489 1.00 0.00 H new ATOM 0 HA GLN A 89 11.244 -7.911 -5.136 1.00 0.00 H new ATOM 0 HB2 GLN A 89 11.831 -9.117 -7.840 1.00 0.00 H new ATOM 0 HB3 GLN A 89 12.599 -7.622 -7.344 1.00 0.00 H new ATOM 0 HG2 GLN A 89 13.473 -8.733 -5.292 1.00 0.00 H new ATOM 0 HG3 GLN A 89 12.669 -10.223 -5.741 1.00 0.00 H new ATOM 0 HE21 GLN A 89 15.316 -10.249 -5.268 1.00 0.00 H new ATOM 0 HE22 GLN A 89 16.238 -10.478 -6.757 1.00 0.00 H new ATOM 1270 N SER A 90 9.524 -7.217 -7.864 1.00 0.00 N ATOM 1271 CA SER A 90 8.781 -6.168 -8.542 1.00 0.00 C ATOM 1272 C SER A 90 7.308 -6.221 -8.133 1.00 0.00 C ATOM 1273 O SER A 90 6.538 -7.013 -8.674 1.00 0.00 O ATOM 1274 CB SER A 90 8.915 -6.292 -10.061 1.00 0.00 C ATOM 1275 OG SER A 90 9.588 -7.489 -10.442 1.00 0.00 O ATOM 0 H SER A 90 9.504 -8.124 -8.331 1.00 0.00 H new ATOM 0 HA SER A 90 9.199 -5.206 -8.245 1.00 0.00 H new ATOM 0 HB2 SER A 90 7.924 -6.273 -10.515 1.00 0.00 H new ATOM 0 HB3 SER A 90 9.460 -5.431 -10.448 1.00 0.00 H new ATOM 0 HG SER A 90 9.652 -7.532 -11.419 1.00 0.00 H new ATOM 1281 N VAL A 91 6.961 -5.369 -7.180 1.00 0.00 N ATOM 1282 CA VAL A 91 5.593 -5.309 -6.691 1.00 0.00 C ATOM 1283 C VAL A 91 4.913 -4.055 -7.245 1.00 0.00 C ATOM 1284 O VAL A 91 5.493 -2.970 -7.225 1.00 0.00 O ATOM 1285 CB VAL A 91 5.581 -5.371 -5.163 1.00 0.00 C ATOM 1286 CG1 VAL A 91 4.212 -5.817 -4.643 1.00 0.00 C ATOM 1287 CG2 VAL A 91 6.690 -6.286 -4.642 1.00 0.00 C ATOM 0 H VAL A 91 7.603 -4.714 -6.733 1.00 0.00 H new ATOM 0 HA VAL A 91 5.023 -6.169 -7.042 1.00 0.00 H new ATOM 0 HB VAL A 91 5.772 -4.366 -4.786 1.00 0.00 H new ATOM 0 HG11 VAL A 91 4.231 -5.853 -3.554 1.00 0.00 H new ATOM 0 HG12 VAL A 91 3.450 -5.109 -4.970 1.00 0.00 H new ATOM 0 HG13 VAL A 91 3.979 -6.807 -5.035 1.00 0.00 H new ATOM 0 HG21 VAL A 91 6.659 -6.312 -3.553 1.00 0.00 H new ATOM 0 HG22 VAL A 91 6.545 -7.293 -5.033 1.00 0.00 H new ATOM 0 HG23 VAL A 91 7.658 -5.906 -4.968 1.00 0.00 H new ATOM 1297 N THR A 92 3.693 -4.246 -7.725 1.00 0.00 N ATOM 1298 CA THR A 92 2.928 -3.144 -8.283 1.00 0.00 C ATOM 1299 C THR A 92 1.886 -2.654 -7.275 1.00 0.00 C ATOM 1300 O THR A 92 0.840 -3.279 -7.105 1.00 0.00 O ATOM 1301 CB THR A 92 2.320 -3.612 -9.606 1.00 0.00 C ATOM 1302 OG1 THR A 92 3.425 -4.156 -10.323 1.00 0.00 O ATOM 1303 CG2 THR A 92 1.848 -2.447 -10.478 1.00 0.00 C ATOM 0 H THR A 92 3.215 -5.147 -7.739 1.00 0.00 H new ATOM 0 HA THR A 92 3.566 -2.284 -8.488 1.00 0.00 H new ATOM 0 HB THR A 92 1.481 -4.278 -9.404 1.00 0.00 H new ATOM 0 HG1 THR A 92 3.120 -4.485 -11.194 1.00 0.00 H new ATOM 0 HG21 THR A 92 1.425 -2.834 -11.405 1.00 0.00 H new ATOM 0 HG22 THR A 92 1.089 -1.876 -9.943 1.00 0.00 H new ATOM 0 HG23 THR A 92 2.694 -1.799 -10.708 1.00 0.00 H new ATOM 1311 N ILE A 93 2.208 -1.541 -6.633 1.00 0.00 N ATOM 1312 CA ILE A 93 1.313 -0.960 -5.646 1.00 0.00 C ATOM 1313 C ILE A 93 0.453 0.114 -6.315 1.00 0.00 C ATOM 1314 O ILE A 93 0.973 1.114 -6.808 1.00 0.00 O ATOM 1315 CB ILE A 93 2.104 -0.452 -4.439 1.00 0.00 C ATOM 1316 CG1 ILE A 93 2.733 -1.613 -3.667 1.00 0.00 C ATOM 1317 CG2 ILE A 93 1.229 0.426 -3.541 1.00 0.00 C ATOM 1318 CD1 ILE A 93 4.180 -1.844 -4.108 1.00 0.00 C ATOM 0 H ILE A 93 3.076 -1.026 -6.777 1.00 0.00 H new ATOM 0 HA ILE A 93 0.632 -1.717 -5.256 1.00 0.00 H new ATOM 0 HB ILE A 93 2.920 0.172 -4.803 1.00 0.00 H new ATOM 0 HG12 ILE A 93 2.704 -1.402 -2.598 1.00 0.00 H new ATOM 0 HG13 ILE A 93 2.150 -2.520 -3.829 1.00 0.00 H new ATOM 0 HG21 ILE A 93 1.815 0.774 -2.690 1.00 0.00 H new ATOM 0 HG22 ILE A 93 0.870 1.284 -4.110 1.00 0.00 H new ATOM 0 HG23 ILE A 93 0.378 -0.154 -3.183 1.00 0.00 H new ATOM 0 HD11 ILE A 93 4.604 -2.675 -3.544 1.00 0.00 H new ATOM 0 HD12 ILE A 93 4.203 -2.079 -5.172 1.00 0.00 H new ATOM 0 HD13 ILE A 93 4.765 -0.943 -3.922 1.00 0.00 H new ATOM 1330 N VAL A 94 -0.850 -0.129 -6.309 1.00 0.00 N ATOM 1331 CA VAL A 94 -1.787 0.805 -6.909 1.00 0.00 C ATOM 1332 C VAL A 94 -2.620 1.464 -5.807 1.00 0.00 C ATOM 1333 O VAL A 94 -3.554 0.858 -5.284 1.00 0.00 O ATOM 1334 CB VAL A 94 -2.642 0.089 -7.957 1.00 0.00 C ATOM 1335 CG1 VAL A 94 -3.585 1.069 -8.658 1.00 0.00 C ATOM 1336 CG2 VAL A 94 -1.764 -0.647 -8.970 1.00 0.00 C ATOM 0 H VAL A 94 -1.278 -0.959 -5.898 1.00 0.00 H new ATOM 0 HA VAL A 94 -1.253 1.598 -7.432 1.00 0.00 H new ATOM 0 HB VAL A 94 -3.253 -0.652 -7.442 1.00 0.00 H new ATOM 0 HG11 VAL A 94 -4.181 0.534 -9.398 1.00 0.00 H new ATOM 0 HG12 VAL A 94 -4.246 1.528 -7.922 1.00 0.00 H new ATOM 0 HG13 VAL A 94 -3.001 1.844 -9.154 1.00 0.00 H new ATOM 0 HG21 VAL A 94 -2.396 -1.147 -9.704 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -1.116 0.068 -9.477 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -1.153 -1.387 -8.452 1.00 0.00 H new ATOM 1346 N ALA A 95 -2.251 2.696 -5.487 1.00 0.00 N ATOM 1347 CA ALA A 95 -2.952 3.443 -4.457 1.00 0.00 C ATOM 1348 C ALA A 95 -3.313 4.829 -4.994 1.00 0.00 C ATOM 1349 O ALA A 95 -2.678 5.322 -5.925 1.00 0.00 O ATOM 1350 CB ALA A 95 -2.085 3.513 -3.198 1.00 0.00 C ATOM 0 H ALA A 95 -1.476 3.195 -5.923 1.00 0.00 H new ATOM 0 HA ALA A 95 -3.882 2.943 -4.186 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -2.611 4.073 -2.425 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -1.882 2.504 -2.840 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -1.144 4.012 -3.431 1.00 0.00 H new ATOM 1356 N GLN A 96 -4.331 5.418 -4.385 1.00 0.00 N ATOM 1357 CA GLN A 96 -4.785 6.737 -4.791 1.00 0.00 C ATOM 1358 C GLN A 96 -4.333 7.789 -3.775 1.00 0.00 C ATOM 1359 O GLN A 96 -4.851 7.843 -2.661 1.00 0.00 O ATOM 1360 CB GLN A 96 -6.304 6.764 -4.970 1.00 0.00 C ATOM 1361 CG GLN A 96 -6.773 5.605 -5.851 1.00 0.00 C ATOM 1362 CD GLN A 96 -7.748 6.093 -6.925 1.00 0.00 C ATOM 1363 OE1 GLN A 96 -7.738 7.242 -7.333 1.00 0.00 O ATOM 1364 NE2 GLN A 96 -8.588 5.157 -7.358 1.00 0.00 N ATOM 0 H GLN A 96 -4.855 5.006 -3.613 1.00 0.00 H new ATOM 0 HA GLN A 96 -4.335 6.974 -5.755 1.00 0.00 H new ATOM 0 HB2 GLN A 96 -6.790 6.705 -3.996 1.00 0.00 H new ATOM 0 HB3 GLN A 96 -6.604 7.711 -5.419 1.00 0.00 H new ATOM 0 HG2 GLN A 96 -5.913 5.131 -6.324 1.00 0.00 H new ATOM 0 HG3 GLN A 96 -7.255 4.847 -5.234 1.00 0.00 H new ATOM 0 HE21 GLN A 96 -8.542 4.213 -6.973 1.00 0.00 H new ATOM 0 HE22 GLN A 96 -9.278 5.383 -8.075 1.00 0.00 H new ATOM 1373 N TYR A 97 -3.373 8.599 -4.197 1.00 0.00 N ATOM 1374 CA TYR A 97 -2.847 9.647 -3.339 1.00 0.00 C ATOM 1375 C TYR A 97 -3.975 10.517 -2.781 1.00 0.00 C ATOM 1376 O TYR A 97 -4.366 11.505 -3.401 1.00 0.00 O ATOM 1377 CB TYR A 97 -1.946 10.507 -4.227 1.00 0.00 C ATOM 1378 CG TYR A 97 -0.854 11.259 -3.463 1.00 0.00 C ATOM 1379 CD1 TYR A 97 -1.059 11.625 -2.148 1.00 0.00 C ATOM 1380 CD2 TYR A 97 0.336 11.571 -4.089 1.00 0.00 C ATOM 1381 CE1 TYR A 97 -0.031 12.333 -1.429 1.00 0.00 C ATOM 1382 CE2 TYR A 97 1.363 12.278 -3.370 1.00 0.00 C ATOM 1383 CZ TYR A 97 1.129 12.624 -2.076 1.00 0.00 C ATOM 1384 OH TYR A 97 2.100 13.293 -1.397 1.00 0.00 O ATOM 0 H TYR A 97 -2.946 8.551 -5.122 1.00 0.00 H new ATOM 0 HA TYR A 97 -2.311 9.217 -2.493 1.00 0.00 H new ATOM 0 HB2 TYR A 97 -1.477 9.870 -4.977 1.00 0.00 H new ATOM 0 HB3 TYR A 97 -2.563 11.229 -4.763 1.00 0.00 H new ATOM 0 HD1 TYR A 97 -1.990 11.381 -1.658 1.00 0.00 H new ATOM 0 HD2 TYR A 97 0.496 11.285 -5.118 1.00 0.00 H new ATOM 0 HE1 TYR A 97 -0.178 12.626 -0.400 1.00 0.00 H new ATOM 0 HE2 TYR A 97 2.299 12.528 -3.848 1.00 0.00 H new ATOM 0 HH TYR A 97 2.873 13.432 -1.983 1.00 0.00 H new ATOM 1394 N ARG A 98 -4.465 10.120 -1.616 1.00 0.00 N ATOM 1395 CA ARG A 98 -5.540 10.851 -0.968 1.00 0.00 C ATOM 1396 C ARG A 98 -5.202 11.098 0.504 1.00 0.00 C ATOM 1397 O ARG A 98 -5.539 10.289 1.366 1.00 0.00 O ATOM 1398 CB ARG A 98 -6.861 10.085 -1.059 1.00 0.00 C ATOM 1399 CG ARG A 98 -7.489 10.236 -2.446 1.00 0.00 C ATOM 1400 CD ARG A 98 -8.349 11.499 -2.523 1.00 0.00 C ATOM 1401 NE ARG A 98 -9.548 11.245 -3.353 1.00 0.00 N ATOM 1402 CZ ARG A 98 -10.375 12.204 -3.792 1.00 0.00 C ATOM 1403 NH1 ARG A 98 -10.138 13.486 -3.482 1.00 0.00 N ATOM 1404 NH2 ARG A 98 -11.439 11.881 -4.540 1.00 0.00 N ATOM 0 H ARG A 98 -4.137 9.301 -1.104 1.00 0.00 H new ATOM 0 HA ARG A 98 -5.650 11.805 -1.484 1.00 0.00 H new ATOM 0 HB2 ARG A 98 -6.689 9.030 -0.847 1.00 0.00 H new ATOM 0 HB3 ARG A 98 -7.552 10.454 -0.301 1.00 0.00 H new ATOM 0 HG2 ARG A 98 -6.705 10.279 -3.202 1.00 0.00 H new ATOM 0 HG3 ARG A 98 -8.100 9.361 -2.670 1.00 0.00 H new ATOM 0 HD2 ARG A 98 -8.649 11.807 -1.521 1.00 0.00 H new ATOM 0 HD3 ARG A 98 -7.769 12.318 -2.948 1.00 0.00 H new ATOM 0 HE ARG A 98 -9.758 10.280 -3.607 1.00 0.00 H new ATOM 0 HH11 ARG A 98 -9.328 13.732 -2.912 1.00 0.00 H new ATOM 0 HH12 ARG A 98 -10.767 14.216 -3.816 1.00 0.00 H new ATOM 0 HH21 ARG A 98 -11.620 10.905 -4.775 1.00 0.00 H new ATOM 0 HH22 ARG A 98 -12.068 12.611 -4.874 1.00 0.00 H new ATOM 1418 N PRO A 99 -4.523 12.250 0.752 1.00 0.00 N ATOM 1419 CA PRO A 99 -4.135 12.614 2.104 1.00 0.00 C ATOM 1420 C PRO A 99 -5.341 13.112 2.904 1.00 0.00 C ATOM 1421 O PRO A 99 -5.298 13.159 4.133 1.00 0.00 O ATOM 1422 CB PRO A 99 -3.058 13.672 1.933 1.00 0.00 C ATOM 1423 CG PRO A 99 -3.209 14.196 0.514 1.00 0.00 C ATOM 1424 CD PRO A 99 -4.107 13.233 -0.245 1.00 0.00 C ATOM 0 HA PRO A 99 -3.755 11.767 2.675 1.00 0.00 H new ATOM 0 HB2 PRO A 99 -3.180 14.474 2.661 1.00 0.00 H new ATOM 0 HB3 PRO A 99 -2.066 13.248 2.089 1.00 0.00 H new ATOM 0 HG2 PRO A 99 -3.641 15.197 0.520 1.00 0.00 H new ATOM 0 HG3 PRO A 99 -2.236 14.273 0.030 1.00 0.00 H new ATOM 0 HD2 PRO A 99 -4.966 13.748 -0.676 1.00 0.00 H new ATOM 0 HD3 PRO A 99 -3.573 12.760 -1.069 1.00 0.00 H new ATOM 1432 N GLU A 100 -6.387 13.471 2.176 1.00 0.00 N ATOM 1433 CA GLU A 100 -7.602 13.964 2.802 1.00 0.00 C ATOM 1434 C GLU A 100 -8.286 12.843 3.588 1.00 0.00 C ATOM 1435 O GLU A 100 -8.842 13.081 4.659 1.00 0.00 O ATOM 1436 CB GLU A 100 -8.551 14.563 1.763 1.00 0.00 C ATOM 1437 CG GLU A 100 -7.903 15.751 1.049 1.00 0.00 C ATOM 1438 CD GLU A 100 -8.912 16.883 0.842 1.00 0.00 C ATOM 1439 OE1 GLU A 100 -9.668 17.152 1.801 1.00 0.00 O ATOM 1440 OE2 GLU A 100 -8.905 17.453 -0.270 1.00 0.00 O ATOM 0 H GLU A 100 -6.419 13.430 1.157 1.00 0.00 H new ATOM 0 HA GLU A 100 -7.332 14.758 3.498 1.00 0.00 H new ATOM 0 HB2 GLU A 100 -8.825 13.801 1.033 1.00 0.00 H new ATOM 0 HB3 GLU A 100 -9.472 14.885 2.249 1.00 0.00 H new ATOM 0 HG2 GLU A 100 -7.058 16.115 1.634 1.00 0.00 H new ATOM 0 HG3 GLU A 100 -7.509 15.430 0.085 1.00 0.00 H new ATOM 1447 N GLU A 101 -8.222 11.645 3.025 1.00 0.00 N ATOM 1448 CA GLU A 101 -8.829 10.487 3.659 1.00 0.00 C ATOM 1449 C GLU A 101 -7.987 10.035 4.855 1.00 0.00 C ATOM 1450 O GLU A 101 -8.464 10.035 5.989 1.00 0.00 O ATOM 1451 CB GLU A 101 -9.013 9.346 2.656 1.00 0.00 C ATOM 1452 CG GLU A 101 -10.106 9.681 1.640 1.00 0.00 C ATOM 1453 CD GLU A 101 -11.286 8.716 1.766 1.00 0.00 C ATOM 1454 OE1 GLU A 101 -11.018 7.522 2.022 1.00 0.00 O ATOM 1455 OE2 GLU A 101 -12.430 9.193 1.603 1.00 0.00 O ATOM 0 H GLU A 101 -7.759 11.451 2.137 1.00 0.00 H new ATOM 0 HA GLU A 101 -9.817 10.771 4.021 1.00 0.00 H new ATOM 0 HB2 GLU A 101 -8.073 9.159 2.136 1.00 0.00 H new ATOM 0 HB3 GLU A 101 -9.272 8.429 3.186 1.00 0.00 H new ATOM 0 HG2 GLU A 101 -10.450 10.704 1.794 1.00 0.00 H new ATOM 0 HG3 GLU A 101 -9.697 9.631 0.631 1.00 0.00 H new ATOM 1462 N TYR A 102 -6.751 9.661 4.560 1.00 0.00 N ATOM 1463 CA TYR A 102 -5.839 9.208 5.597 1.00 0.00 C ATOM 1464 C TYR A 102 -5.996 10.044 6.868 1.00 0.00 C ATOM 1465 O TYR A 102 -5.736 9.561 7.969 1.00 0.00 O ATOM 1466 CB TYR A 102 -4.430 9.412 5.037 1.00 0.00 C ATOM 1467 CG TYR A 102 -3.316 8.907 5.957 1.00 0.00 C ATOM 1468 CD1 TYR A 102 -3.224 7.563 6.256 1.00 0.00 C ATOM 1469 CD2 TYR A 102 -2.403 9.796 6.487 1.00 0.00 C ATOM 1470 CE1 TYR A 102 -2.176 7.089 7.122 1.00 0.00 C ATOM 1471 CE2 TYR A 102 -1.355 9.322 7.353 1.00 0.00 C ATOM 1472 CZ TYR A 102 -1.293 7.991 7.627 1.00 0.00 C ATOM 1473 OH TYR A 102 -0.303 7.543 8.445 1.00 0.00 O ATOM 0 H TYR A 102 -6.359 9.662 3.618 1.00 0.00 H new ATOM 0 HA TYR A 102 -6.039 8.169 5.857 1.00 0.00 H new ATOM 0 HB2 TYR A 102 -4.354 8.901 4.077 1.00 0.00 H new ATOM 0 HB3 TYR A 102 -4.276 10.474 4.846 1.00 0.00 H new ATOM 0 HD1 TYR A 102 -3.938 6.867 5.841 1.00 0.00 H new ATOM 0 HD2 TYR A 102 -2.475 10.848 6.252 1.00 0.00 H new ATOM 0 HE1 TYR A 102 -2.093 6.040 7.365 1.00 0.00 H new ATOM 0 HE2 TYR A 102 -0.635 10.007 7.775 1.00 0.00 H new ATOM 0 HH TYR A 102 -0.280 8.087 9.260 1.00 0.00 H new ATOM 1483 N SER A 103 -6.419 11.284 6.674 1.00 0.00 N ATOM 1484 CA SER A 103 -6.614 12.192 7.792 1.00 0.00 C ATOM 1485 C SER A 103 -7.196 11.434 8.987 1.00 0.00 C ATOM 1486 O SER A 103 -6.755 11.621 10.120 1.00 0.00 O ATOM 1487 CB SER A 103 -7.529 13.355 7.404 1.00 0.00 C ATOM 1488 OG SER A 103 -7.840 14.185 8.520 1.00 0.00 O ATOM 0 H SER A 103 -6.632 11.682 5.759 1.00 0.00 H new ATOM 0 HA SER A 103 -5.644 12.605 8.070 1.00 0.00 H new ATOM 0 HB2 SER A 103 -7.047 13.953 6.631 1.00 0.00 H new ATOM 0 HB3 SER A 103 -8.451 12.963 6.975 1.00 0.00 H new ATOM 0 HG SER A 103 -8.425 14.916 8.231 1.00 0.00 H new ATOM 1494 N ARG A 104 -8.178 10.595 8.693 1.00 0.00 N ATOM 1495 CA ARG A 104 -8.825 9.808 9.729 1.00 0.00 C ATOM 1496 C ARG A 104 -7.779 9.077 10.572 1.00 0.00 C ATOM 1497 O ARG A 104 -7.768 9.198 11.796 1.00 0.00 O ATOM 1498 CB ARG A 104 -9.788 8.784 9.122 1.00 0.00 C ATOM 1499 CG ARG A 104 -10.785 9.461 8.180 1.00 0.00 C ATOM 1500 CD ARG A 104 -10.945 8.662 6.885 1.00 0.00 C ATOM 1501 NE ARG A 104 -11.858 9.371 5.962 1.00 0.00 N ATOM 1502 CZ ARG A 104 -13.193 9.251 5.984 1.00 0.00 C ATOM 1503 NH1 ARG A 104 -13.778 8.447 6.883 1.00 0.00 N ATOM 1504 NH2 ARG A 104 -13.942 9.933 5.108 1.00 0.00 N ATOM 0 H ARG A 104 -8.541 10.443 7.752 1.00 0.00 H new ATOM 0 HA ARG A 104 -9.391 10.493 10.361 1.00 0.00 H new ATOM 0 HB2 ARG A 104 -9.224 8.027 8.577 1.00 0.00 H new ATOM 0 HB3 ARG A 104 -10.326 8.269 9.918 1.00 0.00 H new ATOM 0 HG2 ARG A 104 -11.752 9.556 8.675 1.00 0.00 H new ATOM 0 HG3 ARG A 104 -10.445 10.470 7.949 1.00 0.00 H new ATOM 0 HD2 ARG A 104 -9.973 8.522 6.412 1.00 0.00 H new ATOM 0 HD3 ARG A 104 -11.337 7.670 7.107 1.00 0.00 H new ATOM 0 HE ARG A 104 -11.446 9.991 5.265 1.00 0.00 H new ATOM 0 HH11 ARG A 104 -13.207 7.927 7.550 1.00 0.00 H new ATOM 0 HH12 ARG A 104 -14.794 8.355 6.900 1.00 0.00 H new ATOM 0 HH21 ARG A 104 -13.497 10.544 4.423 1.00 0.00 H new ATOM 0 HH22 ARG A 104 -14.958 9.841 5.125 1.00 0.00 H new ATOM 1518 N PHE A 105 -6.924 8.334 9.883 1.00 0.00 N ATOM 1519 CA PHE A 105 -5.876 7.583 10.553 1.00 0.00 C ATOM 1520 C PHE A 105 -4.868 8.523 11.217 1.00 0.00 C ATOM 1521 O PHE A 105 -4.349 8.224 12.291 1.00 0.00 O ATOM 1522 CB PHE A 105 -5.159 6.761 9.481 1.00 0.00 C ATOM 1523 CG PHE A 105 -6.056 5.741 8.776 1.00 0.00 C ATOM 1524 CD1 PHE A 105 -6.726 4.808 9.503 1.00 0.00 C ATOM 1525 CD2 PHE A 105 -6.183 5.769 7.422 1.00 0.00 C ATOM 1526 CE1 PHE A 105 -7.559 3.861 8.848 1.00 0.00 C ATOM 1527 CE2 PHE A 105 -7.016 4.823 6.767 1.00 0.00 C ATOM 1528 CZ PHE A 105 -7.686 3.889 7.494 1.00 0.00 C ATOM 0 H PHE A 105 -6.936 8.236 8.868 1.00 0.00 H new ATOM 0 HA PHE A 105 -6.309 6.951 11.328 1.00 0.00 H new ATOM 0 HB2 PHE A 105 -4.742 7.439 8.736 1.00 0.00 H new ATOM 0 HB3 PHE A 105 -4.321 6.237 9.940 1.00 0.00 H new ATOM 0 HD1 PHE A 105 -6.625 4.786 10.578 1.00 0.00 H new ATOM 0 HD2 PHE A 105 -5.650 6.510 6.845 1.00 0.00 H new ATOM 0 HE1 PHE A 105 -8.091 3.119 9.425 1.00 0.00 H new ATOM 0 HE2 PHE A 105 -7.117 4.845 5.692 1.00 0.00 H new ATOM 0 HZ PHE A 105 -8.319 3.169 6.996 1.00 0.00 H new ATOM 1538 N GLU A 106 -4.620 9.641 10.550 1.00 0.00 N ATOM 1539 CA GLU A 106 -3.683 10.626 11.062 1.00 0.00 C ATOM 1540 C GLU A 106 -4.056 11.020 12.493 1.00 0.00 C ATOM 1541 O GLU A 106 -3.232 10.927 13.401 1.00 0.00 O ATOM 1542 CB GLU A 106 -3.628 11.855 10.152 1.00 0.00 C ATOM 1543 CG GLU A 106 -2.352 11.853 9.307 1.00 0.00 C ATOM 1544 CD GLU A 106 -1.167 12.404 10.102 1.00 0.00 C ATOM 1545 OE1 GLU A 106 -1.172 13.628 10.355 1.00 0.00 O ATOM 1546 OE2 GLU A 106 -0.282 11.588 10.439 1.00 0.00 O ATOM 0 H GLU A 106 -5.052 9.886 9.659 1.00 0.00 H new ATOM 0 HA GLU A 106 -2.689 10.180 11.076 1.00 0.00 H new ATOM 0 HB2 GLU A 106 -4.501 11.868 9.499 1.00 0.00 H new ATOM 0 HB3 GLU A 106 -3.667 12.762 10.756 1.00 0.00 H new ATOM 0 HG2 GLU A 106 -2.132 10.838 8.976 1.00 0.00 H new ATOM 0 HG3 GLU A 106 -2.504 12.454 8.411 1.00 0.00 H new ATOM 1553 N SER A 107 -5.299 11.453 12.649 1.00 0.00 N ATOM 1554 CA SER A 107 -5.791 11.861 13.953 1.00 0.00 C ATOM 1555 C SER A 107 -5.663 10.705 14.947 1.00 0.00 C ATOM 1556 O SER A 107 -4.940 10.809 15.936 1.00 0.00 O ATOM 1557 CB SER A 107 -7.245 12.331 13.871 1.00 0.00 C ATOM 1558 OG SER A 107 -7.547 13.307 14.865 1.00 0.00 O ATOM 0 H SER A 107 -5.980 11.530 11.893 1.00 0.00 H new ATOM 0 HA SER A 107 -5.185 12.698 14.299 1.00 0.00 H new ATOM 0 HB2 SER A 107 -7.436 12.749 12.883 1.00 0.00 H new ATOM 0 HB3 SER A 107 -7.910 11.475 13.989 1.00 0.00 H new ATOM 0 HG SER A 107 -8.483 13.583 14.779 1.00 0.00 H new ATOM 1564 N SER A 108 -6.375 9.628 14.648 1.00 0.00 N ATOM 1565 CA SER A 108 -6.350 8.453 15.503 1.00 0.00 C ATOM 1566 C SER A 108 -6.283 7.186 14.648 1.00 0.00 C ATOM 1567 O SER A 108 -7.204 6.897 13.886 1.00 0.00 O ATOM 1568 CB SER A 108 -7.575 8.412 16.418 1.00 0.00 C ATOM 1569 OG SER A 108 -7.251 8.762 17.761 1.00 0.00 O ATOM 0 H SER A 108 -6.973 9.544 13.826 1.00 0.00 H new ATOM 0 HA SER A 108 -5.462 8.506 16.133 1.00 0.00 H new ATOM 0 HB2 SER A 108 -8.334 9.096 16.038 1.00 0.00 H new ATOM 0 HB3 SER A 108 -8.009 7.412 16.399 1.00 0.00 H new ATOM 0 HG SER A 108 -8.060 8.726 18.313 1.00 0.00 H new ATOM 1575 N GLY A 109 -5.184 6.463 14.804 1.00 0.00 N ATOM 1576 CA GLY A 109 -4.984 5.234 14.056 1.00 0.00 C ATOM 1577 C GLY A 109 -4.252 4.190 14.902 1.00 0.00 C ATOM 1578 O GLY A 109 -4.318 4.224 16.130 1.00 0.00 O ATOM 0 H GLY A 109 -4.422 6.705 15.438 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -5.948 4.838 13.737 1.00 0.00 H new ATOM 0 HA3 GLY A 109 -4.410 5.443 13.153 1.00 0.00 H new ATOM 1582 N PRO A 110 -3.553 3.263 14.194 1.00 0.00 N ATOM 1583 CA PRO A 110 -2.810 2.211 14.866 1.00 0.00 C ATOM 1584 C PRO A 110 -1.523 2.759 15.485 1.00 0.00 C ATOM 1585 O PRO A 110 -0.427 2.463 15.012 1.00 0.00 O ATOM 1586 CB PRO A 110 -2.555 1.163 13.795 1.00 0.00 C ATOM 1587 CG PRO A 110 -2.754 1.870 12.465 1.00 0.00 C ATOM 1588 CD PRO A 110 -3.453 3.192 12.739 1.00 0.00 C ATOM 0 HA PRO A 110 -3.357 1.779 15.704 1.00 0.00 H new ATOM 0 HB2 PRO A 110 -1.546 0.760 13.876 1.00 0.00 H new ATOM 0 HB3 PRO A 110 -3.243 0.324 13.898 1.00 0.00 H new ATOM 0 HG2 PRO A 110 -1.795 2.040 11.976 1.00 0.00 H new ATOM 0 HG3 PRO A 110 -3.351 1.255 11.791 1.00 0.00 H new ATOM 0 HD2 PRO A 110 -2.884 4.031 12.340 1.00 0.00 H new ATOM 0 HD3 PRO A 110 -4.437 3.224 12.272 1.00 0.00 H new ATOM 1596 N SER A 111 -1.698 3.549 16.534 1.00 0.00 N ATOM 1597 CA SER A 111 -0.564 4.142 17.223 1.00 0.00 C ATOM 1598 C SER A 111 -0.994 4.645 18.602 1.00 0.00 C ATOM 1599 O SER A 111 -0.409 4.265 19.616 1.00 0.00 O ATOM 1600 CB SER A 111 0.041 5.285 16.406 1.00 0.00 C ATOM 1601 OG SER A 111 1.177 4.863 15.656 1.00 0.00 O ATOM 0 H SER A 111 -2.609 3.792 16.924 1.00 0.00 H new ATOM 0 HA SER A 111 0.201 3.375 17.345 1.00 0.00 H new ATOM 0 HB2 SER A 111 -0.713 5.684 15.728 1.00 0.00 H new ATOM 0 HB3 SER A 111 0.329 6.096 17.075 1.00 0.00 H new ATOM 0 HG SER A 111 0.993 3.992 15.246 1.00 0.00 H new ATOM 1607 N SER A 112 -2.012 5.492 18.597 1.00 0.00 N ATOM 1608 CA SER A 112 -2.527 6.051 19.835 1.00 0.00 C ATOM 1609 C SER A 112 -1.455 6.911 20.507 1.00 0.00 C ATOM 1610 O SER A 112 -0.261 6.671 20.331 1.00 0.00 O ATOM 1611 CB SER A 112 -2.994 4.947 20.786 1.00 0.00 C ATOM 1612 OG SER A 112 -3.934 4.073 20.168 1.00 0.00 O ATOM 0 H SER A 112 -2.495 5.805 17.755 1.00 0.00 H new ATOM 0 HA SER A 112 -3.388 6.675 19.596 1.00 0.00 H new ATOM 0 HB2 SER A 112 -2.132 4.372 21.125 1.00 0.00 H new ATOM 0 HB3 SER A 112 -3.445 5.397 21.671 1.00 0.00 H new ATOM 0 HG SER A 112 -4.206 3.381 20.807 1.00 0.00 H new ATOM 1618 N GLY A 113 -1.919 7.896 21.262 1.00 0.00 N ATOM 1619 CA GLY A 113 -1.014 8.793 21.961 1.00 0.00 C ATOM 1620 C GLY A 113 -0.998 10.176 21.305 1.00 0.00 C ATOM 1621 O GLY A 113 -0.207 11.038 21.685 1.00 0.00 O ATOM 0 H GLY A 113 -2.910 8.093 21.405 1.00 0.00 H new ATOM 0 HA2 GLY A 113 -1.320 8.884 23.003 1.00 0.00 H new ATOM 0 HA3 GLY A 113 -0.008 8.374 21.960 1.00 0.00 H new TER 1625 GLY A 113