USER MOD reduce.3.24.130724 H: found=0, std=0, add=1129, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 1127 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 99 LYS NZ :NH3+ -105:sc= 0.554 (180deg=0) USER MOD Set 1.2: A 133 HIS : no HE2:sc= 0.501 K(o=1.1,f=-6.1!) USER MOD Set 2.1: A 66 GLN : amide:sc= 0.321 K(o=0.81,f=0.2) USER MOD Set 2.2: A 70 GLN : amide:sc= 0.491 K(o=0.81,f=0.2) USER MOD Set 3.1: A 22 SER OG : rot -167:sc= 0.524 USER MOD Set 3.2: A 62 HIS : no HD1:sc= 0.688 K(o=1.2,f=-3.3) USER MOD Single : A 1 SER N :NH3+ -106:sc= 0.0975 (180deg=0) USER MOD Single : A 1 SER OG : rot 180:sc= 0.243 USER MOD Single : A 3 GLN : amide:sc= 0 K(o=0,f=-0.99) USER MOD Single : A 5 THR OG1 : rot 67:sc= 1.22 USER MOD Single : A 6 THR OG1 : rot 75:sc= 0.323 USER MOD Single : A 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 ASN : amide:sc= -0.0351 K(o=-0.035,f=-1.7!) USER MOD Single : A 10 THR OG1 : rot -70:sc= 1.26 USER MOD Single : A 14 SER OG : rot -126:sc= 0.458 USER MOD Single : A 15 GLN : amide:sc= -0.178 X(o=-0.18,f=-0.29) USER MOD Single : A 17 SER OG : rot 130:sc= -0.227 USER MOD Single : A 19 SER OG : rot -89:sc= 1.2 USER MOD Single : A 20 SER OG : rot 83:sc= 1.3 USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 GLN : amide:sc= -0.0559 X(o=-0.056,f=-0.056) USER MOD Single : A 29 TYR OH : rot 180:sc= 0.135 USER MOD Single : A 34 LYS NZ :NH3+ 167:sc= 1.22 (180deg=1.14) USER MOD Single : A 38 MET CE :methyl 170:sc=-0.00113 (180deg=-0.152) USER MOD Single : A 40 LYS NZ :NH3+ -125:sc= 0.222 (180deg=0) USER MOD Single : A 42 TYR OH : rot -161:sc= 0.599 USER MOD Single : A 43 MET CE :methyl -177:sc= -1.28 (180deg=-1.3) USER MOD Single : A 47 SER OG : rot 180:sc= 0 USER MOD Single : A 49 ASN : amide:sc= 0.655 K(o=0.65,f=-7!) USER MOD Single : A 50 THR OG1 : rot 180:sc= 0 USER MOD Single : A 53 LYS NZ :NH3+ 171:sc= 1.15 (180deg=1.1) USER MOD Single : A 58 TYR OH : rot 180:sc= 0 USER MOD Single : A 60 MET CE :methyl 161:sc= -0.0792 (180deg=-0.692) USER MOD Single : A 61 ASN : amide:sc= -0.193 K(o=-0.19,f=-3.7!) USER MOD Single : A 65 GLN : amide:sc= 0.721 K(o=0.72,f=-6.1!) USER MOD Single : A 68 LYS NZ :NH3+ -166:sc= 1.24 (180deg=1.18) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 GLN : amide:sc= 0 K(o=0,f=-1.9!) USER MOD Single : A 76 GLN : amide:sc= 0.257 K(o=0.26,f=-0.87) USER MOD Single : A 78 SER OG : rot 106:sc= 1.26 USER MOD Single : A 81 LYS NZ :NH3+ 139:sc= 0.0174 (180deg=0) USER MOD Single : A 91 ASN : amide:sc= -0.124 K(o=-0.12,f=-0.63) USER MOD Single : A 92 GLN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 103 SER OG : rot -27:sc= 1.21 USER MOD Single : A 107 ASN : amide:sc= -0.0631 K(o=-0.063,f=-1.7!) USER MOD Single : A 110 LYS NZ :NH3+ 178:sc= 1.27 (180deg=1.14) USER MOD Single : A 113 ASN : amide:sc= 0 X(o=0,f=-0.35) USER MOD Single : A 116 SER OG : rot 180:sc= -0.198 USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 GLN : amide:sc= 0.328 K(o=0.33,f=-0.21) USER MOD Single : A 121 ASN : amide:sc= -0.0603 K(o=-0.06,f=-1.6!) USER MOD Single : A 126 SER OG : rot 172:sc= 1.17 USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 4.195 2.260 1.264 1.00 0.00 N ATOM 2 CA SER A 1 4.949 3.010 2.262 1.00 0.00 C ATOM 3 C SER A 1 5.094 4.472 1.859 1.00 0.00 C ATOM 4 O SER A 1 4.901 4.827 0.696 1.00 0.00 O ATOM 5 CB SER A 1 6.320 2.390 2.453 1.00 0.00 C ATOM 6 OG SER A 1 7.110 2.556 1.308 1.00 0.00 O ATOM 0 H1 SER A 1 3.241 2.061 1.627 1.00 0.00 H new ATOM 0 H2 SER A 1 4.124 2.819 0.390 1.00 0.00 H new ATOM 0 H3 SER A 1 4.682 1.364 1.062 1.00 0.00 H new ATOM 0 HA SER A 1 4.398 2.968 3.202 1.00 0.00 H new ATOM 0 HB2 SER A 1 6.814 2.848 3.310 1.00 0.00 H new ATOM 0 HB3 SER A 1 6.215 1.328 2.676 1.00 0.00 H new ATOM 0 HG SER A 1 7.990 2.150 1.456 1.00 0.00 H new ATOM 14 N GLU A 2 5.436 5.315 2.827 1.00 0.00 N ATOM 15 CA GLU A 2 5.654 6.733 2.565 1.00 0.00 C ATOM 16 C GLU A 2 6.939 6.957 1.779 1.00 0.00 C ATOM 17 O GLU A 2 7.035 7.889 0.980 1.00 0.00 O ATOM 18 CB GLU A 2 5.706 7.516 3.879 1.00 0.00 C ATOM 19 CG GLU A 2 4.379 7.589 4.621 1.00 0.00 C ATOM 20 CD GLU A 2 4.476 8.334 5.923 1.00 0.00 C ATOM 21 OE1 GLU A 2 5.570 8.654 6.322 1.00 0.00 O ATOM 22 OE2 GLU A 2 3.455 8.584 6.519 1.00 0.00 O ATOM 0 H GLU A 2 5.568 5.041 3.801 1.00 0.00 H new ATOM 0 HA GLU A 2 4.818 7.093 1.966 1.00 0.00 H new ATOM 0 HB2 GLU A 2 6.449 7.057 4.532 1.00 0.00 H new ATOM 0 HB3 GLU A 2 6.048 8.530 3.670 1.00 0.00 H new ATOM 0 HG2 GLU A 2 3.639 8.075 3.985 1.00 0.00 H new ATOM 0 HG3 GLU A 2 4.020 6.578 4.813 1.00 0.00 H new ATOM 29 N GLN A 3 7.925 6.097 2.009 1.00 0.00 N ATOM 30 CA GLN A 3 9.189 6.169 1.286 1.00 0.00 C ATOM 31 C GLN A 3 8.991 5.892 -0.198 1.00 0.00 C ATOM 32 O GLN A 3 9.522 6.606 -1.049 1.00 0.00 O ATOM 33 CB GLN A 3 10.199 5.179 1.873 1.00 0.00 C ATOM 34 CG GLN A 3 10.697 5.545 3.260 1.00 0.00 C ATOM 35 CD GLN A 3 11.633 4.499 3.834 1.00 0.00 C ATOM 36 OE1 GLN A 3 11.601 3.331 3.436 1.00 0.00 O ATOM 37 NE2 GLN A 3 12.475 4.912 4.775 1.00 0.00 N ATOM 0 H GLN A 3 7.873 5.341 2.692 1.00 0.00 H new ATOM 0 HA GLN A 3 9.578 7.181 1.396 1.00 0.00 H new ATOM 0 HB2 GLN A 3 9.741 4.191 1.913 1.00 0.00 H new ATOM 0 HB3 GLN A 3 11.053 5.107 1.200 1.00 0.00 H new ATOM 0 HG2 GLN A 3 11.212 6.505 3.216 1.00 0.00 H new ATOM 0 HG3 GLN A 3 9.844 5.671 3.927 1.00 0.00 H new ATOM 0 HE21 GLN A 3 12.467 5.887 5.074 1.00 0.00 H new ATOM 0 HE22 GLN A 3 13.129 4.254 5.198 1.00 0.00 H new ATOM 46 N PHE A 4 8.224 4.851 -0.504 1.00 0.00 N ATOM 47 CA PHE A 4 7.864 4.543 -1.883 1.00 0.00 C ATOM 48 C PHE A 4 7.047 5.669 -2.503 1.00 0.00 C ATOM 49 O PHE A 4 7.321 6.105 -3.621 1.00 0.00 O ATOM 50 CB PHE A 4 7.074 3.235 -1.949 1.00 0.00 C ATOM 51 CG PHE A 4 6.608 2.878 -3.332 1.00 0.00 C ATOM 52 CD1 PHE A 4 7.477 2.294 -4.242 1.00 0.00 C ATOM 53 CD2 PHE A 4 5.302 3.125 -3.726 1.00 0.00 C ATOM 54 CE1 PHE A 4 7.050 1.965 -5.515 1.00 0.00 C ATOM 55 CE2 PHE A 4 4.872 2.796 -4.997 1.00 0.00 C ATOM 56 CZ PHE A 4 5.748 2.216 -5.892 1.00 0.00 C ATOM 0 H PHE A 4 7.839 4.205 0.186 1.00 0.00 H new ATOM 0 HA PHE A 4 8.788 4.434 -2.451 1.00 0.00 H new ATOM 0 HB2 PHE A 4 7.695 2.426 -1.565 1.00 0.00 H new ATOM 0 HB3 PHE A 4 6.208 3.311 -1.292 1.00 0.00 H new ATOM 0 HD1 PHE A 4 8.498 2.094 -3.953 1.00 0.00 H new ATOM 0 HD2 PHE A 4 4.612 3.580 -3.031 1.00 0.00 H new ATOM 0 HE1 PHE A 4 7.737 1.511 -6.214 1.00 0.00 H new ATOM 0 HE2 PHE A 4 3.851 2.992 -5.290 1.00 0.00 H new ATOM 0 HZ PHE A 4 5.414 1.959 -6.886 1.00 0.00 H new ATOM 66 N THR A 5 6.041 6.135 -1.771 1.00 0.00 N ATOM 67 CA THR A 5 5.199 7.231 -2.235 1.00 0.00 C ATOM 68 C THR A 5 6.041 8.414 -2.698 1.00 0.00 C ATOM 69 O THR A 5 5.784 8.996 -3.752 1.00 0.00 O ATOM 70 CB THR A 5 4.226 7.689 -1.133 1.00 0.00 C ATOM 71 OG1 THR A 5 3.377 6.596 -0.758 1.00 0.00 O ATOM 72 CG2 THR A 5 3.370 8.846 -1.624 1.00 0.00 C ATOM 0 H THR A 5 5.789 5.770 -0.853 1.00 0.00 H new ATOM 0 HA THR A 5 4.622 6.858 -3.081 1.00 0.00 H new ATOM 0 HB THR A 5 4.806 8.020 -0.272 1.00 0.00 H new ATOM 0 HG1 THR A 5 3.912 5.901 -0.322 1.00 0.00 H new ATOM 0 HG21 THR A 5 2.689 9.156 -0.832 1.00 0.00 H new ATOM 0 HG22 THR A 5 4.012 9.683 -1.899 1.00 0.00 H new ATOM 0 HG23 THR A 5 2.795 8.529 -2.494 1.00 0.00 H new ATOM 80 N THR A 6 7.047 8.764 -1.904 1.00 0.00 N ATOM 81 CA THR A 6 7.964 9.841 -2.259 1.00 0.00 C ATOM 82 C THR A 6 8.721 9.520 -3.541 1.00 0.00 C ATOM 83 O THR A 6 8.845 10.364 -4.428 1.00 0.00 O ATOM 84 CB THR A 6 8.965 10.114 -1.121 1.00 0.00 C ATOM 85 OG1 THR A 6 8.256 10.531 0.053 1.00 0.00 O ATOM 86 CG2 THR A 6 9.950 11.199 -1.526 1.00 0.00 C ATOM 0 H THR A 6 7.248 8.317 -1.009 1.00 0.00 H new ATOM 0 HA THR A 6 7.363 10.736 -2.422 1.00 0.00 H new ATOM 0 HB THR A 6 9.516 9.196 -0.914 1.00 0.00 H new ATOM 0 HG1 THR A 6 7.820 9.756 0.465 1.00 0.00 H new ATOM 0 HG21 THR A 6 10.650 11.379 -0.710 1.00 0.00 H new ATOM 0 HG22 THR A 6 10.500 10.879 -2.411 1.00 0.00 H new ATOM 0 HG23 THR A 6 9.408 12.118 -1.748 1.00 0.00 H new ATOM 94 N LYS A 7 9.227 8.294 -3.632 1.00 0.00 N ATOM 95 CA LYS A 7 9.963 7.855 -4.812 1.00 0.00 C ATOM 96 C LYS A 7 9.076 7.864 -6.050 1.00 0.00 C ATOM 97 O LYS A 7 9.534 8.165 -7.152 1.00 0.00 O ATOM 98 CB LYS A 7 10.544 6.458 -4.591 1.00 0.00 C ATOM 99 CG LYS A 7 11.688 6.403 -3.587 1.00 0.00 C ATOM 100 CD LYS A 7 12.179 4.977 -3.386 1.00 0.00 C ATOM 101 CE LYS A 7 13.311 4.919 -2.371 1.00 0.00 C ATOM 102 NZ LYS A 7 13.789 3.527 -2.149 1.00 0.00 N ATOM 0 H LYS A 7 9.141 7.587 -2.902 1.00 0.00 H new ATOM 0 HA LYS A 7 10.781 8.557 -4.975 1.00 0.00 H new ATOM 0 HB2 LYS A 7 9.747 5.796 -4.252 1.00 0.00 H new ATOM 0 HB3 LYS A 7 10.896 6.069 -5.546 1.00 0.00 H new ATOM 0 HG2 LYS A 7 12.511 7.027 -3.935 1.00 0.00 H new ATOM 0 HG3 LYS A 7 11.358 6.814 -2.633 1.00 0.00 H new ATOM 0 HD2 LYS A 7 11.353 4.350 -3.049 1.00 0.00 H new ATOM 0 HD3 LYS A 7 12.520 4.570 -4.338 1.00 0.00 H new ATOM 0 HE2 LYS A 7 14.140 5.536 -2.717 1.00 0.00 H new ATOM 0 HE3 LYS A 7 12.972 5.341 -1.425 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 14.560 3.532 -1.451 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 13.005 2.943 -1.795 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 14.137 3.132 -3.046 1.00 0.00 H new ATOM 116 N LEU A 8 7.803 7.533 -5.862 1.00 0.00 N ATOM 117 CA LEU A 8 6.835 7.560 -6.952 1.00 0.00 C ATOM 118 C LEU A 8 6.546 8.989 -7.396 1.00 0.00 C ATOM 119 O LEU A 8 6.534 9.287 -8.590 1.00 0.00 O ATOM 120 CB LEU A 8 5.530 6.879 -6.519 1.00 0.00 C ATOM 121 CG LEU A 8 4.419 6.839 -7.576 1.00 0.00 C ATOM 122 CD1 LEU A 8 4.922 6.112 -8.815 1.00 0.00 C ATOM 123 CD2 LEU A 8 3.192 6.150 -6.997 1.00 0.00 C ATOM 0 H LEU A 8 7.417 7.242 -4.964 1.00 0.00 H new ATOM 0 HA LEU A 8 7.264 7.018 -7.795 1.00 0.00 H new ATOM 0 HB2 LEU A 8 5.758 5.856 -6.219 1.00 0.00 H new ATOM 0 HB3 LEU A 8 5.149 7.393 -5.637 1.00 0.00 H new ATOM 0 HG LEU A 8 4.140 7.853 -7.863 1.00 0.00 H new ATOM 0 HD11 LEU A 8 4.132 6.084 -9.566 1.00 0.00 H new ATOM 0 HD12 LEU A 8 5.788 6.637 -9.218 1.00 0.00 H new ATOM 0 HD13 LEU A 8 5.206 5.094 -8.549 1.00 0.00 H new ATOM 0 HD21 LEU A 8 2.402 6.122 -7.748 1.00 0.00 H new ATOM 0 HD22 LEU A 8 3.451 5.133 -6.704 1.00 0.00 H new ATOM 0 HD23 LEU A 8 2.843 6.702 -6.124 1.00 0.00 H new ATOM 135 N ASN A 9 6.314 9.868 -6.428 1.00 0.00 N ATOM 136 CA ASN A 9 6.038 11.271 -6.717 1.00 0.00 C ATOM 137 C ASN A 9 7.229 11.939 -7.391 1.00 0.00 C ATOM 138 O ASN A 9 7.065 12.843 -8.209 1.00 0.00 O ATOM 139 CB ASN A 9 5.657 12.012 -5.449 1.00 0.00 C ATOM 140 CG ASN A 9 4.271 11.672 -4.975 1.00 0.00 C ATOM 141 OD1 ASN A 9 3.443 11.172 -5.745 1.00 0.00 O ATOM 142 ND2 ASN A 9 4.002 11.932 -3.721 1.00 0.00 N ATOM 0 H ASN A 9 6.311 9.634 -5.435 1.00 0.00 H new ATOM 0 HA ASN A 9 5.196 11.312 -7.408 1.00 0.00 H new ATOM 0 HB2 ASN A 9 6.374 11.773 -4.664 1.00 0.00 H new ATOM 0 HB3 ASN A 9 5.723 13.085 -5.626 1.00 0.00 H new ATOM 0 HD21 ASN A 9 3.078 11.721 -3.343 1.00 0.00 H new ATOM 0 HD22 ASN A 9 4.716 12.345 -3.121 1.00 0.00 H new ATOM 149 N THR A 10 8.430 11.488 -7.042 1.00 0.00 N ATOM 150 CA THR A 10 9.650 12.012 -7.644 1.00 0.00 C ATOM 151 C THR A 10 10.299 10.982 -8.559 1.00 0.00 C ATOM 152 O THR A 10 11.521 10.944 -8.698 1.00 0.00 O ATOM 153 CB THR A 10 10.656 12.451 -6.564 1.00 0.00 C ATOM 154 OG1 THR A 10 10.964 11.339 -5.713 1.00 0.00 O ATOM 155 CG2 THR A 10 10.079 13.581 -5.725 1.00 0.00 C ATOM 0 H THR A 10 8.584 10.760 -6.344 1.00 0.00 H new ATOM 0 HA THR A 10 9.369 12.881 -8.239 1.00 0.00 H new ATOM 0 HB THR A 10 11.563 12.803 -7.056 1.00 0.00 H new ATOM 0 HG1 THR A 10 10.182 11.121 -5.164 1.00 0.00 H new ATOM 0 HG21 THR A 10 10.804 13.878 -4.967 1.00 0.00 H new ATOM 0 HG22 THR A 10 9.855 14.433 -6.367 1.00 0.00 H new ATOM 0 HG23 THR A 10 9.164 13.243 -5.239 1.00 0.00 H new ATOM 163 N LEU A 11 9.473 10.148 -9.182 1.00 0.00 N ATOM 164 CA LEU A 11 9.964 9.132 -10.106 1.00 0.00 C ATOM 165 C LEU A 11 10.649 9.766 -11.309 1.00 0.00 C ATOM 166 O LEU A 11 10.123 10.700 -11.914 1.00 0.00 O ATOM 167 CB LEU A 11 8.807 8.242 -10.578 1.00 0.00 C ATOM 168 CG LEU A 11 9.211 6.973 -11.339 1.00 0.00 C ATOM 169 CD1 LEU A 11 9.913 6.012 -10.388 1.00 0.00 C ATOM 170 CD2 LEU A 11 7.975 6.331 -11.950 1.00 0.00 C ATOM 0 H LEU A 11 8.460 10.156 -9.064 1.00 0.00 H new ATOM 0 HA LEU A 11 10.696 8.523 -9.576 1.00 0.00 H new ATOM 0 HB2 LEU A 11 8.219 7.950 -9.708 1.00 0.00 H new ATOM 0 HB3 LEU A 11 8.155 8.835 -11.219 1.00 0.00 H new ATOM 0 HG LEU A 11 9.901 7.226 -12.144 1.00 0.00 H new ATOM 0 HD11 LEU A 11 10.200 5.110 -10.929 1.00 0.00 H new ATOM 0 HD12 LEU A 11 10.804 6.490 -9.980 1.00 0.00 H new ATOM 0 HD13 LEU A 11 9.238 5.748 -9.574 1.00 0.00 H new ATOM 0 HD21 LEU A 11 8.263 5.429 -12.491 1.00 0.00 H new ATOM 0 HD22 LEU A 11 7.271 6.071 -11.159 1.00 0.00 H new ATOM 0 HD23 LEU A 11 7.504 7.032 -12.639 1.00 0.00 H new ATOM 182 N GLU A 12 11.825 9.252 -11.653 1.00 0.00 N ATOM 183 CA GLU A 12 12.597 9.784 -12.769 1.00 0.00 C ATOM 184 C GLU A 12 12.141 9.181 -14.091 1.00 0.00 C ATOM 185 O GLU A 12 11.351 8.237 -14.115 1.00 0.00 O ATOM 186 CB GLU A 12 14.089 9.515 -12.562 1.00 0.00 C ATOM 187 CG GLU A 12 14.684 10.185 -11.331 1.00 0.00 C ATOM 188 CD GLU A 12 16.149 9.895 -11.158 1.00 0.00 C ATOM 189 OE1 GLU A 12 16.670 9.101 -11.903 1.00 0.00 O ATOM 190 OE2 GLU A 12 16.748 10.470 -10.279 1.00 0.00 O ATOM 0 H GLU A 12 12.265 8.466 -11.174 1.00 0.00 H new ATOM 0 HA GLU A 12 12.429 10.860 -12.807 1.00 0.00 H new ATOM 0 HB2 GLU A 12 14.245 8.439 -12.486 1.00 0.00 H new ATOM 0 HB3 GLU A 12 14.633 9.854 -13.444 1.00 0.00 H new ATOM 0 HG2 GLU A 12 14.538 11.263 -11.404 1.00 0.00 H new ATOM 0 HG3 GLU A 12 14.145 9.850 -10.445 1.00 0.00 H new ATOM 197 N ASP A 13 12.645 9.730 -15.191 1.00 0.00 N ATOM 198 CA ASP A 13 12.399 9.164 -16.512 1.00 0.00 C ATOM 199 C ASP A 13 13.395 8.056 -16.831 1.00 0.00 C ATOM 200 O ASP A 13 13.286 7.385 -17.857 1.00 0.00 O ATOM 201 CB ASP A 13 12.477 10.252 -17.586 1.00 0.00 C ATOM 202 CG ASP A 13 11.345 11.266 -17.484 1.00 0.00 C ATOM 203 OD1 ASP A 13 10.317 10.928 -16.949 1.00 0.00 O ATOM 204 OD2 ASP A 13 11.521 12.370 -17.943 1.00 0.00 O ATOM 0 H ASP A 13 13.227 10.568 -15.194 1.00 0.00 H new ATOM 0 HA ASP A 13 11.396 8.737 -16.506 1.00 0.00 H new ATOM 0 HB2 ASP A 13 13.432 10.771 -17.502 1.00 0.00 H new ATOM 0 HB3 ASP A 13 12.453 9.786 -18.571 1.00 0.00 H new ATOM 209 N SER A 14 14.368 7.869 -15.944 1.00 0.00 N ATOM 210 CA SER A 14 15.371 6.826 -16.117 1.00 0.00 C ATOM 211 C SER A 14 14.778 5.445 -15.864 1.00 0.00 C ATOM 212 O SER A 14 13.833 5.297 -15.090 1.00 0.00 O ATOM 213 CB SER A 14 16.538 7.064 -15.179 1.00 0.00 C ATOM 214 OG SER A 14 16.156 6.878 -13.844 1.00 0.00 O ATOM 0 H SER A 14 14.482 8.427 -15.098 1.00 0.00 H new ATOM 0 HA SER A 14 15.722 6.864 -17.148 1.00 0.00 H new ATOM 0 HB2 SER A 14 17.352 6.383 -15.426 1.00 0.00 H new ATOM 0 HB3 SER A 14 16.917 8.077 -15.315 1.00 0.00 H new ATOM 0 HG SER A 14 16.383 7.677 -13.324 1.00 0.00 H new ATOM 220 N GLN A 15 15.340 4.437 -16.523 1.00 0.00 N ATOM 221 CA GLN A 15 14.853 3.069 -16.389 1.00 0.00 C ATOM 222 C GLN A 15 15.235 2.478 -15.037 1.00 0.00 C ATOM 223 O GLN A 15 14.536 1.615 -14.507 1.00 0.00 O ATOM 224 CB GLN A 15 15.403 2.191 -17.516 1.00 0.00 C ATOM 225 CG GLN A 15 14.877 2.549 -18.896 1.00 0.00 C ATOM 226 CD GLN A 15 13.371 2.399 -18.998 1.00 0.00 C ATOM 227 OE1 GLN A 15 12.802 1.394 -18.562 1.00 0.00 O ATOM 228 NE2 GLN A 15 12.715 3.400 -19.575 1.00 0.00 N ATOM 0 H GLN A 15 16.133 4.542 -17.155 1.00 0.00 H new ATOM 0 HA GLN A 15 13.765 3.096 -16.457 1.00 0.00 H new ATOM 0 HB2 GLN A 15 16.490 2.266 -17.523 1.00 0.00 H new ATOM 0 HB3 GLN A 15 15.157 1.150 -17.304 1.00 0.00 H new ATOM 0 HG2 GLN A 15 15.154 3.577 -19.132 1.00 0.00 H new ATOM 0 HG3 GLN A 15 15.354 1.911 -19.640 1.00 0.00 H new ATOM 0 HE21 GLN A 15 13.226 4.212 -19.921 1.00 0.00 H new ATOM 0 HE22 GLN A 15 11.701 3.356 -19.672 1.00 0.00 H new ATOM 237 N GLU A 16 16.347 2.949 -14.485 1.00 0.00 N ATOM 238 CA GLU A 16 16.770 2.544 -13.149 1.00 0.00 C ATOM 239 C GLU A 16 15.718 2.900 -12.107 1.00 0.00 C ATOM 240 O GLU A 16 15.307 2.054 -11.312 1.00 0.00 O ATOM 241 CB GLU A 16 18.103 3.205 -12.788 1.00 0.00 C ATOM 242 CG GLU A 16 18.642 2.824 -11.417 1.00 0.00 C ATOM 243 CD GLU A 16 19.968 3.463 -11.112 1.00 0.00 C ATOM 244 OE1 GLU A 16 20.476 4.164 -11.954 1.00 0.00 O ATOM 245 OE2 GLU A 16 20.474 3.250 -10.035 1.00 0.00 O ATOM 0 H GLU A 16 16.973 3.612 -14.942 1.00 0.00 H new ATOM 0 HA GLU A 16 16.896 1.461 -13.154 1.00 0.00 H new ATOM 0 HB2 GLU A 16 18.843 2.939 -13.543 1.00 0.00 H new ATOM 0 HB3 GLU A 16 17.981 4.287 -12.829 1.00 0.00 H new ATOM 0 HG2 GLU A 16 17.920 3.115 -10.654 1.00 0.00 H new ATOM 0 HG3 GLU A 16 18.745 1.740 -11.361 1.00 0.00 H new ATOM 252 N SER A 17 15.285 4.156 -12.115 1.00 0.00 N ATOM 253 CA SER A 17 14.277 4.625 -11.171 1.00 0.00 C ATOM 254 C SER A 17 12.947 3.915 -11.388 1.00 0.00 C ATOM 255 O SER A 17 12.308 3.468 -10.436 1.00 0.00 O ATOM 256 CB SER A 17 14.089 6.123 -11.310 1.00 0.00 C ATOM 257 OG SER A 17 13.139 6.596 -10.396 1.00 0.00 O ATOM 0 H SER A 17 15.617 4.868 -12.765 1.00 0.00 H new ATOM 0 HA SER A 17 14.627 4.396 -10.164 1.00 0.00 H new ATOM 0 HB2 SER A 17 15.040 6.629 -11.146 1.00 0.00 H new ATOM 0 HB3 SER A 17 13.772 6.361 -12.325 1.00 0.00 H new ATOM 0 HG SER A 17 13.505 7.365 -9.912 1.00 0.00 H new ATOM 263 N ILE A 18 12.534 3.814 -12.647 1.00 0.00 N ATOM 264 CA ILE A 18 11.253 3.206 -12.988 1.00 0.00 C ATOM 265 C ILE A 18 11.219 1.736 -12.592 1.00 0.00 C ATOM 266 O ILE A 18 10.268 1.275 -11.960 1.00 0.00 O ATOM 267 CB ILE A 18 10.964 3.340 -14.494 1.00 0.00 C ATOM 268 CG1 ILE A 18 10.763 4.810 -14.870 1.00 0.00 C ATOM 269 CG2 ILE A 18 9.744 2.517 -14.877 1.00 0.00 C ATOM 270 CD1 ILE A 18 10.793 5.069 -16.359 1.00 0.00 C ATOM 0 H ILE A 18 13.069 4.146 -13.449 1.00 0.00 H new ATOM 0 HA ILE A 18 10.483 3.738 -12.430 1.00 0.00 H new ATOM 0 HB ILE A 18 11.822 2.958 -15.047 1.00 0.00 H new ATOM 0 HG12 ILE A 18 9.807 5.150 -14.471 1.00 0.00 H new ATOM 0 HG13 ILE A 18 11.539 5.407 -14.391 1.00 0.00 H new ATOM 0 HG21 ILE A 18 9.554 2.623 -15.945 1.00 0.00 H new ATOM 0 HG22 ILE A 18 9.925 1.468 -14.643 1.00 0.00 H new ATOM 0 HG23 ILE A 18 8.877 2.869 -14.318 1.00 0.00 H new ATOM 0 HD11 ILE A 18 10.644 6.132 -16.546 1.00 0.00 H new ATOM 0 HD12 ILE A 18 11.758 4.761 -16.762 1.00 0.00 H new ATOM 0 HD13 ILE A 18 9.999 4.500 -16.843 1.00 0.00 H new ATOM 282 N SER A 19 12.262 1.003 -12.967 1.00 0.00 N ATOM 283 CA SER A 19 12.315 -0.434 -12.725 1.00 0.00 C ATOM 284 C SER A 19 12.429 -0.737 -11.236 1.00 0.00 C ATOM 285 O SER A 19 11.960 -1.773 -10.766 1.00 0.00 O ATOM 286 CB SER A 19 13.489 -1.045 -13.465 1.00 0.00 C ATOM 287 OG SER A 19 14.706 -0.570 -12.958 1.00 0.00 O ATOM 0 H SER A 19 13.083 1.381 -13.440 1.00 0.00 H new ATOM 0 HA SER A 19 11.387 -0.872 -13.094 1.00 0.00 H new ATOM 0 HB2 SER A 19 13.453 -2.131 -13.377 1.00 0.00 H new ATOM 0 HB3 SER A 19 13.417 -0.809 -14.527 1.00 0.00 H new ATOM 0 HG SER A 19 14.962 0.247 -13.434 1.00 0.00 H new ATOM 293 N SER A 20 13.055 0.173 -10.498 1.00 0.00 N ATOM 294 CA SER A 20 13.161 0.044 -9.050 1.00 0.00 C ATOM 295 C SER A 20 11.797 0.167 -8.384 1.00 0.00 C ATOM 296 O SER A 20 11.459 -0.609 -7.490 1.00 0.00 O ATOM 297 CB SER A 20 14.099 1.101 -8.499 1.00 0.00 C ATOM 298 OG SER A 20 15.412 0.887 -8.942 1.00 0.00 O ATOM 0 H SER A 20 13.497 1.009 -10.880 1.00 0.00 H new ATOM 0 HA SER A 20 13.561 -0.946 -8.830 1.00 0.00 H new ATOM 0 HB2 SER A 20 13.762 2.090 -8.811 1.00 0.00 H new ATOM 0 HB3 SER A 20 14.072 1.084 -7.409 1.00 0.00 H new ATOM 0 HG SER A 20 15.523 1.276 -9.835 1.00 0.00 H new ATOM 304 N ALA A 21 11.015 1.147 -8.825 1.00 0.00 N ATOM 305 CA ALA A 21 9.668 1.346 -8.304 1.00 0.00 C ATOM 306 C ALA A 21 8.749 0.198 -8.699 1.00 0.00 C ATOM 307 O ALA A 21 7.967 -0.292 -7.884 1.00 0.00 O ATOM 308 CB ALA A 21 9.101 2.671 -8.793 1.00 0.00 C ATOM 0 H ALA A 21 11.292 1.816 -9.543 1.00 0.00 H new ATOM 0 HA ALA A 21 9.729 1.369 -7.216 1.00 0.00 H new ATOM 0 HB1 ALA A 21 8.095 2.805 -8.396 1.00 0.00 H new ATOM 0 HB2 ALA A 21 9.738 3.487 -8.452 1.00 0.00 H new ATOM 0 HB3 ALA A 21 9.064 2.671 -9.882 1.00 0.00 H new ATOM 314 N SER A 22 8.848 -0.227 -9.953 1.00 0.00 N ATOM 315 CA SER A 22 8.004 -1.300 -10.467 1.00 0.00 C ATOM 316 C SER A 22 8.371 -2.638 -9.839 1.00 0.00 C ATOM 317 O SER A 22 7.526 -3.522 -9.700 1.00 0.00 O ATOM 318 CB SER A 22 8.132 -1.387 -11.976 1.00 0.00 C ATOM 319 OG SER A 22 9.401 -1.852 -12.346 1.00 0.00 O ATOM 0 H SER A 22 9.505 0.155 -10.633 1.00 0.00 H new ATOM 0 HA SER A 22 6.971 -1.071 -10.204 1.00 0.00 H new ATOM 0 HB2 SER A 22 7.366 -2.055 -12.372 1.00 0.00 H new ATOM 0 HB3 SER A 22 7.958 -0.405 -12.417 1.00 0.00 H new ATOM 0 HG SER A 22 9.534 -1.709 -13.306 1.00 0.00 H new ATOM 325 N LYS A 23 9.637 -2.782 -9.461 1.00 0.00 N ATOM 326 CA LYS A 23 10.085 -3.949 -8.712 1.00 0.00 C ATOM 327 C LYS A 23 9.333 -4.080 -7.394 1.00 0.00 C ATOM 328 O LYS A 23 8.811 -5.147 -7.069 1.00 0.00 O ATOM 329 CB LYS A 23 11.591 -3.874 -8.453 1.00 0.00 C ATOM 330 CG LYS A 23 12.154 -5.053 -7.671 1.00 0.00 C ATOM 331 CD LYS A 23 13.659 -4.926 -7.488 1.00 0.00 C ATOM 332 CE LYS A 23 14.217 -6.080 -6.668 1.00 0.00 C ATOM 333 NZ LYS A 23 15.691 -5.975 -6.490 1.00 0.00 N ATOM 0 H LYS A 23 10.372 -2.103 -9.662 1.00 0.00 H new ATOM 0 HA LYS A 23 9.873 -4.832 -9.314 1.00 0.00 H new ATOM 0 HB2 LYS A 23 12.109 -3.808 -9.410 1.00 0.00 H new ATOM 0 HB3 LYS A 23 11.808 -2.955 -7.908 1.00 0.00 H new ATOM 0 HG2 LYS A 23 11.670 -5.110 -6.696 1.00 0.00 H new ATOM 0 HG3 LYS A 23 11.926 -5.982 -8.194 1.00 0.00 H new ATOM 0 HD2 LYS A 23 14.145 -4.902 -8.463 1.00 0.00 H new ATOM 0 HD3 LYS A 23 13.889 -3.982 -6.994 1.00 0.00 H new ATOM 0 HE2 LYS A 23 13.734 -6.098 -5.691 1.00 0.00 H new ATOM 0 HE3 LYS A 23 13.977 -7.023 -7.159 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 16.031 -6.780 -5.926 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 16.155 -5.984 -7.421 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 15.919 -5.087 -5.998 1.00 0.00 H new ATOM 347 N TRP A 24 9.281 -2.989 -6.637 1.00 0.00 N ATOM 348 CA TRP A 24 8.547 -2.964 -5.377 1.00 0.00 C ATOM 349 C TRP A 24 7.082 -3.325 -5.586 1.00 0.00 C ATOM 350 O TRP A 24 6.508 -4.100 -4.821 1.00 0.00 O ATOM 351 CB TRP A 24 8.649 -1.583 -4.728 1.00 0.00 C ATOM 352 CG TRP A 24 8.025 -1.514 -3.367 1.00 0.00 C ATOM 353 CD1 TRP A 24 8.630 -1.791 -2.178 1.00 0.00 C ATOM 354 CD2 TRP A 24 6.663 -1.141 -3.046 1.00 0.00 C ATOM 355 NE1 TRP A 24 7.743 -1.618 -1.144 1.00 0.00 N ATOM 356 CE2 TRP A 24 6.535 -1.220 -1.657 1.00 0.00 C ATOM 357 CE3 TRP A 24 5.559 -0.753 -3.816 1.00 0.00 C ATOM 358 CZ2 TRP A 24 5.344 -0.925 -1.012 1.00 0.00 C ATOM 359 CZ3 TRP A 24 4.365 -0.456 -3.169 1.00 0.00 C ATOM 360 CH2 TRP A 24 4.261 -0.540 -1.803 1.00 0.00 C ATOM 0 H TRP A 24 9.739 -2.109 -6.875 1.00 0.00 H new ATOM 0 HA TRP A 24 8.995 -3.707 -4.717 1.00 0.00 H new ATOM 0 HB2 TRP A 24 9.700 -1.303 -4.652 1.00 0.00 H new ATOM 0 HB3 TRP A 24 8.170 -0.849 -5.376 1.00 0.00 H new ATOM 0 HD1 TRP A 24 9.658 -2.102 -2.065 1.00 0.00 H new ATOM 0 HE1 TRP A 24 7.949 -1.762 -0.155 1.00 0.00 H new ATOM 0 HE3 TRP A 24 5.634 -0.686 -4.891 1.00 0.00 H new ATOM 0 HZ2 TRP A 24 5.258 -0.991 0.063 1.00 0.00 H new ATOM 0 HZ3 TRP A 24 3.506 -0.155 -3.750 1.00 0.00 H new ATOM 0 HH2 TRP A 24 3.320 -0.303 -1.330 1.00 0.00 H new ATOM 371 N LEU A 25 6.481 -2.758 -6.627 1.00 0.00 N ATOM 372 CA LEU A 25 5.086 -3.032 -6.949 1.00 0.00 C ATOM 373 C LEU A 25 4.876 -4.505 -7.278 1.00 0.00 C ATOM 374 O LEU A 25 3.865 -5.097 -6.901 1.00 0.00 O ATOM 375 CB LEU A 25 4.635 -2.168 -8.133 1.00 0.00 C ATOM 376 CG LEU A 25 4.583 -0.657 -7.872 1.00 0.00 C ATOM 377 CD1 LEU A 25 4.313 0.076 -9.179 1.00 0.00 C ATOM 378 CD2 LEU A 25 3.503 -0.356 -6.843 1.00 0.00 C ATOM 0 H LEU A 25 6.939 -2.105 -7.263 1.00 0.00 H new ATOM 0 HA LEU A 25 4.486 -2.786 -6.073 1.00 0.00 H new ATOM 0 HB2 LEU A 25 5.309 -2.351 -8.970 1.00 0.00 H new ATOM 0 HB3 LEU A 25 3.644 -2.499 -8.444 1.00 0.00 H new ATOM 0 HG LEU A 25 5.539 -0.314 -7.477 1.00 0.00 H new ATOM 0 HD11 LEU A 25 4.276 1.149 -8.993 1.00 0.00 H new ATOM 0 HD12 LEU A 25 5.110 -0.142 -9.890 1.00 0.00 H new ATOM 0 HD13 LEU A 25 3.359 -0.254 -9.591 1.00 0.00 H new ATOM 0 HD21 LEU A 25 3.466 0.717 -6.658 1.00 0.00 H new ATOM 0 HD22 LEU A 25 2.537 -0.693 -7.220 1.00 0.00 H new ATOM 0 HD23 LEU A 25 3.731 -0.877 -5.913 1.00 0.00 H new ATOM 390 N LEU A 26 5.837 -5.091 -7.985 1.00 0.00 N ATOM 391 CA LEU A 26 5.805 -6.517 -8.287 1.00 0.00 C ATOM 392 C LEU A 26 5.937 -7.351 -7.019 1.00 0.00 C ATOM 393 O LEU A 26 5.220 -8.334 -6.835 1.00 0.00 O ATOM 394 CB LEU A 26 6.932 -6.877 -9.264 1.00 0.00 C ATOM 395 CG LEU A 26 6.989 -8.346 -9.700 1.00 0.00 C ATOM 396 CD1 LEU A 26 5.730 -8.693 -10.484 1.00 0.00 C ATOM 397 CD2 LEU A 26 8.237 -8.579 -10.539 1.00 0.00 C ATOM 0 H LEU A 26 6.648 -4.599 -8.360 1.00 0.00 H new ATOM 0 HA LEU A 26 4.842 -6.741 -8.747 1.00 0.00 H new ATOM 0 HB2 LEU A 26 6.828 -6.257 -10.154 1.00 0.00 H new ATOM 0 HB3 LEU A 26 7.885 -6.617 -8.803 1.00 0.00 H new ATOM 0 HG LEU A 26 7.038 -8.993 -8.824 1.00 0.00 H new ATOM 0 HD11 LEU A 26 5.771 -9.737 -10.794 1.00 0.00 H new ATOM 0 HD12 LEU A 26 4.854 -8.535 -9.854 1.00 0.00 H new ATOM 0 HD13 LEU A 26 5.663 -8.055 -11.365 1.00 0.00 H new ATOM 0 HD21 LEU A 26 8.277 -9.623 -10.849 1.00 0.00 H new ATOM 0 HD22 LEU A 26 8.207 -7.940 -11.421 1.00 0.00 H new ATOM 0 HD23 LEU A 26 9.122 -8.341 -9.949 1.00 0.00 H new ATOM 409 N LEU A 27 6.859 -6.953 -6.149 1.00 0.00 N ATOM 410 CA LEU A 27 7.128 -7.698 -4.924 1.00 0.00 C ATOM 411 C LEU A 27 5.885 -7.783 -4.047 1.00 0.00 C ATOM 412 O LEU A 27 5.665 -8.781 -3.361 1.00 0.00 O ATOM 413 CB LEU A 27 8.269 -7.036 -4.142 1.00 0.00 C ATOM 414 CG LEU A 27 9.665 -7.166 -4.765 1.00 0.00 C ATOM 415 CD1 LEU A 27 10.648 -6.293 -3.996 1.00 0.00 C ATOM 416 CD2 LEU A 27 10.097 -8.625 -4.744 1.00 0.00 C ATOM 0 H LEU A 27 7.433 -6.118 -6.269 1.00 0.00 H new ATOM 0 HA LEU A 27 7.420 -8.710 -5.205 1.00 0.00 H new ATOM 0 HB2 LEU A 27 8.040 -5.977 -4.027 1.00 0.00 H new ATOM 0 HB3 LEU A 27 8.296 -7.466 -3.141 1.00 0.00 H new ATOM 0 HG LEU A 27 9.643 -6.829 -5.801 1.00 0.00 H new ATOM 0 HD11 LEU A 27 11.640 -6.385 -4.438 1.00 0.00 H new ATOM 0 HD12 LEU A 27 10.325 -5.253 -4.043 1.00 0.00 H new ATOM 0 HD13 LEU A 27 10.684 -6.615 -2.955 1.00 0.00 H new ATOM 0 HD21 LEU A 27 11.089 -8.717 -5.187 1.00 0.00 H new ATOM 0 HD22 LEU A 27 10.125 -8.981 -3.714 1.00 0.00 H new ATOM 0 HD23 LEU A 27 9.387 -9.223 -5.316 1.00 0.00 H new ATOM 428 N GLN A 28 5.075 -6.730 -4.074 1.00 0.00 N ATOM 429 CA GLN A 28 3.834 -6.699 -3.309 1.00 0.00 C ATOM 430 C GLN A 28 2.754 -7.540 -3.977 1.00 0.00 C ATOM 431 O GLN A 28 1.754 -7.011 -4.463 1.00 0.00 O ATOM 432 CB GLN A 28 3.345 -5.258 -3.140 1.00 0.00 C ATOM 433 CG GLN A 28 4.312 -4.356 -2.392 1.00 0.00 C ATOM 434 CD GLN A 28 4.502 -4.782 -0.949 1.00 0.00 C ATOM 435 OE1 GLN A 28 3.541 -4.868 -0.180 1.00 0.00 O ATOM 436 NE2 GLN A 28 5.747 -5.053 -0.572 1.00 0.00 N ATOM 0 H GLN A 28 5.256 -5.886 -4.618 1.00 0.00 H new ATOM 0 HA GLN A 28 4.038 -7.123 -2.326 1.00 0.00 H new ATOM 0 HB2 GLN A 28 3.157 -4.832 -4.126 1.00 0.00 H new ATOM 0 HB3 GLN A 28 2.392 -5.269 -2.610 1.00 0.00 H new ATOM 0 HG2 GLN A 28 5.277 -4.362 -2.900 1.00 0.00 H new ATOM 0 HG3 GLN A 28 3.943 -3.331 -2.420 1.00 0.00 H new ATOM 0 HE21 GLN A 28 6.512 -4.969 -1.241 1.00 0.00 H new ATOM 0 HE22 GLN A 28 5.937 -5.345 0.386 1.00 0.00 H new ATOM 445 N TYR A 29 2.961 -8.852 -3.997 1.00 0.00 N ATOM 446 CA TYR A 29 2.002 -9.770 -4.601 1.00 0.00 C ATOM 447 C TYR A 29 0.809 -10.001 -3.683 1.00 0.00 C ATOM 448 O TYR A 29 -0.285 -10.330 -4.142 1.00 0.00 O ATOM 449 CB TYR A 29 2.676 -11.101 -4.940 1.00 0.00 C ATOM 450 CG TYR A 29 2.954 -11.970 -3.733 1.00 0.00 C ATOM 451 CD1 TYR A 29 2.001 -12.880 -3.300 1.00 0.00 C ATOM 452 CD2 TYR A 29 4.161 -11.856 -3.060 1.00 0.00 C ATOM 453 CE1 TYR A 29 2.255 -13.674 -2.198 1.00 0.00 C ATOM 454 CE2 TYR A 29 4.414 -12.649 -1.958 1.00 0.00 C ATOM 455 CZ TYR A 29 3.466 -13.555 -1.527 1.00 0.00 C ATOM 456 OH TYR A 29 3.719 -14.346 -0.429 1.00 0.00 O ATOM 0 H TYR A 29 3.785 -9.304 -3.601 1.00 0.00 H new ATOM 0 HA TYR A 29 1.637 -9.316 -5.522 1.00 0.00 H new ATOM 0 HB2 TYR A 29 2.042 -11.652 -5.634 1.00 0.00 H new ATOM 0 HB3 TYR A 29 3.615 -10.901 -5.456 1.00 0.00 H new ATOM 0 HD1 TYR A 29 1.061 -12.968 -3.824 1.00 0.00 H new ATOM 0 HD2 TYR A 29 4.903 -11.147 -3.397 1.00 0.00 H new ATOM 0 HE1 TYR A 29 1.515 -14.384 -1.860 1.00 0.00 H new ATOM 0 HE2 TYR A 29 5.354 -12.560 -1.433 1.00 0.00 H new ATOM 0 HH TYR A 29 4.610 -14.140 -0.076 1.00 0.00 H new ATOM 466 N ARG A 30 1.025 -9.826 -2.384 1.00 0.00 N ATOM 467 CA ARG A 30 -0.053 -9.924 -1.407 1.00 0.00 C ATOM 468 C ARG A 30 -0.974 -8.713 -1.481 1.00 0.00 C ATOM 469 O ARG A 30 -2.153 -8.796 -1.137 1.00 0.00 O ATOM 470 CB ARG A 30 0.509 -10.045 0.001 1.00 0.00 C ATOM 471 CG ARG A 30 1.254 -11.340 0.284 1.00 0.00 C ATOM 472 CD ARG A 30 1.779 -11.380 1.673 1.00 0.00 C ATOM 473 NE ARG A 30 2.546 -12.588 1.928 1.00 0.00 N ATOM 474 CZ ARG A 30 3.102 -12.906 3.113 1.00 0.00 C ATOM 475 NH1 ARG A 30 2.967 -12.096 4.140 1.00 0.00 N ATOM 476 NH2 ARG A 30 3.783 -14.031 3.244 1.00 0.00 N ATOM 0 H ARG A 30 1.939 -9.615 -1.983 1.00 0.00 H new ATOM 0 HA ARG A 30 -0.629 -10.818 -1.644 1.00 0.00 H new ATOM 0 HB2 ARG A 30 1.184 -9.208 0.180 1.00 0.00 H new ATOM 0 HB3 ARG A 30 -0.311 -9.952 0.713 1.00 0.00 H new ATOM 0 HG2 ARG A 30 0.586 -12.186 0.123 1.00 0.00 H new ATOM 0 HG3 ARG A 30 2.079 -11.446 -0.420 1.00 0.00 H new ATOM 0 HD2 ARG A 30 2.408 -10.507 1.849 1.00 0.00 H new ATOM 0 HD3 ARG A 30 0.949 -11.322 2.377 1.00 0.00 H new ATOM 0 HE ARG A 30 2.672 -13.241 1.155 1.00 0.00 H new ATOM 0 HH11 ARG A 30 2.442 -11.228 4.039 1.00 0.00 H new ATOM 0 HH12 ARG A 30 3.388 -12.336 5.038 1.00 0.00 H new ATOM 0 HH21 ARG A 30 3.888 -14.659 2.447 1.00 0.00 H new ATOM 0 HH22 ARG A 30 4.204 -14.271 4.142 1.00 0.00 H new ATOM 490 N ASP A 31 -0.429 -7.588 -1.931 1.00 0.00 N ATOM 491 CA ASP A 31 -1.223 -6.384 -2.145 1.00 0.00 C ATOM 492 C ASP A 31 -1.412 -6.104 -3.630 1.00 0.00 C ATOM 493 O ASP A 31 -1.331 -4.958 -4.071 1.00 0.00 O ATOM 494 CB ASP A 31 -0.561 -5.178 -1.473 1.00 0.00 C ATOM 495 CG ASP A 31 -0.631 -5.235 0.047 1.00 0.00 C ATOM 496 OD1 ASP A 31 -1.600 -5.744 0.559 1.00 0.00 O ATOM 497 OD2 ASP A 31 0.285 -4.769 0.682 1.00 0.00 O ATOM 0 H ASP A 31 0.561 -7.485 -2.155 1.00 0.00 H new ATOM 0 HA ASP A 31 -2.203 -6.551 -1.698 1.00 0.00 H new ATOM 0 HB2 ASP A 31 0.483 -5.124 -1.782 1.00 0.00 H new ATOM 0 HB3 ASP A 31 -1.044 -4.265 -1.820 1.00 0.00 H new ATOM 502 N ALA A 32 -1.663 -7.159 -4.398 1.00 0.00 N ATOM 503 CA ALA A 32 -1.711 -7.054 -5.852 1.00 0.00 C ATOM 504 C ALA A 32 -2.824 -6.116 -6.300 1.00 0.00 C ATOM 505 O ALA A 32 -2.619 -5.261 -7.162 1.00 0.00 O ATOM 506 CB ALA A 32 -1.896 -8.430 -6.476 1.00 0.00 C ATOM 0 H ALA A 32 -1.836 -8.097 -4.037 1.00 0.00 H new ATOM 0 HA ALA A 32 -0.763 -6.637 -6.191 1.00 0.00 H new ATOM 0 HB1 ALA A 32 -1.930 -8.336 -7.561 1.00 0.00 H new ATOM 0 HB2 ALA A 32 -1.062 -9.073 -6.194 1.00 0.00 H new ATOM 0 HB3 ALA A 32 -2.829 -8.868 -6.121 1.00 0.00 H new ATOM 512 N PRO A 33 -4.003 -6.280 -5.710 1.00 0.00 N ATOM 513 CA PRO A 33 -5.166 -5.486 -6.088 1.00 0.00 C ATOM 514 C PRO A 33 -5.118 -4.102 -5.453 1.00 0.00 C ATOM 515 O PRO A 33 -5.866 -3.204 -5.841 1.00 0.00 O ATOM 516 CB PRO A 33 -6.338 -6.313 -5.551 1.00 0.00 C ATOM 517 CG PRO A 33 -5.798 -6.955 -4.319 1.00 0.00 C ATOM 518 CD PRO A 33 -4.388 -7.338 -4.683 1.00 0.00 C ATOM 0 HA PRO A 33 -5.233 -5.302 -7.160 1.00 0.00 H new ATOM 0 HB2 PRO A 33 -7.200 -5.684 -5.327 1.00 0.00 H new ATOM 0 HB3 PRO A 33 -6.666 -7.057 -6.277 1.00 0.00 H new ATOM 0 HG2 PRO A 33 -5.817 -6.269 -3.472 1.00 0.00 H new ATOM 0 HG3 PRO A 33 -6.386 -7.828 -4.035 1.00 0.00 H new ATOM 0 HD2 PRO A 33 -3.727 -7.319 -3.816 1.00 0.00 H new ATOM 0 HD3 PRO A 33 -4.337 -8.344 -5.100 1.00 0.00 H new ATOM 526 N LYS A 34 -4.235 -3.936 -4.474 1.00 0.00 N ATOM 527 CA LYS A 34 -3.968 -2.623 -3.898 1.00 0.00 C ATOM 528 C LYS A 34 -2.954 -1.851 -4.733 1.00 0.00 C ATOM 529 O LYS A 34 -3.017 -0.625 -4.827 1.00 0.00 O ATOM 530 CB LYS A 34 -3.468 -2.762 -2.459 1.00 0.00 C ATOM 531 CG LYS A 34 -4.443 -3.456 -1.519 1.00 0.00 C ATOM 532 CD LYS A 34 -5.750 -2.685 -1.410 1.00 0.00 C ATOM 533 CE LYS A 34 -5.580 -1.422 -0.579 1.00 0.00 C ATOM 534 NZ LYS A 34 -6.868 -0.697 -0.398 1.00 0.00 N ATOM 0 H LYS A 34 -3.692 -4.695 -4.063 1.00 0.00 H new ATOM 0 HA LYS A 34 -4.903 -2.063 -3.895 1.00 0.00 H new ATOM 0 HB2 LYS A 34 -2.530 -3.318 -2.465 1.00 0.00 H new ATOM 0 HB3 LYS A 34 -3.248 -1.769 -2.066 1.00 0.00 H new ATOM 0 HG2 LYS A 34 -4.643 -4.465 -1.879 1.00 0.00 H new ATOM 0 HG3 LYS A 34 -3.992 -3.553 -0.531 1.00 0.00 H new ATOM 0 HD2 LYS A 34 -6.104 -2.422 -2.407 1.00 0.00 H new ATOM 0 HD3 LYS A 34 -6.512 -3.320 -0.959 1.00 0.00 H new ATOM 0 HE2 LYS A 34 -5.170 -1.682 0.397 1.00 0.00 H new ATOM 0 HE3 LYS A 34 -4.858 -0.764 -1.063 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 -6.759 0.024 0.344 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 -7.136 -0.237 -1.291 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 -7.610 -1.371 -0.120 1.00 0.00 H new ATOM 548 N VAL A 35 -2.019 -2.576 -5.338 1.00 0.00 N ATOM 549 CA VAL A 35 -1.145 -2.004 -6.356 1.00 0.00 C ATOM 550 C VAL A 35 -1.947 -1.496 -7.548 1.00 0.00 C ATOM 551 O VAL A 35 -1.705 -0.398 -8.048 1.00 0.00 O ATOM 552 CB VAL A 35 -0.125 -3.053 -6.836 1.00 0.00 C ATOM 553 CG1 VAL A 35 0.563 -2.584 -8.109 1.00 0.00 C ATOM 554 CG2 VAL A 35 0.895 -3.323 -5.740 1.00 0.00 C ATOM 0 H VAL A 35 -1.847 -3.562 -5.141 1.00 0.00 H new ATOM 0 HA VAL A 35 -0.618 -1.163 -5.906 1.00 0.00 H new ATOM 0 HB VAL A 35 -0.651 -3.981 -7.059 1.00 0.00 H new ATOM 0 HG11 VAL A 35 1.280 -3.338 -8.434 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -0.182 -2.432 -8.890 1.00 0.00 H new ATOM 0 HG13 VAL A 35 1.084 -1.646 -7.917 1.00 0.00 H new ATOM 0 HG21 VAL A 35 1.613 -4.066 -6.087 1.00 0.00 H new ATOM 0 HG22 VAL A 35 1.418 -2.399 -5.495 1.00 0.00 H new ATOM 0 HG23 VAL A 35 0.385 -3.698 -4.853 1.00 0.00 H new ATOM 564 N ALA A 36 -2.901 -2.303 -7.999 1.00 0.00 N ATOM 565 CA ALA A 36 -3.789 -1.907 -9.085 1.00 0.00 C ATOM 566 C ALA A 36 -4.623 -0.692 -8.699 1.00 0.00 C ATOM 567 O ALA A 36 -4.834 0.211 -9.509 1.00 0.00 O ATOM 568 CB ALA A 36 -4.694 -3.065 -9.480 1.00 0.00 C ATOM 0 H ALA A 36 -3.079 -3.237 -7.629 1.00 0.00 H new ATOM 0 HA ALA A 36 -3.172 -1.635 -9.941 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -5.351 -2.753 -10.292 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -4.085 -3.907 -9.809 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -5.295 -3.366 -8.622 1.00 0.00 H new ATOM 574 N GLU A 37 -5.094 -0.674 -7.457 1.00 0.00 N ATOM 575 CA GLU A 37 -5.823 0.473 -6.930 1.00 0.00 C ATOM 576 C GLU A 37 -4.958 1.727 -6.940 1.00 0.00 C ATOM 577 O GLU A 37 -5.384 2.783 -7.407 1.00 0.00 O ATOM 578 CB GLU A 37 -6.309 0.188 -5.507 1.00 0.00 C ATOM 579 CG GLU A 37 -7.098 1.325 -4.873 1.00 0.00 C ATOM 580 CD GLU A 37 -7.571 1.005 -3.483 1.00 0.00 C ATOM 581 OE1 GLU A 37 -7.381 -0.108 -3.052 1.00 0.00 O ATOM 582 OE2 GLU A 37 -8.125 1.873 -2.850 1.00 0.00 O ATOM 0 H GLU A 37 -4.984 -1.442 -6.795 1.00 0.00 H new ATOM 0 HA GLU A 37 -6.685 0.645 -7.575 1.00 0.00 H new ATOM 0 HB2 GLU A 37 -6.932 -0.707 -5.521 1.00 0.00 H new ATOM 0 HB3 GLU A 37 -5.446 -0.034 -4.879 1.00 0.00 H new ATOM 0 HG2 GLU A 37 -6.476 2.219 -4.843 1.00 0.00 H new ATOM 0 HG3 GLU A 37 -7.959 1.557 -5.500 1.00 0.00 H new ATOM 589 N MET A 38 -3.741 1.604 -6.422 1.00 0.00 N ATOM 590 CA MET A 38 -2.793 2.712 -6.421 1.00 0.00 C ATOM 591 C MET A 38 -2.510 3.196 -7.837 1.00 0.00 C ATOM 592 O MET A 38 -2.477 4.399 -8.097 1.00 0.00 O ATOM 593 CB MET A 38 -1.495 2.296 -5.730 1.00 0.00 C ATOM 594 CG MET A 38 -1.611 2.127 -4.222 1.00 0.00 C ATOM 595 SD MET A 38 -0.138 1.385 -3.491 1.00 0.00 S ATOM 596 CE MET A 38 1.062 2.689 -3.749 1.00 0.00 C ATOM 0 H MET A 38 -3.387 0.747 -5.997 1.00 0.00 H new ATOM 0 HA MET A 38 -3.239 3.539 -5.868 1.00 0.00 H new ATOM 0 HB2 MET A 38 -1.152 1.356 -6.163 1.00 0.00 H new ATOM 0 HB3 MET A 38 -0.730 3.043 -5.942 1.00 0.00 H new ATOM 0 HG2 MET A 38 -1.789 3.100 -3.764 1.00 0.00 H new ATOM 0 HG3 MET A 38 -2.477 1.505 -3.995 1.00 0.00 H new ATOM 0 HE1 MET A 38 1.974 2.459 -3.198 1.00 0.00 H new ATOM 0 HE2 MET A 38 1.291 2.768 -4.812 1.00 0.00 H new ATOM 0 HE3 MET A 38 0.653 3.635 -3.395 1.00 0.00 H new ATOM 606 N TRP A 39 -2.306 2.252 -8.750 1.00 0.00 N ATOM 607 CA TRP A 39 -2.071 2.580 -10.151 1.00 0.00 C ATOM 608 C TRP A 39 -3.261 3.318 -10.751 1.00 0.00 C ATOM 609 O TRP A 39 -3.095 4.320 -11.446 1.00 0.00 O ATOM 610 CB TRP A 39 -1.795 1.309 -10.957 1.00 0.00 C ATOM 611 CG TRP A 39 -1.541 1.566 -12.411 1.00 0.00 C ATOM 612 CD1 TRP A 39 -0.375 1.994 -12.972 1.00 0.00 C ATOM 613 CD2 TRP A 39 -2.478 1.411 -13.504 1.00 0.00 C ATOM 614 NE1 TRP A 39 -0.521 2.117 -14.332 1.00 0.00 N ATOM 615 CE2 TRP A 39 -1.801 1.763 -14.675 1.00 0.00 C ATOM 616 CE3 TRP A 39 -3.817 1.007 -13.582 1.00 0.00 C ATOM 617 CZ2 TRP A 39 -2.416 1.727 -15.917 1.00 0.00 C ATOM 618 CZ3 TRP A 39 -4.433 0.970 -14.827 1.00 0.00 C ATOM 619 CH2 TRP A 39 -3.749 1.320 -15.964 1.00 0.00 C ATOM 0 H TRP A 39 -2.299 1.253 -8.544 1.00 0.00 H new ATOM 0 HA TRP A 39 -1.200 3.233 -10.197 1.00 0.00 H new ATOM 0 HB2 TRP A 39 -0.932 0.798 -10.530 1.00 0.00 H new ATOM 0 HB3 TRP A 39 -2.645 0.634 -10.859 1.00 0.00 H new ATOM 0 HD1 TRP A 39 0.532 2.206 -12.426 1.00 0.00 H new ATOM 0 HE1 TRP A 39 0.204 2.422 -14.981 1.00 0.00 H new ATOM 0 HE3 TRP A 39 -4.361 0.729 -12.691 1.00 0.00 H new ATOM 0 HZ2 TRP A 39 -1.883 2.004 -16.814 1.00 0.00 H new ATOM 0 HZ3 TRP A 39 -5.465 0.661 -14.901 1.00 0.00 H new ATOM 0 HH2 TRP A 39 -4.255 1.279 -16.917 1.00 0.00 H new ATOM 630 N LYS A 40 -4.460 2.816 -10.478 1.00 0.00 N ATOM 631 CA LYS A 40 -5.683 3.451 -10.956 1.00 0.00 C ATOM 632 C LYS A 40 -5.747 4.913 -10.530 1.00 0.00 C ATOM 633 O LYS A 40 -5.915 5.804 -11.362 1.00 0.00 O ATOM 634 CB LYS A 40 -6.912 2.700 -10.442 1.00 0.00 C ATOM 635 CG LYS A 40 -8.243 3.299 -10.878 1.00 0.00 C ATOM 636 CD LYS A 40 -9.411 2.427 -10.443 1.00 0.00 C ATOM 637 CE LYS A 40 -10.740 3.014 -10.895 1.00 0.00 C ATOM 638 NZ LYS A 40 -11.889 2.149 -10.513 1.00 0.00 N ATOM 0 H LYS A 40 -4.612 1.971 -9.928 1.00 0.00 H new ATOM 0 HA LYS A 40 -5.675 3.413 -12.045 1.00 0.00 H new ATOM 0 HB2 LYS A 40 -6.862 1.667 -10.787 1.00 0.00 H new ATOM 0 HB3 LYS A 40 -6.878 2.675 -9.353 1.00 0.00 H new ATOM 0 HG2 LYS A 40 -8.352 4.296 -10.452 1.00 0.00 H new ATOM 0 HG3 LYS A 40 -8.255 3.413 -11.962 1.00 0.00 H new ATOM 0 HD2 LYS A 40 -9.294 1.426 -10.858 1.00 0.00 H new ATOM 0 HD3 LYS A 40 -9.407 2.325 -9.358 1.00 0.00 H new ATOM 0 HE2 LYS A 40 -10.868 4.003 -10.455 1.00 0.00 H new ATOM 0 HE3 LYS A 40 -10.729 3.146 -11.977 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 -12.448 1.920 -11.360 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 -11.535 1.270 -10.084 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 -12.489 2.651 -9.828 1.00 0.00 H new ATOM 652 N GLU A 41 -5.611 5.152 -9.231 1.00 0.00 N ATOM 653 CA GLU A 41 -5.654 6.506 -8.692 1.00 0.00 C ATOM 654 C GLU A 41 -4.514 7.354 -9.242 1.00 0.00 C ATOM 655 O GLU A 41 -4.707 8.517 -9.595 1.00 0.00 O ATOM 656 CB GLU A 41 -5.588 6.475 -7.164 1.00 0.00 C ATOM 657 CG GLU A 41 -6.843 5.936 -6.491 1.00 0.00 C ATOM 658 CD GLU A 41 -8.018 6.865 -6.616 1.00 0.00 C ATOM 659 OE1 GLU A 41 -7.902 7.997 -6.213 1.00 0.00 O ATOM 660 OE2 GLU A 41 -9.034 6.441 -7.114 1.00 0.00 O ATOM 0 H GLU A 41 -5.470 4.424 -8.530 1.00 0.00 H new ATOM 0 HA GLU A 41 -6.597 6.957 -9.000 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -4.737 5.864 -6.862 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -5.401 7.485 -6.800 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -7.100 4.972 -6.931 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -6.636 5.760 -5.435 1.00 0.00 H new ATOM 667 N TYR A 42 -3.325 6.765 -9.311 1.00 0.00 N ATOM 668 CA TYR A 42 -2.157 7.457 -9.842 1.00 0.00 C ATOM 669 C TYR A 42 -2.416 7.976 -11.250 1.00 0.00 C ATOM 670 O TYR A 42 -2.056 9.106 -11.582 1.00 0.00 O ATOM 671 CB TYR A 42 -0.937 6.532 -9.834 1.00 0.00 C ATOM 672 CG TYR A 42 0.325 7.182 -10.356 1.00 0.00 C ATOM 673 CD1 TYR A 42 1.074 8.006 -9.529 1.00 0.00 C ATOM 674 CD2 TYR A 42 0.733 6.954 -11.662 1.00 0.00 C ATOM 675 CE1 TYR A 42 2.227 8.599 -10.006 1.00 0.00 C ATOM 676 CE2 TYR A 42 1.886 7.547 -12.138 1.00 0.00 C ATOM 677 CZ TYR A 42 2.631 8.367 -11.316 1.00 0.00 C ATOM 678 OH TYR A 42 3.780 8.958 -11.790 1.00 0.00 O ATOM 0 H TYR A 42 -3.145 5.809 -9.005 1.00 0.00 H new ATOM 0 HA TYR A 42 -1.955 8.313 -9.198 1.00 0.00 H new ATOM 0 HB2 TYR A 42 -0.762 6.186 -8.815 1.00 0.00 H new ATOM 0 HB3 TYR A 42 -1.157 5.651 -10.437 1.00 0.00 H new ATOM 0 HD1 TYR A 42 0.756 8.184 -8.512 1.00 0.00 H new ATOM 0 HD2 TYR A 42 0.149 6.313 -12.306 1.00 0.00 H new ATOM 0 HE1 TYR A 42 2.812 9.240 -9.364 1.00 0.00 H new ATOM 0 HE2 TYR A 42 2.205 7.369 -13.154 1.00 0.00 H new ATOM 0 HH TYR A 42 3.770 8.953 -12.770 1.00 0.00 H new ATOM 688 N MET A 43 -3.044 7.146 -12.075 1.00 0.00 N ATOM 689 CA MET A 43 -3.216 7.455 -13.490 1.00 0.00 C ATOM 690 C MET A 43 -4.338 8.463 -13.701 1.00 0.00 C ATOM 691 O MET A 43 -4.310 9.249 -14.648 1.00 0.00 O ATOM 692 CB MET A 43 -3.490 6.177 -14.280 1.00 0.00 C ATOM 693 CG MET A 43 -2.297 5.240 -14.396 1.00 0.00 C ATOM 694 SD MET A 43 -0.882 6.012 -15.207 1.00 0.00 S ATOM 695 CE MET A 43 -1.526 6.244 -16.861 1.00 0.00 C ATOM 0 H MET A 43 -3.443 6.252 -11.788 1.00 0.00 H new ATOM 0 HA MET A 43 -2.291 7.903 -13.854 1.00 0.00 H new ATOM 0 HB2 MET A 43 -4.312 5.641 -13.806 1.00 0.00 H new ATOM 0 HB3 MET A 43 -3.822 6.448 -15.282 1.00 0.00 H new ATOM 0 HG2 MET A 43 -2.003 4.907 -13.400 1.00 0.00 H new ATOM 0 HG3 MET A 43 -2.591 4.352 -14.955 1.00 0.00 H new ATOM 0 HE1 MET A 43 -0.748 6.664 -17.499 1.00 0.00 H new ATOM 0 HE2 MET A 43 -1.847 5.284 -17.265 1.00 0.00 H new ATOM 0 HE3 MET A 43 -2.376 6.926 -16.828 1.00 0.00 H new ATOM 705 N LEU A 44 -5.327 8.434 -12.813 1.00 0.00 N ATOM 706 CA LEU A 44 -6.571 9.164 -13.028 1.00 0.00 C ATOM 707 C LEU A 44 -6.542 10.518 -12.332 1.00 0.00 C ATOM 708 O LEU A 44 -7.112 11.492 -12.824 1.00 0.00 O ATOM 709 CB LEU A 44 -7.761 8.343 -12.516 1.00 0.00 C ATOM 710 CG LEU A 44 -8.026 7.024 -13.252 1.00 0.00 C ATOM 711 CD1 LEU A 44 -9.233 6.330 -12.635 1.00 0.00 C ATOM 712 CD2 LEU A 44 -8.253 7.304 -14.730 1.00 0.00 C ATOM 0 H LEU A 44 -5.291 7.912 -11.937 1.00 0.00 H new ATOM 0 HA LEU A 44 -6.681 9.331 -14.099 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -7.599 8.123 -11.461 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -8.658 8.959 -12.579 1.00 0.00 H new ATOM 0 HG LEU A 44 -7.164 6.364 -13.155 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -9.421 5.393 -13.159 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -9.036 6.125 -11.583 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -10.107 6.975 -12.721 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -8.441 6.367 -15.253 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -9.112 7.964 -14.847 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -7.368 7.782 -15.150 1.00 0.00 H new ATOM 724 N ARG A 45 -5.876 10.574 -11.184 1.00 0.00 N ATOM 725 CA ARG A 45 -5.806 11.799 -10.397 1.00 0.00 C ATOM 726 C ARG A 45 -5.105 12.910 -11.168 1.00 0.00 C ATOM 727 O ARG A 45 -4.043 12.697 -11.754 1.00 0.00 O ATOM 728 CB ARG A 45 -5.071 11.553 -9.087 1.00 0.00 C ATOM 729 CG ARG A 45 -5.871 10.801 -8.036 1.00 0.00 C ATOM 730 CD ARG A 45 -5.092 10.611 -6.785 1.00 0.00 C ATOM 731 NE ARG A 45 -5.807 9.789 -5.822 1.00 0.00 N ATOM 732 CZ ARG A 45 -5.429 9.609 -4.541 1.00 0.00 C ATOM 733 NH1 ARG A 45 -4.346 10.199 -4.086 1.00 0.00 N ATOM 734 NH2 ARG A 45 -6.148 8.841 -3.742 1.00 0.00 N ATOM 0 H ARG A 45 -5.376 9.783 -10.777 1.00 0.00 H new ATOM 0 HA ARG A 45 -6.829 12.111 -10.185 1.00 0.00 H new ATOM 0 HB2 ARG A 45 -4.160 10.994 -9.298 1.00 0.00 H new ATOM 0 HB3 ARG A 45 -4.766 12.514 -8.672 1.00 0.00 H new ATOM 0 HG2 ARG A 45 -6.787 11.349 -7.815 1.00 0.00 H new ATOM 0 HG3 ARG A 45 -6.168 9.829 -8.431 1.00 0.00 H new ATOM 0 HD2 ARG A 45 -4.135 10.145 -7.020 1.00 0.00 H new ATOM 0 HD3 ARG A 45 -4.874 11.583 -6.342 1.00 0.00 H new ATOM 0 HE ARG A 45 -6.654 9.316 -6.138 1.00 0.00 H new ATOM 0 HH11 ARG A 45 -3.792 10.793 -4.703 1.00 0.00 H new ATOM 0 HH12 ARG A 45 -4.060 10.063 -3.116 1.00 0.00 H new ATOM 0 HH21 ARG A 45 -6.989 8.384 -4.095 1.00 0.00 H new ATOM 0 HH22 ARG A 45 -5.862 8.705 -2.772 1.00 0.00 H new ATOM 748 N PRO A 46 -5.705 14.095 -11.165 1.00 0.00 N ATOM 749 CA PRO A 46 -5.170 15.227 -11.913 1.00 0.00 C ATOM 750 C PRO A 46 -3.946 15.815 -11.221 1.00 0.00 C ATOM 751 O PRO A 46 -3.228 16.631 -11.798 1.00 0.00 O ATOM 752 CB PRO A 46 -6.341 16.215 -11.926 1.00 0.00 C ATOM 753 CG PRO A 46 -7.093 15.908 -10.677 1.00 0.00 C ATOM 754 CD PRO A 46 -7.009 14.410 -10.547 1.00 0.00 C ATOM 0 HA PRO A 46 -4.828 14.961 -12.913 1.00 0.00 H new ATOM 0 HB2 PRO A 46 -5.991 17.247 -11.936 1.00 0.00 H new ATOM 0 HB3 PRO A 46 -6.965 16.081 -12.810 1.00 0.00 H new ATOM 0 HG2 PRO A 46 -6.651 16.407 -9.814 1.00 0.00 H new ATOM 0 HG3 PRO A 46 -8.128 16.244 -10.744 1.00 0.00 H new ATOM 0 HD2 PRO A 46 -7.049 14.093 -9.505 1.00 0.00 H new ATOM 0 HD3 PRO A 46 -7.831 13.913 -11.063 1.00 0.00 H new ATOM 762 N SER A 47 -3.714 15.395 -9.983 1.00 0.00 N ATOM 763 CA SER A 47 -2.532 15.816 -9.240 1.00 0.00 C ATOM 764 C SER A 47 -1.262 15.246 -9.857 1.00 0.00 C ATOM 765 O SER A 47 -0.162 15.735 -9.600 1.00 0.00 O ATOM 766 CB SER A 47 -2.642 15.378 -7.792 1.00 0.00 C ATOM 767 OG SER A 47 -2.562 13.983 -7.682 1.00 0.00 O ATOM 0 H SER A 47 -4.330 14.762 -9.472 1.00 0.00 H new ATOM 0 HA SER A 47 -2.476 16.904 -9.286 1.00 0.00 H new ATOM 0 HB2 SER A 47 -1.846 15.839 -7.207 1.00 0.00 H new ATOM 0 HB3 SER A 47 -3.587 15.726 -7.374 1.00 0.00 H new ATOM 0 HG SER A 47 -2.634 13.725 -6.739 1.00 0.00 H new ATOM 773 N VAL A 48 -1.420 14.210 -10.674 1.00 0.00 N ATOM 774 CA VAL A 48 -0.290 13.599 -11.365 1.00 0.00 C ATOM 775 C VAL A 48 -0.149 14.147 -12.779 1.00 0.00 C ATOM 776 O VAL A 48 -1.116 14.188 -13.539 1.00 0.00 O ATOM 777 CB VAL A 48 -0.464 12.070 -11.425 1.00 0.00 C ATOM 778 CG1 VAL A 48 0.685 11.434 -12.194 1.00 0.00 C ATOM 779 CG2 VAL A 48 -0.548 11.503 -10.016 1.00 0.00 C ATOM 0 H VAL A 48 -2.321 13.775 -10.874 1.00 0.00 H new ATOM 0 HA VAL A 48 0.613 13.842 -10.805 1.00 0.00 H new ATOM 0 HB VAL A 48 -1.391 11.839 -11.950 1.00 0.00 H new ATOM 0 HG11 VAL A 48 0.547 10.353 -12.227 1.00 0.00 H new ATOM 0 HG12 VAL A 48 0.705 11.828 -13.210 1.00 0.00 H new ATOM 0 HG13 VAL A 48 1.627 11.664 -11.697 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -0.671 10.421 -10.066 1.00 0.00 H new ATOM 0 HG22 VAL A 48 0.367 11.739 -9.473 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -1.401 11.942 -9.498 1.00 0.00 H new ATOM 789 N ASN A 49 1.063 14.568 -13.127 1.00 0.00 N ATOM 790 CA ASN A 49 1.338 15.094 -14.458 1.00 0.00 C ATOM 791 C ASN A 49 1.174 14.016 -15.522 1.00 0.00 C ATOM 792 O ASN A 49 1.421 12.837 -15.268 1.00 0.00 O ATOM 793 CB ASN A 49 2.731 15.694 -14.518 1.00 0.00 C ATOM 794 CG ASN A 49 2.949 16.528 -15.749 1.00 0.00 C ATOM 795 OD1 ASN A 49 3.080 15.997 -16.858 1.00 0.00 O ATOM 796 ND2 ASN A 49 2.990 17.825 -15.577 1.00 0.00 N ATOM 0 H ASN A 49 1.871 14.555 -12.504 1.00 0.00 H new ATOM 0 HA ASN A 49 0.612 15.881 -14.663 1.00 0.00 H new ATOM 0 HB2 ASN A 49 2.896 16.309 -13.633 1.00 0.00 H new ATOM 0 HB3 ASN A 49 3.469 14.892 -14.491 1.00 0.00 H new ATOM 0 HD21 ASN A 49 3.135 18.441 -16.377 1.00 0.00 H new ATOM 0 HD22 ASN A 49 2.877 18.219 -14.643 1.00 0.00 H new ATOM 803 N THR A 50 0.754 14.427 -16.713 1.00 0.00 N ATOM 804 CA THR A 50 0.481 13.489 -17.795 1.00 0.00 C ATOM 805 C THR A 50 1.753 12.778 -18.242 1.00 0.00 C ATOM 806 O THR A 50 1.706 11.649 -18.730 1.00 0.00 O ATOM 807 CB THR A 50 -0.163 14.202 -18.999 1.00 0.00 C ATOM 808 OG1 THR A 50 0.713 15.234 -19.470 1.00 0.00 O ATOM 809 CG2 THR A 50 -1.497 14.815 -18.604 1.00 0.00 C ATOM 0 H THR A 50 0.595 15.405 -16.954 1.00 0.00 H new ATOM 0 HA THR A 50 -0.219 12.747 -17.409 1.00 0.00 H new ATOM 0 HB THR A 50 -0.331 13.470 -19.789 1.00 0.00 H new ATOM 0 HG1 THR A 50 0.303 15.686 -20.237 1.00 0.00 H new ATOM 0 HG21 THR A 50 -1.938 15.315 -19.467 1.00 0.00 H new ATOM 0 HG22 THR A 50 -2.169 14.031 -18.256 1.00 0.00 H new ATOM 0 HG23 THR A 50 -1.342 15.540 -17.805 1.00 0.00 H new ATOM 817 N ARG A 51 2.888 13.446 -18.071 1.00 0.00 N ATOM 818 CA ARG A 51 4.187 12.813 -18.267 1.00 0.00 C ATOM 819 C ARG A 51 4.450 11.756 -17.202 1.00 0.00 C ATOM 820 O ARG A 51 4.999 10.693 -17.491 1.00 0.00 O ATOM 821 CB ARG A 51 5.299 13.850 -18.234 1.00 0.00 C ATOM 822 CG ARG A 51 6.684 13.314 -18.559 1.00 0.00 C ATOM 823 CD ARG A 51 7.718 14.377 -18.480 1.00 0.00 C ATOM 824 NE ARG A 51 9.034 13.883 -18.853 1.00 0.00 N ATOM 825 CZ ARG A 51 9.520 13.874 -20.110 1.00 0.00 C ATOM 826 NH1 ARG A 51 8.788 14.334 -21.100 1.00 0.00 N ATOM 827 NH2 ARG A 51 10.731 13.403 -20.346 1.00 0.00 N ATOM 0 H ARG A 51 2.935 14.427 -17.797 1.00 0.00 H new ATOM 0 HA ARG A 51 4.172 12.331 -19.244 1.00 0.00 H new ATOM 0 HB2 ARG A 51 5.057 14.643 -18.941 1.00 0.00 H new ATOM 0 HB3 ARG A 51 5.324 14.303 -17.243 1.00 0.00 H new ATOM 0 HG2 ARG A 51 6.935 12.511 -17.866 1.00 0.00 H new ATOM 0 HG3 ARG A 51 6.681 12.883 -19.560 1.00 0.00 H new ATOM 0 HD2 ARG A 51 7.441 15.202 -19.136 1.00 0.00 H new ATOM 0 HD3 ARG A 51 7.754 14.774 -17.466 1.00 0.00 H new ATOM 0 HE ARG A 51 9.631 13.518 -18.111 1.00 0.00 H new ATOM 0 HH11 ARG A 51 7.853 14.698 -20.917 1.00 0.00 H new ATOM 0 HH12 ARG A 51 9.155 14.328 -22.052 1.00 0.00 H new ATOM 0 HH21 ARG A 51 11.298 13.046 -19.577 1.00 0.00 H new ATOM 0 HH22 ARG A 51 11.099 13.396 -21.297 1.00 0.00 H new ATOM 841 N ARG A 52 4.056 12.055 -15.969 1.00 0.00 N ATOM 842 CA ARG A 52 4.200 11.110 -14.868 1.00 0.00 C ATOM 843 C ARG A 52 3.210 9.960 -14.996 1.00 0.00 C ATOM 844 O ARG A 52 3.466 8.852 -14.524 1.00 0.00 O ATOM 845 CB ARG A 52 3.991 11.808 -13.532 1.00 0.00 C ATOM 846 CG ARG A 52 5.098 12.773 -13.135 1.00 0.00 C ATOM 847 CD ARG A 52 4.815 13.425 -11.831 1.00 0.00 C ATOM 848 NE ARG A 52 5.874 14.343 -11.443 1.00 0.00 N ATOM 849 CZ ARG A 52 5.836 15.140 -10.357 1.00 0.00 C ATOM 850 NH1 ARG A 52 4.789 15.119 -9.563 1.00 0.00 N ATOM 851 NH2 ARG A 52 6.852 15.941 -10.090 1.00 0.00 N ATOM 0 H ARG A 52 3.634 12.946 -15.707 1.00 0.00 H new ATOM 0 HA ARG A 52 5.212 10.708 -14.912 1.00 0.00 H new ATOM 0 HB2 ARG A 52 3.048 12.354 -13.567 1.00 0.00 H new ATOM 0 HB3 ARG A 52 3.892 11.051 -12.754 1.00 0.00 H new ATOM 0 HG2 ARG A 52 6.045 12.236 -13.076 1.00 0.00 H new ATOM 0 HG3 ARG A 52 5.211 13.535 -13.906 1.00 0.00 H new ATOM 0 HD2 ARG A 52 3.870 13.966 -11.893 1.00 0.00 H new ATOM 0 HD3 ARG A 52 4.696 12.662 -11.062 1.00 0.00 H new ATOM 0 HE ARG A 52 6.704 14.387 -12.034 1.00 0.00 H new ATOM 0 HH11 ARG A 52 4.005 14.499 -9.769 1.00 0.00 H new ATOM 0 HH12 ARG A 52 4.760 15.722 -8.741 1.00 0.00 H new ATOM 0 HH21 ARG A 52 7.665 15.956 -10.706 1.00 0.00 H new ATOM 0 HH22 ARG A 52 6.823 16.544 -9.268 1.00 0.00 H new ATOM 865 N LYS A 53 2.079 10.228 -15.639 1.00 0.00 N ATOM 866 CA LYS A 53 1.114 9.184 -15.960 1.00 0.00 C ATOM 867 C LYS A 53 1.697 8.179 -16.946 1.00 0.00 C ATOM 868 O LYS A 53 1.503 6.972 -16.805 1.00 0.00 O ATOM 869 CB LYS A 53 -0.168 9.795 -16.529 1.00 0.00 C ATOM 870 CG LYS A 53 -1.009 10.553 -15.510 1.00 0.00 C ATOM 871 CD LYS A 53 -2.258 11.138 -16.150 1.00 0.00 C ATOM 872 CE LYS A 53 -3.041 11.989 -15.161 1.00 0.00 C ATOM 873 NZ LYS A 53 -4.251 12.593 -15.783 1.00 0.00 N ATOM 0 H LYS A 53 1.808 11.161 -15.949 1.00 0.00 H new ATOM 0 HA LYS A 53 0.875 8.657 -15.037 1.00 0.00 H new ATOM 0 HB2 LYS A 53 0.096 10.473 -17.341 1.00 0.00 H new ATOM 0 HB3 LYS A 53 -0.774 8.999 -16.963 1.00 0.00 H new ATOM 0 HG2 LYS A 53 -1.293 9.882 -14.699 1.00 0.00 H new ATOM 0 HG3 LYS A 53 -0.415 11.353 -15.068 1.00 0.00 H new ATOM 0 HD2 LYS A 53 -1.978 11.744 -17.012 1.00 0.00 H new ATOM 0 HD3 LYS A 53 -2.891 10.332 -16.520 1.00 0.00 H new ATOM 0 HE2 LYS A 53 -3.338 11.376 -14.310 1.00 0.00 H new ATOM 0 HE3 LYS A 53 -2.398 12.780 -14.775 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 -4.836 13.037 -15.046 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 -3.963 13.313 -16.476 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 -4.802 11.852 -16.262 1.00 0.00 H new ATOM 887 N LEU A 54 2.412 8.686 -17.945 1.00 0.00 N ATOM 888 CA LEU A 54 3.148 7.832 -18.870 1.00 0.00 C ATOM 889 C LEU A 54 4.132 6.937 -18.129 1.00 0.00 C ATOM 890 O LEU A 54 4.278 5.758 -18.452 1.00 0.00 O ATOM 891 CB LEU A 54 3.899 8.687 -19.898 1.00 0.00 C ATOM 892 CG LEU A 54 4.704 7.912 -20.948 1.00 0.00 C ATOM 893 CD1 LEU A 54 3.767 7.016 -21.748 1.00 0.00 C ATOM 894 CD2 LEU A 54 5.431 8.892 -21.857 1.00 0.00 C ATOM 0 H LEU A 54 2.497 9.685 -18.135 1.00 0.00 H new ATOM 0 HA LEU A 54 2.427 7.197 -19.385 1.00 0.00 H new ATOM 0 HB2 LEU A 54 3.177 9.319 -20.415 1.00 0.00 H new ATOM 0 HB3 LEU A 54 4.578 9.351 -19.364 1.00 0.00 H new ATOM 0 HG LEU A 54 5.446 7.283 -20.457 1.00 0.00 H new ATOM 0 HD11 LEU A 54 4.339 6.465 -22.494 1.00 0.00 H new ATOM 0 HD12 LEU A 54 3.275 6.313 -21.076 1.00 0.00 H new ATOM 0 HD13 LEU A 54 3.015 7.628 -22.246 1.00 0.00 H new ATOM 0 HD21 LEU A 54 6.003 8.340 -22.603 1.00 0.00 H new ATOM 0 HD22 LEU A 54 4.704 9.532 -22.357 1.00 0.00 H new ATOM 0 HD23 LEU A 54 6.107 9.506 -21.263 1.00 0.00 H new ATOM 906 N LEU A 55 4.806 7.503 -17.134 1.00 0.00 N ATOM 907 CA LEU A 55 5.677 6.728 -16.259 1.00 0.00 C ATOM 908 C LEU A 55 4.893 5.656 -15.512 1.00 0.00 C ATOM 909 O LEU A 55 5.390 4.551 -15.291 1.00 0.00 O ATOM 910 CB LEU A 55 6.376 7.651 -15.254 1.00 0.00 C ATOM 911 CG LEU A 55 7.389 8.638 -15.849 1.00 0.00 C ATOM 912 CD1 LEU A 55 7.896 9.568 -14.756 1.00 0.00 C ATOM 913 CD2 LEU A 55 8.535 7.866 -16.486 1.00 0.00 C ATOM 0 H LEU A 55 4.765 8.498 -16.913 1.00 0.00 H new ATOM 0 HA LEU A 55 6.425 6.237 -16.881 1.00 0.00 H new ATOM 0 HB2 LEU A 55 5.614 8.219 -14.720 1.00 0.00 H new ATOM 0 HB3 LEU A 55 6.889 7.033 -14.517 1.00 0.00 H new ATOM 0 HG LEU A 55 6.911 9.243 -16.620 1.00 0.00 H new ATOM 0 HD11 LEU A 55 8.616 10.269 -15.179 1.00 0.00 H new ATOM 0 HD12 LEU A 55 7.058 10.121 -14.331 1.00 0.00 H new ATOM 0 HD13 LEU A 55 8.378 8.981 -13.974 1.00 0.00 H new ATOM 0 HD21 LEU A 55 9.255 8.567 -16.909 1.00 0.00 H new ATOM 0 HD22 LEU A 55 9.026 7.254 -15.730 1.00 0.00 H new ATOM 0 HD23 LEU A 55 8.146 7.224 -17.276 1.00 0.00 H new ATOM 925 N GLY A 56 3.666 5.988 -15.126 1.00 0.00 N ATOM 926 CA GLY A 56 2.777 5.025 -14.486 1.00 0.00 C ATOM 927 C GLY A 56 2.515 3.830 -15.394 1.00 0.00 C ATOM 928 O GLY A 56 2.484 2.687 -14.938 1.00 0.00 O ATOM 0 H GLY A 56 3.264 6.918 -15.245 1.00 0.00 H new ATOM 0 HA2 GLY A 56 3.219 4.684 -13.550 1.00 0.00 H new ATOM 0 HA3 GLY A 56 1.833 5.508 -14.235 1.00 0.00 H new ATOM 932 N LEU A 57 2.326 4.101 -16.681 1.00 0.00 N ATOM 933 CA LEU A 57 2.157 3.043 -17.670 1.00 0.00 C ATOM 934 C LEU A 57 3.394 2.157 -17.745 1.00 0.00 C ATOM 935 O LEU A 57 3.289 0.941 -17.902 1.00 0.00 O ATOM 936 CB LEU A 57 1.870 3.649 -19.050 1.00 0.00 C ATOM 937 CG LEU A 57 0.504 4.330 -19.206 1.00 0.00 C ATOM 938 CD1 LEU A 57 0.457 5.075 -20.533 1.00 0.00 C ATOM 939 CD2 LEU A 57 -0.597 3.284 -19.126 1.00 0.00 C ATOM 0 H LEU A 57 2.286 5.046 -17.064 1.00 0.00 H new ATOM 0 HA LEU A 57 1.312 2.428 -17.361 1.00 0.00 H new ATOM 0 HB2 LEU A 57 2.647 4.379 -19.275 1.00 0.00 H new ATOM 0 HB3 LEU A 57 1.949 2.859 -19.797 1.00 0.00 H new ATOM 0 HG LEU A 57 0.352 5.050 -18.402 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -0.513 5.559 -20.644 1.00 0.00 H new ATOM 0 HD12 LEU A 57 1.243 5.829 -20.555 1.00 0.00 H new ATOM 0 HD13 LEU A 57 0.607 4.371 -21.351 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -1.567 3.768 -19.237 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -0.463 2.553 -19.923 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -0.551 2.780 -18.160 1.00 0.00 H new ATOM 951 N TYR A 58 4.565 2.774 -17.632 1.00 0.00 N ATOM 952 CA TYR A 58 5.823 2.037 -17.641 1.00 0.00 C ATOM 953 C TYR A 58 5.952 1.151 -16.409 1.00 0.00 C ATOM 954 O TYR A 58 6.454 0.030 -16.488 1.00 0.00 O ATOM 955 CB TYR A 58 7.008 3.002 -17.727 1.00 0.00 C ATOM 956 CG TYR A 58 7.077 3.771 -19.028 1.00 0.00 C ATOM 957 CD1 TYR A 58 6.413 3.297 -20.150 1.00 0.00 C ATOM 958 CD2 TYR A 58 7.804 4.950 -19.099 1.00 0.00 C ATOM 959 CE1 TYR A 58 6.476 3.999 -21.338 1.00 0.00 C ATOM 960 CE2 TYR A 58 7.866 5.652 -20.286 1.00 0.00 C ATOM 961 CZ TYR A 58 7.206 5.181 -21.402 1.00 0.00 C ATOM 962 OH TYR A 58 7.268 5.880 -22.586 1.00 0.00 O ATOM 0 H TYR A 58 4.669 3.784 -17.533 1.00 0.00 H new ATOM 0 HA TYR A 58 5.828 1.394 -18.521 1.00 0.00 H new ATOM 0 HB2 TYR A 58 6.949 3.710 -16.900 1.00 0.00 H new ATOM 0 HB3 TYR A 58 7.933 2.439 -17.599 1.00 0.00 H new ATOM 0 HD1 TYR A 58 5.847 2.379 -20.095 1.00 0.00 H new ATOM 0 HD2 TYR A 58 8.322 5.319 -18.226 1.00 0.00 H new ATOM 0 HE1 TYR A 58 5.961 3.632 -22.213 1.00 0.00 H new ATOM 0 HE2 TYR A 58 8.432 6.570 -20.341 1.00 0.00 H new ATOM 0 HH TYR A 58 7.816 6.683 -22.463 1.00 0.00 H new ATOM 972 N LEU A 59 5.495 1.660 -15.270 1.00 0.00 N ATOM 973 CA LEU A 59 5.489 0.888 -14.033 1.00 0.00 C ATOM 974 C LEU A 59 4.614 -0.352 -14.162 1.00 0.00 C ATOM 975 O LEU A 59 5.007 -1.446 -13.757 1.00 0.00 O ATOM 976 CB LEU A 59 4.992 1.755 -12.870 1.00 0.00 C ATOM 977 CG LEU A 59 5.920 2.902 -12.451 1.00 0.00 C ATOM 978 CD1 LEU A 59 5.224 3.763 -11.405 1.00 0.00 C ATOM 979 CD2 LEU A 59 7.222 2.331 -11.910 1.00 0.00 C ATOM 0 H LEU A 59 5.123 2.605 -15.178 1.00 0.00 H new ATOM 0 HA LEU A 59 6.511 0.567 -13.833 1.00 0.00 H new ATOM 0 HB2 LEU A 59 4.024 2.176 -13.143 1.00 0.00 H new ATOM 0 HB3 LEU A 59 4.827 1.111 -12.006 1.00 0.00 H new ATOM 0 HG LEU A 59 6.151 3.527 -13.313 1.00 0.00 H new ATOM 0 HD11 LEU A 59 5.884 4.578 -11.107 1.00 0.00 H new ATOM 0 HD12 LEU A 59 4.306 4.174 -11.825 1.00 0.00 H new ATOM 0 HD13 LEU A 59 4.984 3.154 -10.534 1.00 0.00 H new ATOM 0 HD21 LEU A 59 7.881 3.147 -11.612 1.00 0.00 H new ATOM 0 HD22 LEU A 59 7.012 1.701 -11.046 1.00 0.00 H new ATOM 0 HD23 LEU A 59 7.708 1.736 -12.683 1.00 0.00 H new ATOM 991 N MET A 60 3.425 -0.174 -14.727 1.00 0.00 N ATOM 992 CA MET A 60 2.531 -1.294 -15.000 1.00 0.00 C ATOM 993 C MET A 60 3.190 -2.310 -15.924 1.00 0.00 C ATOM 994 O MET A 60 3.216 -3.505 -15.629 1.00 0.00 O ATOM 995 CB MET A 60 1.224 -0.789 -15.608 1.00 0.00 C ATOM 996 CG MET A 60 0.265 -1.890 -16.041 1.00 0.00 C ATOM 997 SD MET A 60 -1.210 -1.246 -16.855 1.00 0.00 S ATOM 998 CE MET A 60 -0.506 -0.596 -18.368 1.00 0.00 C ATOM 0 H MET A 60 3.057 0.736 -15.005 1.00 0.00 H new ATOM 0 HA MET A 60 2.312 -1.792 -14.056 1.00 0.00 H new ATOM 0 HB2 MET A 60 0.721 -0.152 -14.881 1.00 0.00 H new ATOM 0 HB3 MET A 60 1.456 -0.166 -16.472 1.00 0.00 H new ATOM 0 HG2 MET A 60 0.781 -2.570 -16.718 1.00 0.00 H new ATOM 0 HG3 MET A 60 -0.031 -2.472 -15.169 1.00 0.00 H new ATOM 0 HE1 MET A 60 -1.293 -0.474 -19.113 1.00 0.00 H new ATOM 0 HE2 MET A 60 -0.043 0.370 -18.168 1.00 0.00 H new ATOM 0 HE3 MET A 60 0.247 -1.288 -18.745 1.00 0.00 H new ATOM 1008 N ASN A 61 3.720 -1.829 -17.043 1.00 0.00 N ATOM 1009 CA ASN A 61 4.296 -2.705 -18.057 1.00 0.00 C ATOM 1010 C ASN A 61 5.293 -3.679 -17.441 1.00 0.00 C ATOM 1011 O ASN A 61 5.288 -4.869 -17.756 1.00 0.00 O ATOM 1012 CB ASN A 61 4.954 -1.891 -19.155 1.00 0.00 C ATOM 1013 CG ASN A 61 3.953 -1.224 -20.058 1.00 0.00 C ATOM 1014 OD1 ASN A 61 2.785 -1.625 -20.114 1.00 0.00 O ATOM 1015 ND2 ASN A 61 4.388 -0.213 -20.766 1.00 0.00 N ATOM 0 H ASN A 61 3.763 -0.836 -17.271 1.00 0.00 H new ATOM 0 HA ASN A 61 3.486 -3.287 -18.496 1.00 0.00 H new ATOM 0 HB2 ASN A 61 5.595 -1.132 -18.706 1.00 0.00 H new ATOM 0 HB3 ASN A 61 5.597 -2.541 -19.748 1.00 0.00 H new ATOM 0 HD21 ASN A 61 3.754 0.279 -21.396 1.00 0.00 H new ATOM 0 HD22 ASN A 61 5.361 0.083 -20.688 1.00 0.00 H new ATOM 1022 N HIS A 62 6.147 -3.167 -16.562 1.00 0.00 N ATOM 1023 CA HIS A 62 7.162 -3.987 -15.913 1.00 0.00 C ATOM 1024 C HIS A 62 6.527 -5.078 -15.060 1.00 0.00 C ATOM 1025 O HIS A 62 6.950 -6.233 -15.097 1.00 0.00 O ATOM 1026 CB HIS A 62 8.083 -3.123 -15.045 1.00 0.00 C ATOM 1027 CG HIS A 62 9.013 -2.255 -15.833 1.00 0.00 C ATOM 1028 ND1 HIS A 62 9.846 -1.328 -15.242 1.00 0.00 N ATOM 1029 CD2 HIS A 62 9.243 -2.172 -17.165 1.00 0.00 C ATOM 1030 CE1 HIS A 62 10.549 -0.713 -16.178 1.00 0.00 C ATOM 1031 NE2 HIS A 62 10.201 -1.206 -17.352 1.00 0.00 N ATOM 0 H HIS A 62 6.156 -2.186 -16.282 1.00 0.00 H new ATOM 0 HA HIS A 62 7.752 -4.460 -16.698 1.00 0.00 H new ATOM 0 HB2 HIS A 62 7.472 -2.493 -14.399 1.00 0.00 H new ATOM 0 HB3 HIS A 62 8.669 -3.772 -14.395 1.00 0.00 H new ATOM 0 HD2 HIS A 62 8.763 -2.756 -17.936 1.00 0.00 H new ATOM 0 HE1 HIS A 62 11.283 0.061 -16.010 1.00 0.00 H new ATOM 0 HE2 HIS A 62 10.582 -0.916 -18.253 1.00 0.00 H new ATOM 1039 N VAL A 63 5.509 -4.704 -14.292 1.00 0.00 N ATOM 1040 CA VAL A 63 4.880 -5.624 -13.353 1.00 0.00 C ATOM 1041 C VAL A 63 4.093 -6.704 -14.083 1.00 0.00 C ATOM 1042 O VAL A 63 4.209 -7.889 -13.770 1.00 0.00 O ATOM 1043 CB VAL A 63 3.939 -4.859 -12.404 1.00 0.00 C ATOM 1044 CG1 VAL A 63 3.145 -5.830 -11.543 1.00 0.00 C ATOM 1045 CG2 VAL A 63 4.743 -3.902 -11.537 1.00 0.00 C ATOM 0 H VAL A 63 5.102 -3.769 -14.302 1.00 0.00 H new ATOM 0 HA VAL A 63 5.672 -6.101 -12.776 1.00 0.00 H new ATOM 0 HB VAL A 63 3.232 -4.280 -12.999 1.00 0.00 H new ATOM 0 HG11 VAL A 63 2.485 -5.272 -10.879 1.00 0.00 H new ATOM 0 HG12 VAL A 63 2.549 -6.481 -12.183 1.00 0.00 H new ATOM 0 HG13 VAL A 63 3.831 -6.434 -10.949 1.00 0.00 H new ATOM 0 HG21 VAL A 63 4.071 -3.364 -10.868 1.00 0.00 H new ATOM 0 HG22 VAL A 63 5.467 -4.465 -10.948 1.00 0.00 H new ATOM 0 HG23 VAL A 63 5.269 -3.189 -12.173 1.00 0.00 H new ATOM 1055 N VAL A 64 3.291 -6.288 -15.057 1.00 0.00 N ATOM 1056 CA VAL A 64 2.395 -7.202 -15.755 1.00 0.00 C ATOM 1057 C VAL A 64 3.163 -8.095 -16.722 1.00 0.00 C ATOM 1058 O VAL A 64 2.727 -9.201 -17.041 1.00 0.00 O ATOM 1059 CB VAL A 64 1.324 -6.413 -16.531 1.00 0.00 C ATOM 1060 CG1 VAL A 64 0.564 -5.486 -15.595 1.00 0.00 C ATOM 1061 CG2 VAL A 64 1.975 -5.626 -17.658 1.00 0.00 C ATOM 0 H VAL A 64 3.243 -5.322 -15.381 1.00 0.00 H new ATOM 0 HA VAL A 64 1.914 -7.831 -15.005 1.00 0.00 H new ATOM 0 HB VAL A 64 0.611 -7.115 -16.963 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -0.189 -4.936 -16.160 1.00 0.00 H new ATOM 0 HG12 VAL A 64 0.077 -6.074 -14.817 1.00 0.00 H new ATOM 0 HG13 VAL A 64 1.259 -4.783 -15.136 1.00 0.00 H new ATOM 0 HG21 VAL A 64 1.211 -5.071 -18.202 1.00 0.00 H new ATOM 0 HG22 VAL A 64 2.703 -4.930 -17.242 1.00 0.00 H new ATOM 0 HG23 VAL A 64 2.478 -6.313 -18.338 1.00 0.00 H new ATOM 1071 N GLN A 65 4.309 -7.607 -17.186 1.00 0.00 N ATOM 1072 CA GLN A 65 5.212 -8.414 -17.997 1.00 0.00 C ATOM 1073 C GLN A 65 5.836 -9.536 -17.176 1.00 0.00 C ATOM 1074 O GLN A 65 5.981 -10.661 -17.654 1.00 0.00 O ATOM 1075 CB GLN A 65 6.311 -7.540 -18.608 1.00 0.00 C ATOM 1076 CG GLN A 65 7.253 -8.284 -19.538 1.00 0.00 C ATOM 1077 CD GLN A 65 6.544 -8.838 -20.759 1.00 0.00 C ATOM 1078 OE1 GLN A 65 5.874 -8.104 -21.491 1.00 0.00 O ATOM 1079 NE2 GLN A 65 6.686 -10.139 -20.986 1.00 0.00 N ATOM 0 H GLN A 65 4.634 -6.656 -17.014 1.00 0.00 H new ATOM 0 HA GLN A 65 4.626 -8.862 -18.800 1.00 0.00 H new ATOM 0 HB2 GLN A 65 5.845 -6.723 -19.159 1.00 0.00 H new ATOM 0 HB3 GLN A 65 6.893 -7.091 -17.803 1.00 0.00 H new ATOM 0 HG2 GLN A 65 8.049 -7.612 -19.858 1.00 0.00 H new ATOM 0 HG3 GLN A 65 7.726 -9.102 -18.994 1.00 0.00 H new ATOM 0 HE21 GLN A 65 7.249 -10.708 -20.355 1.00 0.00 H new ATOM 0 HE22 GLN A 65 6.232 -10.569 -21.792 1.00 0.00 H new ATOM 1088 N GLN A 66 6.204 -9.221 -15.939 1.00 0.00 N ATOM 1089 CA GLN A 66 6.713 -10.226 -15.012 1.00 0.00 C ATOM 1090 C GLN A 66 5.599 -11.149 -14.535 1.00 0.00 C ATOM 1091 O GLN A 66 5.828 -12.331 -14.275 1.00 0.00 O ATOM 1092 CB GLN A 66 7.387 -9.556 -13.812 1.00 0.00 C ATOM 1093 CG GLN A 66 8.718 -8.897 -14.133 1.00 0.00 C ATOM 1094 CD GLN A 66 9.763 -9.897 -14.591 1.00 0.00 C ATOM 1095 OE1 GLN A 66 9.881 -10.992 -14.033 1.00 0.00 O ATOM 1096 NE2 GLN A 66 10.527 -9.527 -15.611 1.00 0.00 N ATOM 0 H GLN A 66 6.159 -8.277 -15.555 1.00 0.00 H new ATOM 0 HA GLN A 66 7.451 -10.826 -15.544 1.00 0.00 H new ATOM 0 HB2 GLN A 66 6.712 -8.805 -13.403 1.00 0.00 H new ATOM 0 HB3 GLN A 66 7.542 -10.303 -13.033 1.00 0.00 H new ATOM 0 HG2 GLN A 66 8.571 -8.147 -14.911 1.00 0.00 H new ATOM 0 HG3 GLN A 66 9.083 -8.373 -13.250 1.00 0.00 H new ATOM 0 HE21 GLN A 66 10.394 -8.612 -16.042 1.00 0.00 H new ATOM 0 HE22 GLN A 66 11.247 -10.158 -15.964 1.00 0.00 H new ATOM 1105 N ALA A 67 4.393 -10.604 -14.421 1.00 0.00 N ATOM 1106 CA ALA A 67 3.215 -11.406 -14.114 1.00 0.00 C ATOM 1107 C ALA A 67 2.916 -12.396 -15.232 1.00 0.00 C ATOM 1108 O ALA A 67 2.462 -13.512 -14.981 1.00 0.00 O ATOM 1109 CB ALA A 67 2.012 -10.507 -13.866 1.00 0.00 C ATOM 0 H ALA A 67 4.206 -9.608 -14.537 1.00 0.00 H new ATOM 0 HA ALA A 67 3.422 -11.975 -13.208 1.00 0.00 H new ATOM 0 HB1 ALA A 67 1.140 -11.120 -13.638 1.00 0.00 H new ATOM 0 HB2 ALA A 67 2.220 -9.845 -13.025 1.00 0.00 H new ATOM 0 HB3 ALA A 67 1.813 -9.911 -14.757 1.00 0.00 H new ATOM 1115 N LYS A 68 3.172 -11.980 -16.468 1.00 0.00 N ATOM 1116 CA LYS A 68 3.030 -12.864 -17.619 1.00 0.00 C ATOM 1117 C LYS A 68 4.085 -13.963 -17.602 1.00 0.00 C ATOM 1118 O LYS A 68 3.775 -15.137 -17.802 1.00 0.00 O ATOM 1119 CB LYS A 68 3.121 -12.067 -18.921 1.00 0.00 C ATOM 1120 CG LYS A 68 3.030 -12.913 -20.184 1.00 0.00 C ATOM 1121 CD LYS A 68 1.641 -13.512 -20.349 1.00 0.00 C ATOM 1122 CE LYS A 68 1.553 -14.371 -21.602 1.00 0.00 C ATOM 1123 NZ LYS A 68 0.184 -14.916 -21.808 1.00 0.00 N ATOM 0 H LYS A 68 3.479 -11.035 -16.698 1.00 0.00 H new ATOM 0 HA LYS A 68 2.048 -13.333 -17.560 1.00 0.00 H new ATOM 0 HB2 LYS A 68 2.321 -11.326 -18.936 1.00 0.00 H new ATOM 0 HB3 LYS A 68 4.063 -11.519 -18.932 1.00 0.00 H new ATOM 0 HG2 LYS A 68 3.270 -12.300 -21.053 1.00 0.00 H new ATOM 0 HG3 LYS A 68 3.770 -13.712 -20.143 1.00 0.00 H new ATOM 0 HD2 LYS A 68 1.397 -14.115 -19.475 1.00 0.00 H new ATOM 0 HD3 LYS A 68 0.902 -12.712 -20.401 1.00 0.00 H new ATOM 0 HE2 LYS A 68 1.841 -13.778 -22.470 1.00 0.00 H new ATOM 0 HE3 LYS A 68 2.264 -15.194 -21.528 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 0.215 -15.673 -22.520 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 -0.176 -15.299 -20.911 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 -0.446 -14.157 -22.138 1.00 0.00 H new ATOM 1137 N GLY A 69 5.333 -13.574 -17.364 1.00 0.00 N ATOM 1138 CA GLY A 69 6.444 -14.518 -17.374 1.00 0.00 C ATOM 1139 C GLY A 69 6.367 -15.473 -16.190 1.00 0.00 C ATOM 1140 O GLY A 69 6.598 -16.673 -16.333 1.00 0.00 O ATOM 0 H GLY A 69 5.600 -12.611 -17.162 1.00 0.00 H new ATOM 0 HA2 GLY A 69 6.433 -15.086 -18.304 1.00 0.00 H new ATOM 0 HA3 GLY A 69 7.388 -13.973 -17.344 1.00 0.00 H new ATOM 1144 N GLN A 70 6.042 -14.932 -15.021 1.00 0.00 N ATOM 1145 CA GLN A 70 5.995 -15.724 -13.797 1.00 0.00 C ATOM 1146 C GLN A 70 4.620 -16.348 -13.597 1.00 0.00 C ATOM 1147 O GLN A 70 4.413 -17.132 -12.671 1.00 0.00 O ATOM 1148 CB GLN A 70 6.359 -14.860 -12.586 1.00 0.00 C ATOM 1149 CG GLN A 70 7.779 -14.322 -12.610 1.00 0.00 C ATOM 1150 CD GLN A 70 8.094 -13.467 -11.397 1.00 0.00 C ATOM 1151 OE1 GLN A 70 7.742 -13.814 -10.267 1.00 0.00 O ATOM 1152 NE2 GLN A 70 8.761 -12.341 -11.626 1.00 0.00 N ATOM 0 H GLN A 70 5.807 -13.947 -14.895 1.00 0.00 H new ATOM 0 HA GLN A 70 6.725 -16.528 -13.893 1.00 0.00 H new ATOM 0 HB2 GLN A 70 5.665 -14.021 -12.531 1.00 0.00 H new ATOM 0 HB3 GLN A 70 6.221 -15.448 -11.679 1.00 0.00 H new ATOM 0 HG2 GLN A 70 8.480 -15.156 -12.655 1.00 0.00 H new ATOM 0 HG3 GLN A 70 7.926 -13.732 -13.515 1.00 0.00 H new ATOM 0 HE21 GLN A 70 9.032 -12.093 -12.578 1.00 0.00 H new ATOM 0 HE22 GLN A 70 9.002 -11.724 -10.850 1.00 0.00 H new ATOM 1161 N LYS A 71 3.682 -15.994 -14.470 1.00 0.00 N ATOM 1162 CA LYS A 71 2.327 -16.526 -14.396 1.00 0.00 C ATOM 1163 C LYS A 71 1.655 -16.142 -13.084 1.00 0.00 C ATOM 1164 O LYS A 71 1.231 -17.006 -12.317 1.00 0.00 O ATOM 1165 CB LYS A 71 2.340 -18.048 -14.555 1.00 0.00 C ATOM 1166 CG LYS A 71 2.928 -18.538 -15.872 1.00 0.00 C ATOM 1167 CD LYS A 71 2.857 -20.054 -15.978 1.00 0.00 C ATOM 1168 CE LYS A 71 3.481 -20.548 -17.275 1.00 0.00 C ATOM 1169 NZ LYS A 71 3.446 -22.032 -17.379 1.00 0.00 N ATOM 0 H LYS A 71 3.836 -15.340 -15.238 1.00 0.00 H new ATOM 0 HA LYS A 71 1.752 -16.090 -15.213 1.00 0.00 H new ATOM 0 HB2 LYS A 71 2.909 -18.482 -13.733 1.00 0.00 H new ATOM 0 HB3 LYS A 71 1.319 -18.419 -14.467 1.00 0.00 H new ATOM 0 HG2 LYS A 71 2.387 -18.087 -16.704 1.00 0.00 H new ATOM 0 HG3 LYS A 71 3.965 -18.214 -15.953 1.00 0.00 H new ATOM 0 HD2 LYS A 71 3.372 -20.504 -15.130 1.00 0.00 H new ATOM 0 HD3 LYS A 71 1.817 -20.376 -15.927 1.00 0.00 H new ATOM 0 HE2 LYS A 71 2.951 -20.112 -18.122 1.00 0.00 H new ATOM 0 HE3 LYS A 71 4.514 -20.204 -17.335 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 3.881 -22.327 -18.276 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 3.974 -22.448 -16.585 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 2.459 -22.359 -17.348 1.00 0.00 H new ATOM 1183 N ILE A 72 1.561 -14.841 -12.832 1.00 0.00 N ATOM 1184 CA ILE A 72 0.911 -14.339 -11.627 1.00 0.00 C ATOM 1185 C ILE A 72 -0.466 -13.769 -11.941 1.00 0.00 C ATOM 1186 O ILE A 72 -0.591 -12.620 -12.363 1.00 0.00 O ATOM 1187 CB ILE A 72 1.772 -13.259 -10.949 1.00 0.00 C ATOM 1188 CG1 ILE A 72 3.171 -13.803 -10.646 1.00 0.00 C ATOM 1189 CG2 ILE A 72 1.102 -12.767 -9.675 1.00 0.00 C ATOM 1190 CD1 ILE A 72 4.154 -12.745 -10.200 1.00 0.00 C ATOM 0 H ILE A 72 1.927 -14.114 -13.447 1.00 0.00 H new ATOM 0 HA ILE A 72 0.794 -15.182 -10.946 1.00 0.00 H new ATOM 0 HB ILE A 72 1.871 -12.416 -11.632 1.00 0.00 H new ATOM 0 HG12 ILE A 72 3.094 -14.564 -9.870 1.00 0.00 H new ATOM 0 HG13 ILE A 72 3.560 -14.295 -11.538 1.00 0.00 H new ATOM 0 HG21 ILE A 72 1.724 -12.004 -9.208 1.00 0.00 H new ATOM 0 HG22 ILE A 72 0.127 -12.343 -9.917 1.00 0.00 H new ATOM 0 HG23 ILE A 72 0.973 -13.602 -8.986 1.00 0.00 H new ATOM 0 HD11 ILE A 72 5.122 -13.207 -10.004 1.00 0.00 H new ATOM 0 HD12 ILE A 72 4.262 -11.995 -10.984 1.00 0.00 H new ATOM 0 HD13 ILE A 72 3.788 -12.269 -9.290 1.00 0.00 H new ATOM 1202 N ILE A 73 -1.498 -14.580 -11.732 1.00 0.00 N ATOM 1203 CA ILE A 73 -2.864 -14.177 -12.043 1.00 0.00 C ATOM 1204 C ILE A 73 -3.318 -13.031 -11.148 1.00 0.00 C ATOM 1205 O ILE A 73 -4.209 -12.262 -11.510 1.00 0.00 O ATOM 1206 CB ILE A 73 -3.835 -15.362 -11.892 1.00 0.00 C ATOM 1207 CG1 ILE A 73 -5.174 -15.045 -12.563 1.00 0.00 C ATOM 1208 CG2 ILE A 73 -4.039 -15.699 -10.422 1.00 0.00 C ATOM 1209 CD1 ILE A 73 -5.074 -14.840 -14.057 1.00 0.00 C ATOM 0 H ILE A 73 -1.414 -15.521 -11.348 1.00 0.00 H new ATOM 0 HA ILE A 73 -2.874 -13.838 -13.079 1.00 0.00 H new ATOM 0 HB ILE A 73 -3.400 -16.231 -12.386 1.00 0.00 H new ATOM 0 HG12 ILE A 73 -5.872 -15.858 -12.363 1.00 0.00 H new ATOM 0 HG13 ILE A 73 -5.593 -14.147 -12.110 1.00 0.00 H new ATOM 0 HG21 ILE A 73 -4.728 -16.539 -10.333 1.00 0.00 H new ATOM 0 HG22 ILE A 73 -3.082 -15.966 -9.974 1.00 0.00 H new ATOM 0 HG23 ILE A 73 -4.453 -14.834 -9.904 1.00 0.00 H new ATOM 0 HD11 ILE A 73 -6.062 -14.620 -14.461 1.00 0.00 H new ATOM 0 HD12 ILE A 73 -4.403 -14.007 -14.266 1.00 0.00 H new ATOM 0 HD13 ILE A 73 -4.685 -15.745 -14.523 1.00 0.00 H new ATOM 1221 N GLN A 74 -2.700 -12.921 -9.977 1.00 0.00 N ATOM 1222 CA GLN A 74 -3.038 -11.867 -9.028 1.00 0.00 C ATOM 1223 C GLN A 74 -2.913 -10.490 -9.666 1.00 0.00 C ATOM 1224 O GLN A 74 -3.808 -9.654 -9.543 1.00 0.00 O ATOM 1225 CB GLN A 74 -2.142 -11.953 -7.789 1.00 0.00 C ATOM 1226 CG GLN A 74 -2.408 -13.164 -6.911 1.00 0.00 C ATOM 1227 CD GLN A 74 -1.397 -13.297 -5.788 1.00 0.00 C ATOM 1228 OE1 GLN A 74 -0.201 -13.059 -5.979 1.00 0.00 O ATOM 1229 NE2 GLN A 74 -1.872 -13.679 -4.608 1.00 0.00 N ATOM 0 H GLN A 74 -1.961 -13.550 -9.662 1.00 0.00 H new ATOM 0 HA GLN A 74 -4.076 -12.012 -8.727 1.00 0.00 H new ATOM 0 HB2 GLN A 74 -1.100 -11.972 -8.109 1.00 0.00 H new ATOM 0 HB3 GLN A 74 -2.277 -11.050 -7.194 1.00 0.00 H new ATOM 0 HG2 GLN A 74 -3.410 -13.089 -6.488 1.00 0.00 H new ATOM 0 HG3 GLN A 74 -2.387 -14.065 -7.524 1.00 0.00 H new ATOM 0 HE21 GLN A 74 -2.869 -13.865 -4.495 1.00 0.00 H new ATOM 0 HE22 GLN A 74 -1.240 -13.786 -3.814 1.00 0.00 H new ATOM 1238 N PHE A 75 -1.796 -10.260 -10.349 1.00 0.00 N ATOM 1239 CA PHE A 75 -1.543 -8.976 -10.993 1.00 0.00 C ATOM 1240 C PHE A 75 -2.298 -8.864 -12.312 1.00 0.00 C ATOM 1241 O PHE A 75 -2.836 -7.807 -12.641 1.00 0.00 O ATOM 1242 CB PHE A 75 -0.045 -8.789 -11.240 1.00 0.00 C ATOM 1243 CG PHE A 75 0.727 -8.396 -10.013 1.00 0.00 C ATOM 1244 CD1 PHE A 75 1.761 -9.192 -9.542 1.00 0.00 C ATOM 1245 CD2 PHE A 75 0.420 -7.231 -9.326 1.00 0.00 C ATOM 1246 CE1 PHE A 75 2.472 -8.832 -8.413 1.00 0.00 C ATOM 1247 CE2 PHE A 75 1.130 -6.868 -8.197 1.00 0.00 C ATOM 1248 CZ PHE A 75 2.156 -7.670 -7.741 1.00 0.00 C ATOM 0 H PHE A 75 -1.051 -10.946 -10.471 1.00 0.00 H new ATOM 0 HA PHE A 75 -1.898 -8.193 -10.323 1.00 0.00 H new ATOM 0 HB2 PHE A 75 0.367 -9.717 -11.635 1.00 0.00 H new ATOM 0 HB3 PHE A 75 0.095 -8.026 -12.006 1.00 0.00 H new ATOM 0 HD1 PHE A 75 2.013 -10.103 -10.064 1.00 0.00 H new ATOM 0 HD2 PHE A 75 -0.383 -6.600 -9.677 1.00 0.00 H new ATOM 0 HE1 PHE A 75 3.275 -9.461 -8.057 1.00 0.00 H new ATOM 0 HE2 PHE A 75 0.882 -5.957 -7.672 1.00 0.00 H new ATOM 0 HZ PHE A 75 2.711 -7.388 -6.859 1.00 0.00 H new ATOM 1258 N GLN A 76 -2.335 -9.959 -13.062 1.00 0.00 N ATOM 1259 CA GLN A 76 -3.002 -9.978 -14.359 1.00 0.00 C ATOM 1260 C GLN A 76 -4.485 -9.661 -14.219 1.00 0.00 C ATOM 1261 O GLN A 76 -5.042 -8.894 -15.005 1.00 0.00 O ATOM 1262 CB GLN A 76 -2.820 -11.339 -15.036 1.00 0.00 C ATOM 1263 CG GLN A 76 -1.412 -11.599 -15.542 1.00 0.00 C ATOM 1264 CD GLN A 76 -1.253 -12.992 -16.121 1.00 0.00 C ATOM 1265 OE1 GLN A 76 -1.408 -13.994 -15.417 1.00 0.00 O ATOM 1266 NE2 GLN A 76 -0.941 -13.064 -17.410 1.00 0.00 N ATOM 0 H GLN A 76 -1.910 -10.847 -12.794 1.00 0.00 H new ATOM 0 HA GLN A 76 -2.544 -9.208 -14.980 1.00 0.00 H new ATOM 0 HB2 GLN A 76 -3.090 -12.123 -14.329 1.00 0.00 H new ATOM 0 HB3 GLN A 76 -3.514 -11.412 -15.873 1.00 0.00 H new ATOM 0 HG2 GLN A 76 -1.161 -10.861 -16.304 1.00 0.00 H new ATOM 0 HG3 GLN A 76 -0.704 -11.466 -14.724 1.00 0.00 H new ATOM 0 HE21 GLN A 76 -0.822 -12.210 -17.954 1.00 0.00 H new ATOM 0 HE22 GLN A 76 -0.820 -13.974 -17.855 1.00 0.00 H new ATOM 1275 N ASP A 77 -5.120 -10.255 -13.215 1.00 0.00 N ATOM 1276 CA ASP A 77 -6.526 -9.989 -12.933 1.00 0.00 C ATOM 1277 C ASP A 77 -6.722 -8.578 -12.393 1.00 0.00 C ATOM 1278 O ASP A 77 -7.595 -7.842 -12.854 1.00 0.00 O ATOM 1279 CB ASP A 77 -7.073 -11.006 -11.929 1.00 0.00 C ATOM 1280 CG ASP A 77 -8.580 -10.896 -11.736 1.00 0.00 C ATOM 1281 OD1 ASP A 77 -9.299 -11.137 -12.677 1.00 0.00 O ATOM 1282 OD2 ASP A 77 -8.998 -10.574 -10.650 1.00 0.00 O ATOM 0 H ASP A 77 -4.683 -10.925 -12.582 1.00 0.00 H new ATOM 0 HA ASP A 77 -7.074 -10.080 -13.871 1.00 0.00 H new ATOM 0 HB2 ASP A 77 -6.828 -12.012 -12.268 1.00 0.00 H new ATOM 0 HB3 ASP A 77 -6.577 -10.864 -10.969 1.00 0.00 H new ATOM 1287 N SER A 78 -5.904 -8.205 -11.415 1.00 0.00 N ATOM 1288 CA SER A 78 -6.035 -6.910 -10.759 1.00 0.00 C ATOM 1289 C SER A 78 -5.861 -5.769 -11.753 1.00 0.00 C ATOM 1290 O SER A 78 -6.695 -4.866 -11.830 1.00 0.00 O ATOM 1291 CB SER A 78 -5.013 -6.783 -9.646 1.00 0.00 C ATOM 1292 OG SER A 78 -5.268 -7.706 -8.623 1.00 0.00 O ATOM 0 H SER A 78 -5.142 -8.782 -11.059 1.00 0.00 H new ATOM 0 HA SER A 78 -7.038 -6.846 -10.338 1.00 0.00 H new ATOM 0 HB2 SER A 78 -4.012 -6.945 -10.046 1.00 0.00 H new ATOM 0 HB3 SER A 78 -5.034 -5.771 -9.241 1.00 0.00 H new ATOM 0 HG SER A 78 -4.614 -8.434 -8.669 1.00 0.00 H new ATOM 1298 N PHE A 79 -4.772 -5.815 -12.513 1.00 0.00 N ATOM 1299 CA PHE A 79 -4.465 -4.764 -13.476 1.00 0.00 C ATOM 1300 C PHE A 79 -5.437 -4.791 -14.650 1.00 0.00 C ATOM 1301 O PHE A 79 -5.824 -3.746 -15.171 1.00 0.00 O ATOM 1302 CB PHE A 79 -3.032 -4.912 -13.991 1.00 0.00 C ATOM 1303 CG PHE A 79 -2.009 -4.212 -13.143 1.00 0.00 C ATOM 1304 CD1 PHE A 79 -1.159 -4.934 -12.318 1.00 0.00 C ATOM 1305 CD2 PHE A 79 -1.893 -2.830 -13.168 1.00 0.00 C ATOM 1306 CE1 PHE A 79 -0.217 -4.291 -11.537 1.00 0.00 C ATOM 1307 CE2 PHE A 79 -0.952 -2.185 -12.391 1.00 0.00 C ATOM 1308 CZ PHE A 79 -0.113 -2.916 -11.574 1.00 0.00 C ATOM 0 H PHE A 79 -4.087 -6.570 -12.481 1.00 0.00 H new ATOM 0 HA PHE A 79 -4.566 -3.807 -12.964 1.00 0.00 H new ATOM 0 HB2 PHE A 79 -2.783 -5.972 -14.045 1.00 0.00 H new ATOM 0 HB3 PHE A 79 -2.978 -4.520 -15.007 1.00 0.00 H new ATOM 0 HD1 PHE A 79 -1.234 -6.011 -12.286 1.00 0.00 H new ATOM 0 HD2 PHE A 79 -2.547 -2.251 -13.803 1.00 0.00 H new ATOM 0 HE1 PHE A 79 0.437 -4.865 -10.898 1.00 0.00 H new ATOM 0 HE2 PHE A 79 -0.872 -1.108 -12.422 1.00 0.00 H new ATOM 0 HZ PHE A 79 0.623 -2.412 -10.965 1.00 0.00 H new ATOM 1318 N GLY A 80 -5.827 -5.993 -15.060 1.00 0.00 N ATOM 1319 CA GLY A 80 -6.756 -6.159 -16.171 1.00 0.00 C ATOM 1320 C GLY A 80 -8.059 -5.412 -15.916 1.00 0.00 C ATOM 1321 O GLY A 80 -8.583 -4.738 -16.802 1.00 0.00 O ATOM 0 H GLY A 80 -5.514 -6.868 -14.639 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -6.298 -5.793 -17.090 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -6.964 -7.219 -16.319 1.00 0.00 H new ATOM 1325 N LYS A 81 -8.577 -5.536 -14.698 1.00 0.00 N ATOM 1326 CA LYS A 81 -9.854 -4.928 -14.344 1.00 0.00 C ATOM 1327 C LYS A 81 -9.776 -3.408 -14.401 1.00 0.00 C ATOM 1328 O LYS A 81 -10.652 -2.752 -14.966 1.00 0.00 O ATOM 1329 CB LYS A 81 -10.294 -5.380 -12.951 1.00 0.00 C ATOM 1330 CG LYS A 81 -10.757 -6.829 -12.876 1.00 0.00 C ATOM 1331 CD LYS A 81 -11.080 -7.233 -11.446 1.00 0.00 C ATOM 1332 CE LYS A 81 -11.605 -8.660 -11.377 1.00 0.00 C ATOM 1333 NZ LYS A 81 -11.769 -9.126 -9.974 1.00 0.00 N ATOM 0 H LYS A 81 -8.131 -6.052 -13.940 1.00 0.00 H new ATOM 0 HA LYS A 81 -10.594 -5.258 -15.074 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -9.464 -5.240 -12.258 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -11.104 -4.735 -12.612 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -11.639 -6.964 -13.502 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -9.980 -7.482 -13.274 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -10.185 -7.143 -10.830 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -11.822 -6.550 -11.032 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -12.563 -8.719 -11.893 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -10.919 -9.325 -11.902 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -12.653 -9.667 -9.889 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -10.965 -9.733 -9.714 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -11.803 -8.305 -9.337 1.00 0.00 H new ATOM 1347 N VAL A 82 -8.722 -2.852 -13.814 1.00 0.00 N ATOM 1348 CA VAL A 82 -8.575 -1.405 -13.713 1.00 0.00 C ATOM 1349 C VAL A 82 -8.079 -0.809 -15.024 1.00 0.00 C ATOM 1350 O VAL A 82 -8.361 0.348 -15.336 1.00 0.00 O ATOM 1351 CB VAL A 82 -7.591 -1.045 -12.584 1.00 0.00 C ATOM 1352 CG1 VAL A 82 -8.106 -1.555 -11.246 1.00 0.00 C ATOM 1353 CG2 VAL A 82 -6.218 -1.624 -12.889 1.00 0.00 C ATOM 0 H VAL A 82 -7.956 -3.383 -13.400 1.00 0.00 H new ATOM 0 HA VAL A 82 -9.557 -0.987 -13.489 1.00 0.00 H new ATOM 0 HB VAL A 82 -7.506 0.040 -12.522 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -7.399 -1.292 -10.460 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -9.073 -1.100 -11.031 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -8.216 -2.639 -11.288 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -5.528 -1.365 -12.086 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -6.290 -2.709 -12.970 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -5.851 -1.214 -13.830 1.00 0.00 H new ATOM 1363 N ALA A 83 -7.339 -1.605 -15.788 1.00 0.00 N ATOM 1364 CA ALA A 83 -6.790 -1.152 -17.060 1.00 0.00 C ATOM 1365 C ALA A 83 -7.897 -0.831 -18.056 1.00 0.00 C ATOM 1366 O ALA A 83 -7.826 0.163 -18.779 1.00 0.00 O ATOM 1367 CB ALA A 83 -5.849 -2.201 -17.634 1.00 0.00 C ATOM 0 H ALA A 83 -7.105 -2.568 -15.548 1.00 0.00 H new ATOM 0 HA ALA A 83 -6.228 -0.237 -16.876 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -5.447 -1.848 -18.584 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -5.030 -2.376 -16.936 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -6.395 -3.131 -17.794 1.00 0.00 H new ATOM 1373 N ALA A 84 -8.920 -1.678 -18.088 1.00 0.00 N ATOM 1374 CA ALA A 84 -10.039 -1.492 -19.004 1.00 0.00 C ATOM 1375 C ALA A 84 -10.660 -0.111 -18.843 1.00 0.00 C ATOM 1376 O ALA A 84 -11.057 0.520 -19.823 1.00 0.00 O ATOM 1377 CB ALA A 84 -11.088 -2.573 -18.784 1.00 0.00 C ATOM 0 H ALA A 84 -8.997 -2.501 -17.490 1.00 0.00 H new ATOM 0 HA ALA A 84 -9.657 -1.572 -20.022 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -11.917 -2.421 -19.475 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -10.644 -3.553 -18.960 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -11.455 -2.520 -17.759 1.00 0.00 H new ATOM 1383 N GLU A 85 -10.740 0.355 -17.601 1.00 0.00 N ATOM 1384 CA GLU A 85 -11.311 1.664 -17.310 1.00 0.00 C ATOM 1385 C GLU A 85 -10.279 2.769 -17.495 1.00 0.00 C ATOM 1386 O GLU A 85 -10.515 3.738 -18.217 1.00 0.00 O ATOM 1387 CB GLU A 85 -11.861 1.701 -15.882 1.00 0.00 C ATOM 1388 CG GLU A 85 -12.525 3.015 -15.497 1.00 0.00 C ATOM 1389 CD GLU A 85 -13.104 2.994 -14.110 1.00 0.00 C ATOM 1390 OE1 GLU A 85 -12.956 2.000 -13.440 1.00 0.00 O ATOM 1391 OE2 GLU A 85 -13.696 3.973 -13.720 1.00 0.00 O ATOM 0 H GLU A 85 -10.416 -0.155 -16.779 1.00 0.00 H new ATOM 0 HA GLU A 85 -12.127 1.835 -18.013 1.00 0.00 H new ATOM 0 HB2 GLU A 85 -12.584 0.894 -15.763 1.00 0.00 H new ATOM 0 HB3 GLU A 85 -11.045 1.503 -15.186 1.00 0.00 H new ATOM 0 HG2 GLU A 85 -11.794 3.820 -15.568 1.00 0.00 H new ATOM 0 HG3 GLU A 85 -13.316 3.240 -16.212 1.00 0.00 H new ATOM 1398 N VAL A 86 -9.134 2.618 -16.838 1.00 0.00 N ATOM 1399 CA VAL A 86 -8.143 3.685 -16.769 1.00 0.00 C ATOM 1400 C VAL A 86 -7.626 4.047 -18.155 1.00 0.00 C ATOM 1401 O VAL A 86 -7.564 5.222 -18.518 1.00 0.00 O ATOM 1402 CB VAL A 86 -6.961 3.260 -15.878 1.00 0.00 C ATOM 1403 CG1 VAL A 86 -5.813 4.250 -16.009 1.00 0.00 C ATOM 1404 CG2 VAL A 86 -7.416 3.151 -14.431 1.00 0.00 C ATOM 0 H VAL A 86 -8.869 1.765 -16.345 1.00 0.00 H new ATOM 0 HA VAL A 86 -8.629 4.561 -16.338 1.00 0.00 H new ATOM 0 HB VAL A 86 -6.604 2.283 -16.206 1.00 0.00 H new ATOM 0 HG11 VAL A 86 -4.986 3.935 -15.373 1.00 0.00 H new ATOM 0 HG12 VAL A 86 -5.480 4.286 -17.046 1.00 0.00 H new ATOM 0 HG13 VAL A 86 -6.150 5.240 -15.702 1.00 0.00 H new ATOM 0 HG21 VAL A 86 -6.575 2.850 -13.807 1.00 0.00 H new ATOM 0 HG22 VAL A 86 -7.791 4.117 -14.094 1.00 0.00 H new ATOM 0 HG23 VAL A 86 -8.209 2.407 -14.354 1.00 0.00 H new ATOM 1414 N LEU A 87 -7.256 3.031 -18.927 1.00 0.00 N ATOM 1415 CA LEU A 87 -6.619 3.244 -20.221 1.00 0.00 C ATOM 1416 C LEU A 87 -7.508 4.069 -21.143 1.00 0.00 C ATOM 1417 O LEU A 87 -7.021 4.892 -21.918 1.00 0.00 O ATOM 1418 CB LEU A 87 -6.297 1.897 -20.881 1.00 0.00 C ATOM 1419 CG LEU A 87 -5.212 1.061 -20.191 1.00 0.00 C ATOM 1420 CD1 LEU A 87 -5.095 -0.290 -20.883 1.00 0.00 C ATOM 1421 CD2 LEU A 87 -3.890 1.812 -20.228 1.00 0.00 C ATOM 0 H LEU A 87 -7.387 2.050 -18.678 1.00 0.00 H new ATOM 0 HA LEU A 87 -5.694 3.795 -20.052 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -7.212 1.306 -20.924 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -5.988 2.082 -21.910 1.00 0.00 H new ATOM 0 HG LEU A 87 -5.480 0.891 -19.148 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -4.324 -0.884 -20.393 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -6.049 -0.813 -20.823 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -4.828 -0.141 -21.929 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -3.120 1.217 -19.737 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -3.604 1.993 -21.264 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -3.998 2.765 -19.709 1.00 0.00 H new ATOM 1433 N GLY A 88 -8.814 3.843 -21.055 1.00 0.00 N ATOM 1434 CA GLY A 88 -9.781 4.632 -21.809 1.00 0.00 C ATOM 1435 C GLY A 88 -9.817 6.074 -21.318 1.00 0.00 C ATOM 1436 O GLY A 88 -9.802 7.012 -22.116 1.00 0.00 O ATOM 0 H GLY A 88 -9.228 3.119 -20.468 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -9.524 4.612 -22.868 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -10.771 4.187 -21.713 1.00 0.00 H new ATOM 1440 N ARG A 89 -9.865 6.245 -20.001 1.00 0.00 N ATOM 1441 CA ARG A 89 -9.980 7.570 -19.404 1.00 0.00 C ATOM 1442 C ARG A 89 -8.768 8.431 -19.738 1.00 0.00 C ATOM 1443 O ARG A 89 -8.906 9.600 -20.098 1.00 0.00 O ATOM 1444 CB ARG A 89 -10.123 7.465 -17.893 1.00 0.00 C ATOM 1445 CG ARG A 89 -11.469 6.947 -17.413 1.00 0.00 C ATOM 1446 CD ARG A 89 -11.597 7.035 -15.936 1.00 0.00 C ATOM 1447 NE ARG A 89 -12.847 6.463 -15.464 1.00 0.00 N ATOM 1448 CZ ARG A 89 -14.042 7.082 -15.521 1.00 0.00 C ATOM 1449 NH1 ARG A 89 -14.132 8.290 -16.032 1.00 0.00 N ATOM 1450 NH2 ARG A 89 -15.124 6.475 -15.065 1.00 0.00 N ATOM 0 H ARG A 89 -9.826 5.481 -19.326 1.00 0.00 H new ATOM 0 HA ARG A 89 -10.871 8.041 -19.820 1.00 0.00 H new ATOM 0 HB2 ARG A 89 -9.341 6.808 -17.513 1.00 0.00 H new ATOM 0 HB3 ARG A 89 -9.952 8.449 -17.457 1.00 0.00 H new ATOM 0 HG2 ARG A 89 -12.268 7.521 -17.882 1.00 0.00 H new ATOM 0 HG3 ARG A 89 -11.593 5.911 -17.728 1.00 0.00 H new ATOM 0 HD2 ARG A 89 -10.761 6.516 -15.468 1.00 0.00 H new ATOM 0 HD3 ARG A 89 -11.537 8.079 -15.628 1.00 0.00 H new ATOM 0 HE ARG A 89 -12.817 5.526 -15.061 1.00 0.00 H new ATOM 0 HH11 ARG A 89 -13.297 8.758 -16.385 1.00 0.00 H new ATOM 0 HH12 ARG A 89 -15.037 8.759 -16.075 1.00 0.00 H new ATOM 0 HH21 ARG A 89 -15.054 5.537 -14.670 1.00 0.00 H new ATOM 0 HH22 ARG A 89 -16.029 6.944 -15.108 1.00 0.00 H new ATOM 1464 N ILE A 90 -7.582 7.846 -19.617 1.00 0.00 N ATOM 1465 CA ILE A 90 -6.340 8.583 -19.819 1.00 0.00 C ATOM 1466 C ILE A 90 -6.085 8.835 -21.300 1.00 0.00 C ATOM 1467 O ILE A 90 -5.364 9.763 -21.666 1.00 0.00 O ATOM 1468 CB ILE A 90 -5.145 7.824 -19.214 1.00 0.00 C ATOM 1469 CG1 ILE A 90 -4.916 6.507 -19.959 1.00 0.00 C ATOM 1470 CG2 ILE A 90 -5.374 7.569 -17.732 1.00 0.00 C ATOM 1471 CD1 ILE A 90 -3.678 5.761 -19.515 1.00 0.00 C ATOM 0 H ILE A 90 -7.454 6.862 -19.380 1.00 0.00 H new ATOM 0 HA ILE A 90 -6.446 9.542 -19.312 1.00 0.00 H new ATOM 0 HB ILE A 90 -4.252 8.439 -19.323 1.00 0.00 H new ATOM 0 HG12 ILE A 90 -5.786 5.865 -19.818 1.00 0.00 H new ATOM 0 HG13 ILE A 90 -4.841 6.713 -21.027 1.00 0.00 H new ATOM 0 HG21 ILE A 90 -4.520 7.032 -17.319 1.00 0.00 H new ATOM 0 HG22 ILE A 90 -5.490 8.520 -17.213 1.00 0.00 H new ATOM 0 HG23 ILE A 90 -6.276 6.972 -17.601 1.00 0.00 H new ATOM 0 HD11 ILE A 90 -3.584 4.839 -20.088 1.00 0.00 H new ATOM 0 HD12 ILE A 90 -2.799 6.383 -19.682 1.00 0.00 H new ATOM 0 HD13 ILE A 90 -3.758 5.522 -18.454 1.00 0.00 H new ATOM 1483 N ASN A 91 -6.680 8.003 -22.148 1.00 0.00 N ATOM 1484 CA ASN A 91 -6.665 8.236 -23.587 1.00 0.00 C ATOM 1485 C ASN A 91 -7.295 9.578 -23.935 1.00 0.00 C ATOM 1486 O ASN A 91 -6.750 10.343 -24.731 1.00 0.00 O ATOM 1487 CB ASN A 91 -7.372 7.109 -24.317 1.00 0.00 C ATOM 1488 CG ASN A 91 -7.292 7.249 -25.812 1.00 0.00 C ATOM 1489 OD1 ASN A 91 -8.023 8.045 -26.413 1.00 0.00 O ATOM 1490 ND2 ASN A 91 -6.418 6.491 -26.424 1.00 0.00 N ATOM 0 H ASN A 91 -7.179 7.160 -21.863 1.00 0.00 H new ATOM 0 HA ASN A 91 -5.625 8.261 -23.911 1.00 0.00 H new ATOM 0 HB2 ASN A 91 -6.932 6.157 -24.021 1.00 0.00 H new ATOM 0 HB3 ASN A 91 -8.419 7.085 -24.013 1.00 0.00 H new ATOM 0 HD21 ASN A 91 -6.319 6.543 -27.438 1.00 0.00 H new ATOM 0 HD22 ASN A 91 -5.836 5.848 -25.887 1.00 0.00 H new ATOM 1497 N GLN A 92 -8.445 9.860 -23.333 1.00 0.00 N ATOM 1498 CA GLN A 92 -9.105 11.148 -23.506 1.00 0.00 C ATOM 1499 C GLN A 92 -8.274 12.277 -22.910 1.00 0.00 C ATOM 1500 O GLN A 92 -8.155 13.351 -23.499 1.00 0.00 O ATOM 1501 CB GLN A 92 -10.496 11.129 -22.865 1.00 0.00 C ATOM 1502 CG GLN A 92 -11.287 12.411 -23.057 1.00 0.00 C ATOM 1503 CD GLN A 92 -12.680 12.326 -22.461 1.00 0.00 C ATOM 1504 OE1 GLN A 92 -13.154 11.243 -22.107 1.00 0.00 O ATOM 1505 NE2 GLN A 92 -13.345 13.470 -22.347 1.00 0.00 N ATOM 0 H GLN A 92 -8.940 9.212 -22.720 1.00 0.00 H new ATOM 0 HA GLN A 92 -9.209 11.327 -24.576 1.00 0.00 H new ATOM 0 HB2 GLN A 92 -11.065 10.298 -23.282 1.00 0.00 H new ATOM 0 HB3 GLN A 92 -10.389 10.938 -21.797 1.00 0.00 H new ATOM 0 HG2 GLN A 92 -10.748 13.240 -22.597 1.00 0.00 H new ATOM 0 HG3 GLN A 92 -11.363 12.632 -24.122 1.00 0.00 H new ATOM 0 HE21 GLN A 92 -12.915 14.343 -22.653 1.00 0.00 H new ATOM 0 HE22 GLN A 92 -14.286 13.476 -21.954 1.00 0.00 H new ATOM 1514 N GLU A 93 -7.700 12.027 -21.738 1.00 0.00 N ATOM 1515 CA GLU A 93 -6.912 13.036 -21.039 1.00 0.00 C ATOM 1516 C GLU A 93 -5.643 13.375 -21.810 1.00 0.00 C ATOM 1517 O GLU A 93 -5.234 14.534 -21.873 1.00 0.00 O ATOM 1518 CB GLU A 93 -6.553 12.553 -19.633 1.00 0.00 C ATOM 1519 CG GLU A 93 -7.735 12.456 -18.680 1.00 0.00 C ATOM 1520 CD GLU A 93 -7.358 11.905 -17.333 1.00 0.00 C ATOM 1521 OE1 GLU A 93 -6.271 11.394 -17.204 1.00 0.00 O ATOM 1522 OE2 GLU A 93 -8.157 11.995 -16.431 1.00 0.00 O ATOM 0 H GLU A 93 -7.766 11.133 -21.251 1.00 0.00 H new ATOM 0 HA GLU A 93 -7.519 13.938 -20.963 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -6.081 11.573 -19.708 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -5.813 13.231 -19.207 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -8.174 13.445 -18.552 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -8.502 11.822 -19.124 1.00 0.00 H new ATOM 1529 N PHE A 94 -5.023 12.356 -22.396 1.00 0.00 N ATOM 1530 CA PHE A 94 -3.738 12.523 -23.065 1.00 0.00 C ATOM 1531 C PHE A 94 -3.887 13.327 -24.350 1.00 0.00 C ATOM 1532 O PHE A 94 -4.858 13.163 -25.087 1.00 0.00 O ATOM 1533 CB PHE A 94 -3.117 11.161 -23.378 1.00 0.00 C ATOM 1534 CG PHE A 94 -2.484 10.495 -22.189 1.00 0.00 C ATOM 1535 CD1 PHE A 94 -2.197 11.220 -21.042 1.00 0.00 C ATOM 1536 CD2 PHE A 94 -2.174 9.144 -22.215 1.00 0.00 C ATOM 1537 CE1 PHE A 94 -1.615 10.609 -19.948 1.00 0.00 C ATOM 1538 CE2 PHE A 94 -1.593 8.531 -21.123 1.00 0.00 C ATOM 1539 CZ PHE A 94 -1.313 9.265 -19.988 1.00 0.00 C ATOM 0 H PHE A 94 -5.390 11.405 -22.421 1.00 0.00 H new ATOM 0 HA PHE A 94 -3.081 13.070 -22.389 1.00 0.00 H new ATOM 0 HB2 PHE A 94 -3.888 10.505 -23.782 1.00 0.00 H new ATOM 0 HB3 PHE A 94 -2.364 11.286 -24.156 1.00 0.00 H new ATOM 0 HD1 PHE A 94 -2.431 12.274 -21.004 1.00 0.00 H new ATOM 0 HD2 PHE A 94 -2.390 8.564 -23.100 1.00 0.00 H new ATOM 0 HE1 PHE A 94 -1.397 11.185 -19.061 1.00 0.00 H new ATOM 0 HE2 PHE A 94 -1.358 7.478 -21.157 1.00 0.00 H new ATOM 0 HZ PHE A 94 -0.858 8.787 -19.133 1.00 0.00 H new ATOM 1549 N PRO A 95 -2.917 14.197 -24.613 1.00 0.00 N ATOM 1550 CA PRO A 95 -2.807 14.852 -25.911 1.00 0.00 C ATOM 1551 C PRO A 95 -2.418 13.858 -26.999 1.00 0.00 C ATOM 1552 O PRO A 95 -2.237 12.670 -26.732 1.00 0.00 O ATOM 1553 CB PRO A 95 -1.709 15.894 -25.680 1.00 0.00 C ATOM 1554 CG PRO A 95 -0.818 15.267 -24.662 1.00 0.00 C ATOM 1555 CD PRO A 95 -1.759 14.535 -23.741 1.00 0.00 C ATOM 0 HA PRO A 95 -3.744 15.292 -26.253 1.00 0.00 H new ATOM 0 HB2 PRO A 95 -1.169 16.114 -26.601 1.00 0.00 H new ATOM 0 HB3 PRO A 95 -2.123 16.836 -25.321 1.00 0.00 H new ATOM 0 HG2 PRO A 95 -0.104 14.585 -25.125 1.00 0.00 H new ATOM 0 HG3 PRO A 95 -0.239 16.018 -24.124 1.00 0.00 H new ATOM 0 HD2 PRO A 95 -1.296 13.640 -23.325 1.00 0.00 H new ATOM 0 HD3 PRO A 95 -2.061 15.158 -22.899 1.00 0.00 H new ATOM 1563 N ARG A 96 -2.291 14.351 -28.226 1.00 0.00 N ATOM 1564 CA ARG A 96 -2.003 13.495 -29.370 1.00 0.00 C ATOM 1565 C ARG A 96 -0.711 12.715 -29.163 1.00 0.00 C ATOM 1566 O ARG A 96 -0.626 11.535 -29.500 1.00 0.00 O ATOM 1567 CB ARG A 96 -1.896 14.320 -30.643 1.00 0.00 C ATOM 1568 CG ARG A 96 -3.211 14.897 -31.145 1.00 0.00 C ATOM 1569 CD ARG A 96 -3.017 15.736 -32.355 1.00 0.00 C ATOM 1570 NE ARG A 96 -4.271 16.292 -32.836 1.00 0.00 N ATOM 1571 CZ ARG A 96 -4.376 17.200 -33.826 1.00 0.00 C ATOM 1572 NH1 ARG A 96 -3.294 17.644 -34.428 1.00 0.00 N ATOM 1573 NH2 ARG A 96 -5.565 17.645 -34.191 1.00 0.00 N ATOM 0 H ARG A 96 -2.383 15.341 -28.454 1.00 0.00 H new ATOM 0 HA ARG A 96 -2.827 12.788 -29.466 1.00 0.00 H new ATOM 0 HB2 ARG A 96 -1.199 15.140 -30.470 1.00 0.00 H new ATOM 0 HB3 ARG A 96 -1.466 13.697 -31.427 1.00 0.00 H new ATOM 0 HG2 ARG A 96 -3.901 14.085 -31.372 1.00 0.00 H new ATOM 0 HG3 ARG A 96 -3.670 15.495 -30.358 1.00 0.00 H new ATOM 0 HD2 ARG A 96 -2.324 16.546 -32.128 1.00 0.00 H new ATOM 0 HD3 ARG A 96 -2.560 15.137 -33.143 1.00 0.00 H new ATOM 0 HE ARG A 96 -5.132 15.972 -32.393 1.00 0.00 H new ATOM 0 HH11 ARG A 96 -2.376 17.301 -34.145 1.00 0.00 H new ATOM 0 HH12 ARG A 96 -3.373 18.331 -35.177 1.00 0.00 H new ATOM 0 HH21 ARG A 96 -6.404 17.301 -33.723 1.00 0.00 H new ATOM 0 HH22 ARG A 96 -5.644 18.332 -34.940 1.00 0.00 H new ATOM 1587 N ASP A 97 0.294 13.383 -28.607 1.00 0.00 N ATOM 1588 CA ASP A 97 1.609 12.779 -28.428 1.00 0.00 C ATOM 1589 C ASP A 97 1.544 11.590 -27.478 1.00 0.00 C ATOM 1590 O ASP A 97 2.034 10.505 -27.792 1.00 0.00 O ATOM 1591 CB ASP A 97 2.605 13.812 -27.894 1.00 0.00 C ATOM 1592 CG ASP A 97 2.983 14.861 -28.931 1.00 0.00 C ATOM 1593 OD1 ASP A 97 2.725 14.642 -30.091 1.00 0.00 O ATOM 1594 OD2 ASP A 97 3.524 15.872 -28.553 1.00 0.00 O ATOM 0 H ASP A 97 0.223 14.344 -28.272 1.00 0.00 H new ATOM 0 HA ASP A 97 1.946 12.425 -29.402 1.00 0.00 H new ATOM 0 HB2 ASP A 97 2.175 14.307 -27.023 1.00 0.00 H new ATOM 0 HB3 ASP A 97 3.506 13.300 -27.557 1.00 0.00 H new ATOM 1599 N LEU A 98 0.936 11.800 -26.316 1.00 0.00 N ATOM 1600 CA LEU A 98 0.863 10.765 -25.291 1.00 0.00 C ATOM 1601 C LEU A 98 -0.205 9.731 -25.628 1.00 0.00 C ATOM 1602 O LEU A 98 -0.125 8.580 -25.199 1.00 0.00 O ATOM 1603 CB LEU A 98 0.562 11.393 -23.924 1.00 0.00 C ATOM 1604 CG LEU A 98 1.664 12.291 -23.348 1.00 0.00 C ATOM 1605 CD1 LEU A 98 1.213 12.852 -22.006 1.00 0.00 C ATOM 1606 CD2 LEU A 98 2.949 11.489 -23.202 1.00 0.00 C ATOM 0 H LEU A 98 0.486 12.679 -26.060 1.00 0.00 H new ATOM 0 HA LEU A 98 1.829 10.262 -25.254 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -0.353 11.980 -24.008 1.00 0.00 H new ATOM 0 HB3 LEU A 98 0.363 10.592 -23.212 1.00 0.00 H new ATOM 0 HG LEU A 98 1.855 13.126 -24.023 1.00 0.00 H new ATOM 0 HD11 LEU A 98 1.996 13.490 -21.597 1.00 0.00 H new ATOM 0 HD12 LEU A 98 0.303 13.437 -22.143 1.00 0.00 H new ATOM 0 HD13 LEU A 98 1.016 12.031 -21.316 1.00 0.00 H new ATOM 0 HD21 LEU A 98 3.732 12.127 -22.793 1.00 0.00 H new ATOM 0 HD22 LEU A 98 2.779 10.648 -22.530 1.00 0.00 H new ATOM 0 HD23 LEU A 98 3.258 11.116 -24.179 1.00 0.00 H new ATOM 1618 N LYS A 99 -1.204 10.149 -26.397 1.00 0.00 N ATOM 1619 CA LYS A 99 -2.218 9.231 -26.901 1.00 0.00 C ATOM 1620 C LYS A 99 -1.603 8.173 -27.807 1.00 0.00 C ATOM 1621 O LYS A 99 -1.949 6.994 -27.727 1.00 0.00 O ATOM 1622 CB LYS A 99 -3.309 9.997 -27.652 1.00 0.00 C ATOM 1623 CG LYS A 99 -4.469 9.134 -28.129 1.00 0.00 C ATOM 1624 CD LYS A 99 -5.494 9.959 -28.893 1.00 0.00 C ATOM 1625 CE LYS A 99 -6.295 10.852 -27.958 1.00 0.00 C ATOM 1626 NZ LYS A 99 -7.345 11.618 -28.683 1.00 0.00 N ATOM 0 H LYS A 99 -1.333 11.119 -26.685 1.00 0.00 H new ATOM 0 HA LYS A 99 -2.665 8.727 -26.044 1.00 0.00 H new ATOM 0 HB2 LYS A 99 -3.698 10.781 -27.002 1.00 0.00 H new ATOM 0 HB3 LYS A 99 -2.861 10.491 -28.514 1.00 0.00 H new ATOM 0 HG2 LYS A 99 -4.092 8.336 -28.768 1.00 0.00 H new ATOM 0 HG3 LYS A 99 -4.947 8.658 -27.273 1.00 0.00 H new ATOM 0 HD2 LYS A 99 -4.987 10.572 -29.639 1.00 0.00 H new ATOM 0 HD3 LYS A 99 -6.170 9.295 -29.432 1.00 0.00 H new ATOM 0 HE2 LYS A 99 -6.761 10.242 -27.184 1.00 0.00 H new ATOM 0 HE3 LYS A 99 -5.622 11.546 -27.455 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 -7.047 12.609 -28.780 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 -7.487 11.205 -29.627 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 -8.237 11.576 -28.149 1.00 0.00 H new ATOM 1640 N LYS A 100 -0.687 8.600 -28.670 1.00 0.00 N ATOM 1641 CA LYS A 100 0.044 7.678 -29.531 1.00 0.00 C ATOM 1642 C LYS A 100 0.909 6.729 -28.713 1.00 0.00 C ATOM 1643 O LYS A 100 0.934 5.524 -28.963 1.00 0.00 O ATOM 1644 CB LYS A 100 0.908 8.449 -30.530 1.00 0.00 C ATOM 1645 CG LYS A 100 0.122 9.161 -31.624 1.00 0.00 C ATOM 1646 CD LYS A 100 1.043 9.951 -32.541 1.00 0.00 C ATOM 1647 CE LYS A 100 0.258 10.680 -33.621 1.00 0.00 C ATOM 1648 NZ LYS A 100 1.144 11.480 -34.510 1.00 0.00 N ATOM 0 H LYS A 100 -0.433 9.580 -28.792 1.00 0.00 H new ATOM 0 HA LYS A 100 -0.687 7.084 -30.080 1.00 0.00 H new ATOM 0 HB2 LYS A 100 1.500 9.186 -29.987 1.00 0.00 H new ATOM 0 HB3 LYS A 100 1.609 7.757 -30.995 1.00 0.00 H new ATOM 0 HG2 LYS A 100 -0.436 8.430 -32.208 1.00 0.00 H new ATOM 0 HG3 LYS A 100 -0.608 9.832 -31.172 1.00 0.00 H new ATOM 0 HD2 LYS A 100 1.613 10.671 -31.954 1.00 0.00 H new ATOM 0 HD3 LYS A 100 1.763 9.277 -33.005 1.00 0.00 H new ATOM 0 HE2 LYS A 100 -0.296 9.956 -34.218 1.00 0.00 H new ATOM 0 HE3 LYS A 100 -0.476 11.337 -33.155 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 0.569 11.960 -35.232 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 1.654 12.189 -33.945 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 1.829 10.850 -34.975 1.00 0.00 H new ATOM 1662 N LYS A 101 1.620 7.280 -27.734 1.00 0.00 N ATOM 1663 CA LYS A 101 2.460 6.478 -26.852 1.00 0.00 C ATOM 1664 C LYS A 101 1.625 5.497 -26.039 1.00 0.00 C ATOM 1665 O LYS A 101 2.040 4.363 -25.800 1.00 0.00 O ATOM 1666 CB LYS A 101 3.271 7.379 -25.920 1.00 0.00 C ATOM 1667 CG LYS A 101 4.368 8.175 -26.612 1.00 0.00 C ATOM 1668 CD LYS A 101 5.126 9.048 -25.623 1.00 0.00 C ATOM 1669 CE LYS A 101 6.205 9.865 -26.317 1.00 0.00 C ATOM 1670 NZ LYS A 101 6.940 10.741 -25.365 1.00 0.00 N ATOM 0 H LYS A 101 1.631 8.280 -27.532 1.00 0.00 H new ATOM 0 HA LYS A 101 3.147 5.905 -27.475 1.00 0.00 H new ATOM 0 HB2 LYS A 101 2.592 8.074 -25.425 1.00 0.00 H new ATOM 0 HB3 LYS A 101 3.722 6.764 -25.141 1.00 0.00 H new ATOM 0 HG2 LYS A 101 5.061 7.492 -27.103 1.00 0.00 H new ATOM 0 HG3 LYS A 101 3.931 8.800 -27.391 1.00 0.00 H new ATOM 0 HD2 LYS A 101 4.429 9.717 -25.118 1.00 0.00 H new ATOM 0 HD3 LYS A 101 5.580 8.421 -24.855 1.00 0.00 H new ATOM 0 HE2 LYS A 101 6.909 9.193 -26.808 1.00 0.00 H new ATOM 0 HE3 LYS A 101 5.751 10.477 -27.096 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 7.666 11.280 -25.879 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 6.274 11.400 -24.914 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 7.395 10.156 -24.635 1.00 0.00 H new ATOM 1684 N LEU A 102 0.447 5.940 -25.614 1.00 0.00 N ATOM 1685 CA LEU A 102 -0.493 5.071 -24.918 1.00 0.00 C ATOM 1686 C LEU A 102 -0.897 3.887 -25.787 1.00 0.00 C ATOM 1687 O LEU A 102 -0.867 2.739 -25.342 1.00 0.00 O ATOM 1688 CB LEU A 102 -1.742 5.861 -24.507 1.00 0.00 C ATOM 1689 CG LEU A 102 -2.884 5.034 -23.901 1.00 0.00 C ATOM 1690 CD1 LEU A 102 -2.390 4.332 -22.644 1.00 0.00 C ATOM 1691 CD2 LEU A 102 -4.062 5.945 -23.592 1.00 0.00 C ATOM 0 H LEU A 102 0.120 6.898 -25.740 1.00 0.00 H new ATOM 0 HA LEU A 102 0.004 4.689 -24.026 1.00 0.00 H new ATOM 0 HB2 LEU A 102 -1.446 6.622 -23.785 1.00 0.00 H new ATOM 0 HB3 LEU A 102 -2.123 6.384 -25.384 1.00 0.00 H new ATOM 0 HG LEU A 102 -3.214 4.276 -24.611 1.00 0.00 H new ATOM 0 HD11 LEU A 102 -3.201 3.744 -22.213 1.00 0.00 H new ATOM 0 HD12 LEU A 102 -1.559 3.673 -22.898 1.00 0.00 H new ATOM 0 HD13 LEU A 102 -2.056 5.075 -21.920 1.00 0.00 H new ATOM 0 HD21 LEU A 102 -4.873 5.358 -23.162 1.00 0.00 H new ATOM 0 HD22 LEU A 102 -3.753 6.712 -22.882 1.00 0.00 H new ATOM 0 HD23 LEU A 102 -4.406 6.420 -24.511 1.00 0.00 H new ATOM 1703 N SER A 103 -1.274 4.172 -27.028 1.00 0.00 N ATOM 1704 CA SER A 103 -1.724 3.136 -27.950 1.00 0.00 C ATOM 1705 C SER A 103 -0.627 2.110 -28.203 1.00 0.00 C ATOM 1706 O SER A 103 -0.906 0.938 -28.458 1.00 0.00 O ATOM 1707 CB SER A 103 -2.160 3.757 -29.262 1.00 0.00 C ATOM 1708 OG SER A 103 -1.061 4.263 -29.968 1.00 0.00 O ATOM 0 H SER A 103 -1.277 5.114 -27.420 1.00 0.00 H new ATOM 0 HA SER A 103 -2.572 2.625 -27.493 1.00 0.00 H new ATOM 0 HB2 SER A 103 -2.674 3.011 -29.868 1.00 0.00 H new ATOM 0 HB3 SER A 103 -2.873 4.558 -29.070 1.00 0.00 H new ATOM 0 HG SER A 103 -0.354 4.513 -29.337 1.00 0.00 H new ATOM 1714 N ARG A 104 0.622 2.558 -28.132 1.00 0.00 N ATOM 1715 CA ARG A 104 1.765 1.658 -28.228 1.00 0.00 C ATOM 1716 C ARG A 104 1.835 0.725 -27.026 1.00 0.00 C ATOM 1717 O ARG A 104 2.082 -0.473 -27.171 1.00 0.00 O ATOM 1718 CB ARG A 104 3.062 2.448 -28.329 1.00 0.00 C ATOM 1719 CG ARG A 104 3.267 3.174 -29.649 1.00 0.00 C ATOM 1720 CD ARG A 104 4.518 3.976 -29.646 1.00 0.00 C ATOM 1721 NE ARG A 104 4.722 4.668 -30.908 1.00 0.00 N ATOM 1722 CZ ARG A 104 5.729 5.527 -31.156 1.00 0.00 C ATOM 1723 NH1 ARG A 104 6.615 5.789 -30.220 1.00 0.00 N ATOM 1724 NH2 ARG A 104 5.828 6.107 -32.339 1.00 0.00 N ATOM 0 H ARG A 104 0.868 3.540 -28.008 1.00 0.00 H new ATOM 0 HA ARG A 104 1.635 1.059 -29.129 1.00 0.00 H new ATOM 0 HB2 ARG A 104 3.089 3.179 -27.521 1.00 0.00 H new ATOM 0 HB3 ARG A 104 3.899 1.767 -28.172 1.00 0.00 H new ATOM 0 HG2 ARG A 104 3.302 2.449 -30.462 1.00 0.00 H new ATOM 0 HG3 ARG A 104 2.416 3.828 -29.841 1.00 0.00 H new ATOM 0 HD2 ARG A 104 4.481 4.703 -28.835 1.00 0.00 H new ATOM 0 HD3 ARG A 104 5.368 3.322 -29.449 1.00 0.00 H new ATOM 0 HE ARG A 104 4.055 4.490 -31.659 1.00 0.00 H new ATOM 0 HH11 ARG A 104 6.539 5.342 -29.307 1.00 0.00 H new ATOM 0 HH12 ARG A 104 7.378 6.440 -30.408 1.00 0.00 H new ATOM 0 HH21 ARG A 104 5.141 5.904 -33.065 1.00 0.00 H new ATOM 0 HH22 ARG A 104 6.591 6.758 -32.526 1.00 0.00 H new ATOM 1738 N VAL A 105 1.616 1.280 -25.839 1.00 0.00 N ATOM 1739 CA VAL A 105 1.559 0.483 -24.620 1.00 0.00 C ATOM 1740 C VAL A 105 0.463 -0.571 -24.700 1.00 0.00 C ATOM 1741 O VAL A 105 0.676 -1.730 -24.345 1.00 0.00 O ATOM 1742 CB VAL A 105 1.307 1.390 -23.400 1.00 0.00 C ATOM 1743 CG1 VAL A 105 0.996 0.552 -22.169 1.00 0.00 C ATOM 1744 CG2 VAL A 105 2.517 2.278 -23.156 1.00 0.00 C ATOM 0 H VAL A 105 1.475 2.280 -25.695 1.00 0.00 H new ATOM 0 HA VAL A 105 2.519 -0.021 -24.509 1.00 0.00 H new ATOM 0 HB VAL A 105 0.444 2.025 -23.603 1.00 0.00 H new ATOM 0 HG11 VAL A 105 0.821 1.209 -21.317 1.00 0.00 H new ATOM 0 HG12 VAL A 105 0.105 -0.049 -22.353 1.00 0.00 H new ATOM 0 HG13 VAL A 105 1.839 -0.105 -21.954 1.00 0.00 H new ATOM 0 HG21 VAL A 105 2.332 2.916 -22.292 1.00 0.00 H new ATOM 0 HG22 VAL A 105 3.392 1.656 -22.967 1.00 0.00 H new ATOM 0 HG23 VAL A 105 2.696 2.899 -24.034 1.00 0.00 H new ATOM 1754 N VAL A 106 -0.711 -0.162 -25.170 1.00 0.00 N ATOM 1755 CA VAL A 106 -1.844 -1.070 -25.295 1.00 0.00 C ATOM 1756 C VAL A 106 -1.551 -2.182 -26.295 1.00 0.00 C ATOM 1757 O VAL A 106 -1.868 -3.347 -26.053 1.00 0.00 O ATOM 1758 CB VAL A 106 -3.100 -0.299 -25.744 1.00 0.00 C ATOM 1759 CG1 VAL A 106 -4.232 -1.264 -26.063 1.00 0.00 C ATOM 1760 CG2 VAL A 106 -3.518 0.684 -24.661 1.00 0.00 C ATOM 0 H VAL A 106 -0.902 0.794 -25.471 1.00 0.00 H new ATOM 0 HA VAL A 106 -2.019 -1.517 -24.317 1.00 0.00 H new ATOM 0 HB VAL A 106 -2.867 0.259 -26.651 1.00 0.00 H new ATOM 0 HG11 VAL A 106 -5.111 -0.702 -26.378 1.00 0.00 H new ATOM 0 HG12 VAL A 106 -3.923 -1.935 -26.865 1.00 0.00 H new ATOM 0 HG13 VAL A 106 -4.474 -1.848 -25.175 1.00 0.00 H new ATOM 0 HG21 VAL A 106 -4.407 1.226 -24.985 1.00 0.00 H new ATOM 0 HG22 VAL A 106 -3.739 0.141 -23.742 1.00 0.00 H new ATOM 0 HG23 VAL A 106 -2.708 1.391 -24.479 1.00 0.00 H new ATOM 1770 N ASN A 107 -0.944 -1.816 -27.418 1.00 0.00 N ATOM 1771 CA ASN A 107 -0.569 -2.788 -28.438 1.00 0.00 C ATOM 1772 C ASN A 107 0.404 -3.820 -27.884 1.00 0.00 C ATOM 1773 O ASN A 107 0.299 -5.010 -28.184 1.00 0.00 O ATOM 1774 CB ASN A 107 0.024 -2.090 -29.648 1.00 0.00 C ATOM 1775 CG ASN A 107 -1.016 -1.398 -30.485 1.00 0.00 C ATOM 1776 OD1 ASN A 107 -2.209 -1.713 -30.400 1.00 0.00 O ATOM 1777 ND2 ASN A 107 -0.588 -0.461 -31.292 1.00 0.00 N ATOM 0 H ASN A 107 -0.701 -0.852 -27.645 1.00 0.00 H new ATOM 0 HA ASN A 107 -1.472 -3.313 -28.749 1.00 0.00 H new ATOM 0 HB2 ASN A 107 0.762 -1.360 -29.316 1.00 0.00 H new ATOM 0 HB3 ASN A 107 0.552 -2.820 -30.262 1.00 0.00 H new ATOM 0 HD21 ASN A 107 -1.248 0.043 -31.884 1.00 0.00 H new ATOM 0 HD22 ASN A 107 0.406 -0.235 -31.329 1.00 0.00 H new ATOM 1784 N ILE A 108 1.351 -3.359 -27.074 1.00 0.00 N ATOM 1785 CA ILE A 108 2.296 -4.251 -26.414 1.00 0.00 C ATOM 1786 C ILE A 108 1.577 -5.246 -25.513 1.00 0.00 C ATOM 1787 O ILE A 108 1.873 -6.441 -25.531 1.00 0.00 O ATOM 1788 CB ILE A 108 3.318 -3.452 -25.585 1.00 0.00 C ATOM 1789 CG1 ILE A 108 4.256 -2.667 -26.506 1.00 0.00 C ATOM 1790 CG2 ILE A 108 4.111 -4.382 -24.679 1.00 0.00 C ATOM 1791 CD1 ILE A 108 5.081 -1.622 -25.790 1.00 0.00 C ATOM 0 H ILE A 108 1.484 -2.371 -26.859 1.00 0.00 H new ATOM 0 HA ILE A 108 2.822 -4.801 -27.194 1.00 0.00 H new ATOM 0 HB ILE A 108 2.778 -2.742 -24.959 1.00 0.00 H new ATOM 0 HG12 ILE A 108 4.927 -3.365 -27.007 1.00 0.00 H new ATOM 0 HG13 ILE A 108 3.665 -2.181 -27.282 1.00 0.00 H new ATOM 0 HG21 ILE A 108 4.829 -3.801 -24.100 1.00 0.00 H new ATOM 0 HG22 ILE A 108 3.430 -4.897 -24.001 1.00 0.00 H new ATOM 0 HG23 ILE A 108 4.643 -5.115 -25.286 1.00 0.00 H new ATOM 0 HD11 ILE A 108 5.720 -1.108 -26.508 1.00 0.00 H new ATOM 0 HD12 ILE A 108 4.419 -0.900 -25.312 1.00 0.00 H new ATOM 0 HD13 ILE A 108 5.700 -2.103 -25.033 1.00 0.00 H new ATOM 1803 N LEU A 109 0.631 -4.747 -24.725 1.00 0.00 N ATOM 1804 CA LEU A 109 -0.135 -5.592 -23.816 1.00 0.00 C ATOM 1805 C LEU A 109 -0.915 -6.655 -24.579 1.00 0.00 C ATOM 1806 O LEU A 109 -1.009 -7.803 -24.144 1.00 0.00 O ATOM 1807 CB LEU A 109 -1.101 -4.738 -22.985 1.00 0.00 C ATOM 1808 CG LEU A 109 -0.445 -3.768 -21.994 1.00 0.00 C ATOM 1809 CD1 LEU A 109 -1.505 -2.839 -21.417 1.00 0.00 C ATOM 1810 CD2 LEU A 109 0.248 -4.556 -20.894 1.00 0.00 C ATOM 0 H LEU A 109 0.376 -3.760 -24.697 1.00 0.00 H new ATOM 0 HA LEU A 109 0.569 -6.092 -23.151 1.00 0.00 H new ATOM 0 HB2 LEU A 109 -1.728 -4.163 -23.667 1.00 0.00 H new ATOM 0 HB3 LEU A 109 -1.761 -5.405 -22.430 1.00 0.00 H new ATOM 0 HG LEU A 109 0.303 -3.162 -22.505 1.00 0.00 H new ATOM 0 HD11 LEU A 109 -1.040 -2.149 -20.713 1.00 0.00 H new ATOM 0 HD12 LEU A 109 -1.972 -2.274 -22.224 1.00 0.00 H new ATOM 0 HD13 LEU A 109 -2.263 -3.428 -20.901 1.00 0.00 H new ATOM 0 HD21 LEU A 109 0.714 -3.866 -20.190 1.00 0.00 H new ATOM 0 HD22 LEU A 109 -0.484 -5.170 -20.369 1.00 0.00 H new ATOM 0 HD23 LEU A 109 1.012 -5.198 -21.332 1.00 0.00 H new ATOM 1822 N LYS A 110 -1.475 -6.266 -25.720 1.00 0.00 N ATOM 1823 CA LYS A 110 -2.262 -7.181 -26.538 1.00 0.00 C ATOM 1824 C LYS A 110 -1.372 -8.202 -27.235 1.00 0.00 C ATOM 1825 O LYS A 110 -1.622 -9.405 -27.169 1.00 0.00 O ATOM 1826 CB LYS A 110 -3.081 -6.406 -27.572 1.00 0.00 C ATOM 1827 CG LYS A 110 -3.971 -7.275 -28.450 1.00 0.00 C ATOM 1828 CD LYS A 110 -4.826 -6.428 -29.380 1.00 0.00 C ATOM 1829 CE LYS A 110 -5.740 -7.294 -30.235 1.00 0.00 C ATOM 1830 NZ LYS A 110 -6.593 -6.478 -31.141 1.00 0.00 N ATOM 0 H LYS A 110 -1.398 -5.322 -26.099 1.00 0.00 H new ATOM 0 HA LYS A 110 -2.942 -7.717 -25.876 1.00 0.00 H new ATOM 0 HB2 LYS A 110 -3.704 -5.678 -27.052 1.00 0.00 H new ATOM 0 HB3 LYS A 110 -2.399 -5.844 -28.210 1.00 0.00 H new ATOM 0 HG2 LYS A 110 -3.354 -7.954 -29.038 1.00 0.00 H new ATOM 0 HG3 LYS A 110 -4.614 -7.892 -27.822 1.00 0.00 H new ATOM 0 HD2 LYS A 110 -5.426 -5.732 -28.793 1.00 0.00 H new ATOM 0 HD3 LYS A 110 -4.182 -5.829 -30.024 1.00 0.00 H new ATOM 0 HE2 LYS A 110 -5.137 -7.983 -30.827 1.00 0.00 H new ATOM 0 HE3 LYS A 110 -6.374 -7.900 -29.588 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 -7.176 -7.107 -31.729 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 -7.211 -5.863 -30.575 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 -5.989 -5.893 -31.753 1.00 0.00 H new ATOM 1844 N GLU A 111 -0.331 -7.715 -27.902 1.00 0.00 N ATOM 1845 CA GLU A 111 0.516 -8.566 -28.728 1.00 0.00 C ATOM 1846 C GLU A 111 1.239 -9.609 -27.884 1.00 0.00 C ATOM 1847 O GLU A 111 1.451 -10.739 -28.324 1.00 0.00 O ATOM 1848 CB GLU A 111 1.536 -7.721 -29.495 1.00 0.00 C ATOM 1849 CG GLU A 111 0.939 -6.877 -30.612 1.00 0.00 C ATOM 1850 CD GLU A 111 1.952 -5.986 -31.276 1.00 0.00 C ATOM 1851 OE1 GLU A 111 3.091 -6.014 -30.878 1.00 0.00 O ATOM 1852 OE2 GLU A 111 1.585 -5.277 -32.183 1.00 0.00 O ATOM 0 H GLU A 111 -0.054 -6.734 -27.886 1.00 0.00 H new ATOM 0 HA GLU A 111 -0.127 -9.085 -29.439 1.00 0.00 H new ATOM 0 HB2 GLU A 111 2.047 -7.063 -28.792 1.00 0.00 H new ATOM 0 HB3 GLU A 111 2.292 -8.382 -29.920 1.00 0.00 H new ATOM 0 HG2 GLU A 111 0.495 -7.534 -31.360 1.00 0.00 H new ATOM 0 HG3 GLU A 111 0.133 -6.264 -30.207 1.00 0.00 H new ATOM 1859 N ARG A 112 1.614 -9.223 -26.669 1.00 0.00 N ATOM 1860 CA ARG A 112 2.338 -10.114 -25.772 1.00 0.00 C ATOM 1861 C ARG A 112 1.380 -10.954 -24.937 1.00 0.00 C ATOM 1862 O ARG A 112 1.803 -11.722 -24.074 1.00 0.00 O ATOM 1863 CB ARG A 112 3.248 -9.319 -24.847 1.00 0.00 C ATOM 1864 CG ARG A 112 4.397 -8.604 -25.540 1.00 0.00 C ATOM 1865 CD ARG A 112 5.301 -7.943 -24.564 1.00 0.00 C ATOM 1866 NE ARG A 112 6.398 -7.252 -25.222 1.00 0.00 N ATOM 1867 CZ ARG A 112 7.378 -6.587 -24.581 1.00 0.00 C ATOM 1868 NH1 ARG A 112 7.385 -6.533 -23.267 1.00 0.00 N ATOM 1869 NH2 ARG A 112 8.333 -5.989 -25.272 1.00 0.00 N ATOM 0 H ARG A 112 1.428 -8.297 -26.283 1.00 0.00 H new ATOM 0 HA ARG A 112 2.941 -10.780 -26.389 1.00 0.00 H new ATOM 0 HB2 ARG A 112 2.647 -8.581 -24.316 1.00 0.00 H new ATOM 0 HB3 ARG A 112 3.659 -9.994 -24.097 1.00 0.00 H new ATOM 0 HG2 ARG A 112 4.965 -9.319 -26.135 1.00 0.00 H new ATOM 0 HG3 ARG A 112 3.999 -7.860 -26.230 1.00 0.00 H new ATOM 0 HD2 ARG A 112 4.731 -7.232 -23.965 1.00 0.00 H new ATOM 0 HD3 ARG A 112 5.702 -8.689 -23.877 1.00 0.00 H new ATOM 0 HE ARG A 112 6.427 -7.272 -26.241 1.00 0.00 H new ATOM 0 HH11 ARG A 112 6.648 -6.995 -22.734 1.00 0.00 H new ATOM 0 HH12 ARG A 112 8.127 -6.029 -22.781 1.00 0.00 H new ATOM 0 HH21 ARG A 112 8.328 -6.031 -26.291 1.00 0.00 H new ATOM 0 HH22 ARG A 112 9.075 -5.485 -24.786 1.00 0.00 H new ATOM 1883 N ASN A 113 0.086 -10.802 -25.200 1.00 0.00 N ATOM 1884 CA ASN A 113 -0.932 -11.592 -24.518 1.00 0.00 C ATOM 1885 C ASN A 113 -0.815 -11.453 -23.005 1.00 0.00 C ATOM 1886 O ASN A 113 -0.901 -12.439 -22.274 1.00 0.00 O ATOM 1887 CB ASN A 113 -0.841 -13.050 -24.929 1.00 0.00 C ATOM 1888 CG ASN A 113 -1.132 -13.258 -26.390 1.00 0.00 C ATOM 1889 OD1 ASN A 113 -2.075 -12.674 -26.936 1.00 0.00 O ATOM 1890 ND2 ASN A 113 -0.341 -14.078 -27.032 1.00 0.00 N ATOM 0 H ASN A 113 -0.282 -10.138 -25.881 1.00 0.00 H new ATOM 0 HA ASN A 113 -1.908 -11.209 -24.815 1.00 0.00 H new ATOM 0 HB2 ASN A 113 0.157 -13.425 -24.704 1.00 0.00 H new ATOM 0 HB3 ASN A 113 -1.543 -13.636 -24.335 1.00 0.00 H new ATOM 0 HD21 ASN A 113 -0.490 -14.258 -28.025 1.00 0.00 H new ATOM 0 HD22 ASN A 113 0.425 -14.538 -26.540 1.00 0.00 H new ATOM 1897 N ILE A 114 -0.619 -10.224 -22.542 1.00 0.00 N ATOM 1898 CA ILE A 114 -0.449 -9.959 -21.119 1.00 0.00 C ATOM 1899 C ILE A 114 -1.739 -10.218 -20.352 1.00 0.00 C ATOM 1900 O ILE A 114 -1.724 -10.814 -19.275 1.00 0.00 O ATOM 1901 CB ILE A 114 0.008 -8.508 -20.880 1.00 0.00 C ATOM 1902 CG1 ILE A 114 1.386 -8.273 -21.505 1.00 0.00 C ATOM 1903 CG2 ILE A 114 0.035 -8.197 -19.392 1.00 0.00 C ATOM 1904 CD1 ILE A 114 2.470 -9.166 -20.947 1.00 0.00 C ATOM 0 H ILE A 114 -0.574 -9.394 -23.133 1.00 0.00 H new ATOM 0 HA ILE A 114 0.320 -10.640 -20.753 1.00 0.00 H new ATOM 0 HB ILE A 114 -0.706 -7.836 -21.357 1.00 0.00 H new ATOM 0 HG12 ILE A 114 1.318 -8.430 -22.582 1.00 0.00 H new ATOM 0 HG13 ILE A 114 1.671 -7.232 -21.352 1.00 0.00 H new ATOM 0 HG21 ILE A 114 0.360 -7.168 -19.241 1.00 0.00 H new ATOM 0 HG22 ILE A 114 -0.964 -8.327 -18.975 1.00 0.00 H new ATOM 0 HG23 ILE A 114 0.728 -8.873 -18.891 1.00 0.00 H new ATOM 0 HD11 ILE A 114 3.416 -8.940 -21.439 1.00 0.00 H new ATOM 0 HD12 ILE A 114 2.568 -8.993 -19.875 1.00 0.00 H new ATOM 0 HD13 ILE A 114 2.209 -10.209 -21.124 1.00 0.00 H new ATOM 1916 N PHE A 115 -2.856 -9.767 -20.914 1.00 0.00 N ATOM 1917 CA PHE A 115 -4.161 -9.974 -20.298 1.00 0.00 C ATOM 1918 C PHE A 115 -5.036 -10.882 -21.152 1.00 0.00 C ATOM 1919 O PHE A 115 -4.686 -11.210 -22.286 1.00 0.00 O ATOM 1920 CB PHE A 115 -4.867 -8.634 -20.081 1.00 0.00 C ATOM 1921 CG PHE A 115 -4.107 -7.684 -19.200 1.00 0.00 C ATOM 1922 CD1 PHE A 115 -3.956 -7.942 -17.846 1.00 0.00 C ATOM 1923 CD2 PHE A 115 -3.543 -6.530 -19.723 1.00 0.00 C ATOM 1924 CE1 PHE A 115 -3.257 -7.068 -17.034 1.00 0.00 C ATOM 1925 CE2 PHE A 115 -2.843 -5.656 -18.915 1.00 0.00 C ATOM 1926 CZ PHE A 115 -2.700 -5.926 -17.568 1.00 0.00 C ATOM 0 H PHE A 115 -2.883 -9.255 -21.796 1.00 0.00 H new ATOM 0 HA PHE A 115 -4.000 -10.457 -19.334 1.00 0.00 H new ATOM 0 HB2 PHE A 115 -5.035 -8.162 -21.049 1.00 0.00 H new ATOM 0 HB3 PHE A 115 -5.847 -8.817 -19.641 1.00 0.00 H new ATOM 0 HD1 PHE A 115 -4.389 -8.835 -17.421 1.00 0.00 H new ATOM 0 HD2 PHE A 115 -3.653 -6.312 -20.775 1.00 0.00 H new ATOM 0 HE1 PHE A 115 -3.147 -7.280 -15.981 1.00 0.00 H new ATOM 0 HE2 PHE A 115 -2.408 -4.762 -19.336 1.00 0.00 H new ATOM 0 HZ PHE A 115 -2.153 -5.244 -16.934 1.00 0.00 H new ATOM 1936 N SER A 116 -6.175 -11.286 -20.601 1.00 0.00 N ATOM 1937 CA SER A 116 -7.115 -12.138 -21.321 1.00 0.00 C ATOM 1938 C SER A 116 -7.797 -11.375 -22.449 1.00 0.00 C ATOM 1939 O SER A 116 -7.798 -10.144 -22.467 1.00 0.00 O ATOM 1940 CB SER A 116 -8.157 -12.688 -20.367 1.00 0.00 C ATOM 1941 OG SER A 116 -9.019 -11.675 -19.926 1.00 0.00 O ATOM 0 H SER A 116 -6.470 -11.037 -19.657 1.00 0.00 H new ATOM 0 HA SER A 116 -6.554 -12.964 -21.758 1.00 0.00 H new ATOM 0 HB2 SER A 116 -8.732 -13.470 -20.863 1.00 0.00 H new ATOM 0 HB3 SER A 116 -7.664 -13.149 -19.511 1.00 0.00 H new ATOM 0 HG SER A 116 -9.683 -12.054 -19.313 1.00 0.00 H new ATOM 1947 N LYS A 117 -8.377 -12.113 -23.389 1.00 0.00 N ATOM 1948 CA LYS A 117 -9.076 -11.507 -24.516 1.00 0.00 C ATOM 1949 C LYS A 117 -10.243 -10.649 -24.044 1.00 0.00 C ATOM 1950 O LYS A 117 -10.553 -9.621 -24.645 1.00 0.00 O ATOM 1951 CB LYS A 117 -9.573 -12.585 -25.481 1.00 0.00 C ATOM 1952 CG LYS A 117 -8.470 -13.288 -26.260 1.00 0.00 C ATOM 1953 CD LYS A 117 -9.040 -14.356 -27.182 1.00 0.00 C ATOM 1954 CE LYS A 117 -7.939 -15.066 -27.956 1.00 0.00 C ATOM 1955 NZ LYS A 117 -8.478 -16.140 -28.833 1.00 0.00 N ATOM 0 H LYS A 117 -8.377 -13.133 -23.393 1.00 0.00 H new ATOM 0 HA LYS A 117 -8.369 -10.863 -25.039 1.00 0.00 H new ATOM 0 HB2 LYS A 117 -10.134 -13.330 -24.917 1.00 0.00 H new ATOM 0 HB3 LYS A 117 -10.267 -12.131 -26.188 1.00 0.00 H new ATOM 0 HG2 LYS A 117 -7.913 -12.557 -26.847 1.00 0.00 H new ATOM 0 HG3 LYS A 117 -7.764 -13.743 -25.565 1.00 0.00 H new ATOM 0 HD2 LYS A 117 -9.602 -15.083 -26.596 1.00 0.00 H new ATOM 0 HD3 LYS A 117 -9.742 -13.899 -27.880 1.00 0.00 H new ATOM 0 HE2 LYS A 117 -7.397 -14.341 -28.563 1.00 0.00 H new ATOM 0 HE3 LYS A 117 -7.222 -15.495 -27.256 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 -7.695 -16.598 -29.342 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 -8.974 -16.846 -28.252 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 -9.142 -15.728 -29.519 1.00 0.00 H new ATOM 1969 N GLN A 118 -10.886 -11.077 -22.963 1.00 0.00 N ATOM 1970 CA GLN A 118 -11.951 -10.296 -22.346 1.00 0.00 C ATOM 1971 C GLN A 118 -11.452 -8.920 -21.923 1.00 0.00 C ATOM 1972 O GLN A 118 -12.072 -7.902 -22.232 1.00 0.00 O ATOM 1973 CB GLN A 118 -12.528 -11.037 -21.136 1.00 0.00 C ATOM 1974 CG GLN A 118 -13.618 -10.276 -20.401 1.00 0.00 C ATOM 1975 CD GLN A 118 -14.864 -10.089 -21.247 1.00 0.00 C ATOM 1976 OE1 GLN A 118 -15.345 -11.030 -21.884 1.00 0.00 O ATOM 1977 NE2 GLN A 118 -15.394 -8.872 -21.257 1.00 0.00 N ATOM 0 H GLN A 118 -10.688 -11.962 -22.496 1.00 0.00 H new ATOM 0 HA GLN A 118 -12.737 -10.162 -23.089 1.00 0.00 H new ATOM 0 HB2 GLN A 118 -12.930 -11.994 -21.468 1.00 0.00 H new ATOM 0 HB3 GLN A 118 -11.719 -11.255 -20.438 1.00 0.00 H new ATOM 0 HG2 GLN A 118 -13.879 -10.812 -19.488 1.00 0.00 H new ATOM 0 HG3 GLN A 118 -13.237 -9.300 -20.100 1.00 0.00 H new ATOM 0 HE21 GLN A 118 -14.963 -8.123 -20.715 1.00 0.00 H new ATOM 0 HE22 GLN A 118 -16.233 -8.685 -21.807 1.00 0.00 H new ATOM 1986 N VAL A 119 -10.329 -8.896 -21.215 1.00 0.00 N ATOM 1987 CA VAL A 119 -9.742 -7.644 -20.752 1.00 0.00 C ATOM 1988 C VAL A 119 -9.344 -6.755 -21.923 1.00 0.00 C ATOM 1989 O VAL A 119 -9.625 -5.557 -21.929 1.00 0.00 O ATOM 1990 CB VAL A 119 -8.502 -7.925 -19.881 1.00 0.00 C ATOM 1991 CG1 VAL A 119 -7.756 -6.632 -19.585 1.00 0.00 C ATOM 1992 CG2 VAL A 119 -8.921 -8.614 -18.591 1.00 0.00 C ATOM 0 H VAL A 119 -9.806 -9.730 -20.949 1.00 0.00 H new ATOM 0 HA VAL A 119 -10.496 -7.125 -20.160 1.00 0.00 H new ATOM 0 HB VAL A 119 -7.828 -8.586 -20.426 1.00 0.00 H new ATOM 0 HG11 VAL A 119 -6.883 -6.848 -18.969 1.00 0.00 H new ATOM 0 HG12 VAL A 119 -7.435 -6.175 -20.521 1.00 0.00 H new ATOM 0 HG13 VAL A 119 -8.415 -5.946 -19.053 1.00 0.00 H new ATOM 0 HG21 VAL A 119 -8.040 -8.810 -17.980 1.00 0.00 H new ATOM 0 HG22 VAL A 119 -9.608 -7.970 -18.041 1.00 0.00 H new ATOM 0 HG23 VAL A 119 -9.416 -9.556 -18.826 1.00 0.00 H new ATOM 2002 N VAL A 120 -8.690 -7.350 -22.915 1.00 0.00 N ATOM 2003 CA VAL A 120 -8.238 -6.609 -24.087 1.00 0.00 C ATOM 2004 C VAL A 120 -9.408 -5.958 -24.813 1.00 0.00 C ATOM 2005 O VAL A 120 -9.341 -4.791 -25.197 1.00 0.00 O ATOM 2006 CB VAL A 120 -7.493 -7.546 -25.056 1.00 0.00 C ATOM 2007 CG1 VAL A 120 -7.235 -6.845 -26.382 1.00 0.00 C ATOM 2008 CG2 VAL A 120 -6.187 -8.010 -24.429 1.00 0.00 C ATOM 0 H VAL A 120 -8.461 -8.344 -22.931 1.00 0.00 H new ATOM 0 HA VAL A 120 -7.562 -5.826 -23.743 1.00 0.00 H new ATOM 0 HB VAL A 120 -8.115 -8.419 -25.250 1.00 0.00 H new ATOM 0 HG11 VAL A 120 -6.708 -7.522 -27.055 1.00 0.00 H new ATOM 0 HG12 VAL A 120 -8.185 -6.554 -26.831 1.00 0.00 H new ATOM 0 HG13 VAL A 120 -6.627 -5.956 -26.212 1.00 0.00 H new ATOM 0 HG21 VAL A 120 -5.666 -8.672 -25.121 1.00 0.00 H new ATOM 0 HG22 VAL A 120 -5.560 -7.145 -24.213 1.00 0.00 H new ATOM 0 HG23 VAL A 120 -6.398 -8.546 -23.503 1.00 0.00 H new ATOM 2018 N ASN A 121 -10.481 -6.720 -24.997 1.00 0.00 N ATOM 2019 CA ASN A 121 -11.678 -6.211 -25.656 1.00 0.00 C ATOM 2020 C ASN A 121 -12.295 -5.064 -24.867 1.00 0.00 C ATOM 2021 O ASN A 121 -12.755 -4.078 -25.443 1.00 0.00 O ATOM 2022 CB ASN A 121 -12.689 -7.324 -25.860 1.00 0.00 C ATOM 2023 CG ASN A 121 -12.285 -8.279 -26.949 1.00 0.00 C ATOM 2024 OD1 ASN A 121 -11.449 -7.953 -27.799 1.00 0.00 O ATOM 2025 ND2 ASN A 121 -12.863 -9.454 -26.940 1.00 0.00 N ATOM 0 H ASN A 121 -10.546 -7.693 -24.699 1.00 0.00 H new ATOM 0 HA ASN A 121 -11.385 -5.826 -26.633 1.00 0.00 H new ATOM 0 HB2 ASN A 121 -12.812 -7.874 -24.927 1.00 0.00 H new ATOM 0 HB3 ASN A 121 -13.658 -6.889 -26.104 1.00 0.00 H new ATOM 0 HD21 ASN A 121 -12.628 -10.143 -27.654 1.00 0.00 H new ATOM 0 HD22 ASN A 121 -13.548 -9.680 -26.219 1.00 0.00 H new ATOM 2032 N ASP A 122 -12.303 -5.199 -23.545 1.00 0.00 N ATOM 2033 CA ASP A 122 -12.831 -4.158 -22.671 1.00 0.00 C ATOM 2034 C ASP A 122 -11.978 -2.897 -22.739 1.00 0.00 C ATOM 2035 O ASP A 122 -12.498 -1.782 -22.709 1.00 0.00 O ATOM 2036 CB ASP A 122 -12.903 -4.655 -21.226 1.00 0.00 C ATOM 2037 CG ASP A 122 -14.002 -5.688 -21.009 1.00 0.00 C ATOM 2038 OD1 ASP A 122 -14.941 -5.695 -21.768 1.00 0.00 O ATOM 2039 OD2 ASP A 122 -13.891 -6.458 -20.085 1.00 0.00 O ATOM 0 H ASP A 122 -11.949 -6.021 -23.055 1.00 0.00 H new ATOM 0 HA ASP A 122 -13.836 -3.915 -23.016 1.00 0.00 H new ATOM 0 HB2 ASP A 122 -11.943 -5.090 -20.948 1.00 0.00 H new ATOM 0 HB3 ASP A 122 -13.073 -3.807 -20.563 1.00 0.00 H new ATOM 2044 N ILE A 123 -10.666 -3.081 -22.830 1.00 0.00 N ATOM 2045 CA ILE A 123 -9.746 -1.964 -23.007 1.00 0.00 C ATOM 2046 C ILE A 123 -10.011 -1.234 -24.317 1.00 0.00 C ATOM 2047 O ILE A 123 -10.137 -0.010 -24.342 1.00 0.00 O ATOM 2048 CB ILE A 123 -8.284 -2.446 -22.974 1.00 0.00 C ATOM 2049 CG1 ILE A 123 -7.908 -2.916 -21.566 1.00 0.00 C ATOM 2050 CG2 ILE A 123 -7.349 -1.339 -23.437 1.00 0.00 C ATOM 2051 CD1 ILE A 123 -6.606 -3.681 -21.506 1.00 0.00 C ATOM 0 H ILE A 123 -10.215 -3.995 -22.784 1.00 0.00 H new ATOM 0 HA ILE A 123 -9.912 -1.273 -22.181 1.00 0.00 H new ATOM 0 HB ILE A 123 -8.181 -3.290 -23.657 1.00 0.00 H new ATOM 0 HG12 ILE A 123 -7.840 -2.048 -20.910 1.00 0.00 H new ATOM 0 HG13 ILE A 123 -8.708 -3.547 -21.178 1.00 0.00 H new ATOM 0 HG21 ILE A 123 -6.320 -1.696 -23.408 1.00 0.00 H new ATOM 0 HG22 ILE A 123 -7.604 -1.050 -24.457 1.00 0.00 H new ATOM 0 HG23 ILE A 123 -7.453 -0.476 -22.779 1.00 0.00 H new ATOM 0 HD11 ILE A 123 -6.407 -3.981 -20.477 1.00 0.00 H new ATOM 0 HD12 ILE A 123 -6.676 -4.568 -22.135 1.00 0.00 H new ATOM 0 HD13 ILE A 123 -5.794 -3.047 -21.863 1.00 0.00 H new ATOM 2063 N GLU A 124 -10.096 -1.992 -25.405 1.00 0.00 N ATOM 2064 CA GLU A 124 -10.265 -1.413 -26.732 1.00 0.00 C ATOM 2065 C GLU A 124 -11.577 -0.646 -26.834 1.00 0.00 C ATOM 2066 O GLU A 124 -11.650 0.394 -27.490 1.00 0.00 O ATOM 2067 CB GLU A 124 -10.217 -2.506 -27.801 1.00 0.00 C ATOM 2068 CG GLU A 124 -8.838 -3.112 -28.020 1.00 0.00 C ATOM 2069 CD GLU A 124 -8.831 -4.188 -29.070 1.00 0.00 C ATOM 2070 OE1 GLU A 124 -9.890 -4.584 -29.494 1.00 0.00 O ATOM 2071 OE2 GLU A 124 -7.766 -4.614 -29.448 1.00 0.00 O ATOM 0 H GLU A 124 -10.050 -3.011 -25.393 1.00 0.00 H new ATOM 0 HA GLU A 124 -9.445 -0.714 -26.898 1.00 0.00 H new ATOM 0 HB2 GLU A 124 -10.909 -3.300 -27.522 1.00 0.00 H new ATOM 0 HB3 GLU A 124 -10.572 -2.090 -28.744 1.00 0.00 H new ATOM 0 HG2 GLU A 124 -8.143 -2.324 -28.310 1.00 0.00 H new ATOM 0 HG3 GLU A 124 -8.476 -3.527 -27.079 1.00 0.00 H new ATOM 2078 N ARG A 125 -12.613 -1.165 -26.183 1.00 0.00 N ATOM 2079 CA ARG A 125 -13.922 -0.524 -26.191 1.00 0.00 C ATOM 2080 C ARG A 125 -13.872 0.841 -25.515 1.00 0.00 C ATOM 2081 O ARG A 125 -14.409 1.820 -26.032 1.00 0.00 O ATOM 2082 CB ARG A 125 -14.950 -1.397 -25.488 1.00 0.00 C ATOM 2083 CG ARG A 125 -16.378 -0.879 -25.548 1.00 0.00 C ATOM 2084 CD ARG A 125 -17.347 -1.874 -25.020 1.00 0.00 C ATOM 2085 NE ARG A 125 -17.177 -2.092 -23.592 1.00 0.00 N ATOM 2086 CZ ARG A 125 -16.641 -3.200 -23.046 1.00 0.00 C ATOM 2087 NH1 ARG A 125 -16.227 -4.180 -23.818 1.00 0.00 N ATOM 2088 NH2 ARG A 125 -16.530 -3.302 -21.733 1.00 0.00 N ATOM 0 H ARG A 125 -12.571 -2.029 -25.643 1.00 0.00 H new ATOM 0 HA ARG A 125 -14.213 -0.389 -27.233 1.00 0.00 H new ATOM 0 HB2 ARG A 125 -14.922 -2.393 -25.929 1.00 0.00 H new ATOM 0 HB3 ARG A 125 -14.661 -1.503 -24.442 1.00 0.00 H new ATOM 0 HG2 ARG A 125 -16.455 0.044 -24.973 1.00 0.00 H new ATOM 0 HG3 ARG A 125 -16.633 -0.634 -26.579 1.00 0.00 H new ATOM 0 HD2 ARG A 125 -18.363 -1.531 -25.216 1.00 0.00 H new ATOM 0 HD3 ARG A 125 -17.222 -2.819 -25.549 1.00 0.00 H new ATOM 0 HE ARG A 125 -17.486 -1.354 -22.960 1.00 0.00 H new ATOM 0 HH11 ARG A 125 -16.312 -4.101 -24.831 1.00 0.00 H new ATOM 0 HH12 ARG A 125 -15.821 -5.019 -23.404 1.00 0.00 H new ATOM 0 HH21 ARG A 125 -16.850 -2.541 -21.133 1.00 0.00 H new ATOM 0 HH22 ARG A 125 -16.124 -4.141 -21.319 1.00 0.00 H new ATOM 2102 N SER A 126 -13.224 0.898 -24.357 1.00 0.00 N ATOM 2103 CA SER A 126 -13.106 2.142 -23.606 1.00 0.00 C ATOM 2104 C SER A 126 -12.209 3.139 -24.328 1.00 0.00 C ATOM 2105 O SER A 126 -12.412 4.350 -24.239 1.00 0.00 O ATOM 2106 CB SER A 126 -12.556 1.865 -22.220 1.00 0.00 C ATOM 2107 OG SER A 126 -11.228 1.425 -22.286 1.00 0.00 O ATOM 0 H SER A 126 -12.772 0.096 -23.918 1.00 0.00 H new ATOM 0 HA SER A 126 -14.101 2.578 -23.520 1.00 0.00 H new ATOM 0 HB2 SER A 126 -12.614 2.770 -21.615 1.00 0.00 H new ATOM 0 HB3 SER A 126 -13.169 1.111 -21.726 1.00 0.00 H new ATOM 0 HG SER A 126 -10.856 1.371 -21.381 1.00 0.00 H new ATOM 2113 N LEU A 127 -11.215 2.623 -25.043 1.00 0.00 N ATOM 2114 CA LEU A 127 -10.353 3.458 -25.870 1.00 0.00 C ATOM 2115 C LEU A 127 -11.130 4.082 -27.022 1.00 0.00 C ATOM 2116 O LEU A 127 -10.963 5.263 -27.329 1.00 0.00 O ATOM 2117 CB LEU A 127 -9.185 2.630 -26.422 1.00 0.00 C ATOM 2118 CG LEU A 127 -8.137 2.190 -25.392 1.00 0.00 C ATOM 2119 CD1 LEU A 127 -7.172 1.205 -26.039 1.00 0.00 C ATOM 2120 CD2 LEU A 127 -7.400 3.411 -24.863 1.00 0.00 C ATOM 0 H LEU A 127 -10.987 1.629 -25.066 1.00 0.00 H new ATOM 0 HA LEU A 127 -9.964 4.261 -25.243 1.00 0.00 H new ATOM 0 HB2 LEU A 127 -9.590 1.740 -26.904 1.00 0.00 H new ATOM 0 HB3 LEU A 127 -8.685 3.212 -27.196 1.00 0.00 H new ATOM 0 HG LEU A 127 -8.624 1.694 -24.553 1.00 0.00 H new ATOM 0 HD11 LEU A 127 -6.427 0.892 -25.308 1.00 0.00 H new ATOM 0 HD12 LEU A 127 -7.724 0.333 -26.391 1.00 0.00 H new ATOM 0 HD13 LEU A 127 -6.674 1.684 -26.882 1.00 0.00 H new ATOM 0 HD21 LEU A 127 -6.655 3.098 -24.131 1.00 0.00 H new ATOM 0 HD22 LEU A 127 -6.905 3.923 -25.688 1.00 0.00 H new ATOM 0 HD23 LEU A 127 -8.111 4.089 -24.390 1.00 0.00 H new ATOM 2132 N ALA A 128 -11.980 3.283 -27.658 1.00 0.00 N ATOM 2133 CA ALA A 128 -12.817 3.766 -28.749 1.00 0.00 C ATOM 2134 C ALA A 128 -13.768 4.857 -28.272 1.00 0.00 C ATOM 2135 O ALA A 128 -13.992 5.846 -28.969 1.00 0.00 O ATOM 2136 CB ALA A 128 -13.598 2.616 -29.368 1.00 0.00 C ATOM 0 H ALA A 128 -12.107 2.296 -27.436 1.00 0.00 H new ATOM 0 HA ALA A 128 -12.164 4.196 -29.508 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -14.218 2.993 -30.181 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -12.903 1.872 -29.757 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -14.233 2.158 -28.610 1.00 0.00 H new ATOM 2142 N ALA A 129 -14.325 4.669 -27.080 1.00 0.00 N ATOM 2143 CA ALA A 129 -15.199 5.668 -26.477 1.00 0.00 C ATOM 2144 C ALA A 129 -14.460 6.981 -26.252 1.00 0.00 C ATOM 2145 O ALA A 129 -15.012 8.060 -26.470 1.00 0.00 O ATOM 2146 CB ALA A 129 -15.769 5.150 -25.165 1.00 0.00 C ATOM 0 H ALA A 129 -14.186 3.833 -26.512 1.00 0.00 H new ATOM 0 HA ALA A 129 -16.021 5.858 -27.167 1.00 0.00 H new ATOM 0 HB1 ALA A 129 -16.419 5.907 -24.727 1.00 0.00 H new ATOM 0 HB2 ALA A 129 -16.343 4.242 -25.351 1.00 0.00 H new ATOM 0 HB3 ALA A 129 -14.954 4.929 -24.476 1.00 0.00 H new ATOM 2152 N ALA A 130 -13.210 6.884 -25.815 1.00 0.00 N ATOM 2153 CA ALA A 130 -12.368 8.060 -25.632 1.00 0.00 C ATOM 2154 C ALA A 130 -12.056 8.727 -26.966 1.00 0.00 C ATOM 2155 O ALA A 130 -12.051 9.953 -27.071 1.00 0.00 O ATOM 2156 CB ALA A 130 -11.079 7.683 -24.916 1.00 0.00 C ATOM 0 H ALA A 130 -12.756 6.001 -25.580 1.00 0.00 H new ATOM 0 HA ALA A 130 -12.917 8.774 -25.018 1.00 0.00 H new ATOM 0 HB1 ALA A 130 -10.461 8.572 -24.787 1.00 0.00 H new ATOM 0 HB2 ALA A 130 -11.315 7.260 -23.939 1.00 0.00 H new ATOM 0 HB3 ALA A 130 -10.536 6.946 -25.508 1.00 0.00 H new ATOM 2162 N LEU A 131 -11.797 7.912 -27.983 1.00 0.00 N ATOM 2163 CA LEU A 131 -11.496 8.422 -29.315 1.00 0.00 C ATOM 2164 C LEU A 131 -12.696 9.146 -29.912 1.00 0.00 C ATOM 2165 O LEU A 131 -12.541 10.093 -30.683 1.00 0.00 O ATOM 2166 CB LEU A 131 -11.074 7.272 -30.239 1.00 0.00 C ATOM 2167 CG LEU A 131 -9.710 6.640 -29.934 1.00 0.00 C ATOM 2168 CD1 LEU A 131 -9.513 5.409 -30.808 1.00 0.00 C ATOM 2169 CD2 LEU A 131 -8.610 7.663 -30.175 1.00 0.00 C ATOM 0 H LEU A 131 -11.790 6.895 -27.910 1.00 0.00 H new ATOM 0 HA LEU A 131 -10.676 9.134 -29.223 1.00 0.00 H new ATOM 0 HB2 LEU A 131 -11.834 6.493 -30.189 1.00 0.00 H new ATOM 0 HB3 LEU A 131 -11.062 7.640 -31.265 1.00 0.00 H new ATOM 0 HG LEU A 131 -9.669 6.331 -28.890 1.00 0.00 H new ATOM 0 HD11 LEU A 131 -8.544 4.960 -30.591 1.00 0.00 H new ATOM 0 HD12 LEU A 131 -10.302 4.686 -30.601 1.00 0.00 H new ATOM 0 HD13 LEU A 131 -9.552 5.698 -31.858 1.00 0.00 H new ATOM 0 HD21 LEU A 131 -7.641 7.213 -29.958 1.00 0.00 H new ATOM 0 HD22 LEU A 131 -8.635 7.986 -31.216 1.00 0.00 H new ATOM 0 HD23 LEU A 131 -8.764 8.524 -29.524 1.00 0.00 H new ATOM 2181 N GLU A 132 -13.893 8.695 -29.551 1.00 0.00 N ATOM 2182 CA GLU A 132 -15.120 9.357 -29.976 1.00 0.00 C ATOM 2183 C GLU A 132 -15.279 10.712 -29.298 1.00 0.00 C ATOM 2184 O GLU A 132 -16.019 10.847 -28.324 1.00 0.00 O ATOM 2185 CB GLU A 132 -16.334 8.477 -29.668 1.00 0.00 C ATOM 2186 CG GLU A 132 -17.660 9.042 -30.157 1.00 0.00 C ATOM 2187 CD GLU A 132 -18.827 8.144 -29.852 1.00 0.00 C ATOM 2188 OE1 GLU A 132 -18.612 7.087 -29.307 1.00 0.00 O ATOM 2189 OE2 GLU A 132 -19.934 8.514 -30.166 1.00 0.00 O ATOM 0 H GLU A 132 -14.039 7.873 -28.965 1.00 0.00 H new ATOM 0 HA GLU A 132 -15.056 9.517 -31.052 1.00 0.00 H new ATOM 0 HB2 GLU A 132 -16.181 7.497 -30.121 1.00 0.00 H new ATOM 0 HB3 GLU A 132 -16.393 8.325 -28.590 1.00 0.00 H new ATOM 0 HG2 GLU A 132 -17.827 10.015 -29.695 1.00 0.00 H new ATOM 0 HG3 GLU A 132 -17.605 9.205 -31.233 1.00 0.00 H new ATOM 2196 N HIS A 133 -14.579 11.714 -29.820 1.00 0.00 N ATOM 2197 CA HIS A 133 -14.641 13.061 -29.266 1.00 0.00 C ATOM 2198 C HIS A 133 -15.839 13.827 -29.813 1.00 0.00 C ATOM 2199 O HIS A 133 -16.932 13.641 -29.353 1.00 0.00 O ATOM 2200 CB HIS A 133 -13.353 13.832 -29.571 1.00 0.00 C ATOM 2201 CG HIS A 133 -12.141 13.270 -28.895 1.00 0.00 C ATOM 2202 ND1 HIS A 133 -11.922 13.393 -27.539 1.00 0.00 N ATOM 2203 CD2 HIS A 133 -11.084 12.582 -29.386 1.00 0.00 C ATOM 2204 CE1 HIS A 133 -10.781 12.805 -27.225 1.00 0.00 C ATOM 2205 NE2 HIS A 133 -10.253 12.306 -28.328 1.00 0.00 N ATOM 0 H HIS A 133 -13.962 11.618 -30.626 1.00 0.00 H new ATOM 0 HA HIS A 133 -14.753 12.966 -28.186 1.00 0.00 H new ATOM 0 HB2 HIS A 133 -13.188 13.835 -30.649 1.00 0.00 H new ATOM 0 HB3 HIS A 133 -13.480 14.870 -29.265 1.00 0.00 H new ATOM 0 HD1 HIS A 133 -12.543 13.864 -26.881 1.00 0.00 H new ATOM 0 HD2 HIS A 133 -10.924 12.302 -30.417 1.00 0.00 H new ATOM 0 HE1 HIS A 133 -10.353 12.743 -26.235 1.00 0.00 H new TER 2213 HIS A 133