USER MOD reduce.3.24.130724 H: found=0, std=0, add=938, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 940 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 48 TYR OH : rot 30:sc= 0.907 USER MOD Set 1.2: B 38 ASN : amide:sc= 0.796 K(o=1.7,f=-0.72) USER MOD Set 2.1: A 18 GLN : amide:sc= 0.905 K(o=1.7,f=0) USER MOD Set 2.2: A 53 GLN : amide:sc= 0.789 K(o=1.7,f=-0.65) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 LYS NZ :NH3+ 165:sc= -0.0229 (180deg=-0.213) USER MOD Single : A 14 LYS NZ :NH3+ 161:sc= -0.0645 (180deg=-0.371) USER MOD Single : A 16 ASN : amide:sc= 0 X(o=0,f=-0.015) USER MOD Single : A 20 THR OG1 : rot 90:sc= 1.24 USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 MET CE :methyl -173:sc= -0.397 (180deg=-0.593) USER MOD Single : A 27 HIS : no HD1:sc= 0.447 K(o=1.9,f=-8.2!) USER MOD Single : A 35 THR OG1 : rot 17:sc= 1.12 USER MOD Single : A 38 ASN : amide:sc= 0 X(o=0,f=-0.022) USER MOD Single : A 41 MET CE :methyl 137:sc= -0.35 (180deg=-1.88!) USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 THR OG1 : rot 73:sc= 0.522 USER MOD Single : A 51 TYR OH : rot 180:sc= -0.149 USER MOD Single : A 59 LYS NZ :NH3+ -157:sc= 0.69 (180deg=-0.459!) USER MOD Single : A 60 SER OG : rot -80:sc= 0.767 USER MOD Single : A 61 THR OG1 : rot -150:sc= -0.192 USER MOD Single : B 9 LYS NZ :NH3+ -162:sc= -0.0773 (180deg=-0.433) USER MOD Single : B 11 LYS NZ :NH3+ -169:sc= -0.0107 (180deg=-0.133) USER MOD Single : B 13 LYS NZ :NH3+ -163:sc= -0.0418 (180deg=-0.291) USER MOD Single : B 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 16 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 18 GLN : amide:sc= -0.94 K(o=-0.94,f=0) USER MOD Single : B 20 THR OG1 : rot 82:sc= 1.25 USER MOD Single : B 23 LYS NZ :NH3+ 170:sc= -0.0356 (180deg=-0.177) USER MOD Single : B 24 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 27 HIS : no HD1:sc= 0.936 K(o=0.94,f=-4.4!) USER MOD Single : B 35 THR OG1 : rot 75:sc= 1.21 USER MOD Single : B 41 MET CE :methyl 177:sc= -1.46 (180deg=-1.48) USER MOD Single : B 46 LYS NZ :NH3+ -153:sc= 1.67 (180deg=0.0658) USER MOD Single : B 47 THR OG1 : rot 74:sc= 1.19 USER MOD Single : B 48 TYR OH : rot 130:sc= 0.779 USER MOD Single : B 51 TYR OH : rot 180:sc= 0 USER MOD Single : B 53 GLN : amide:sc= -0.0443 K(o=-0.044,f=-0.62) USER MOD Single : B 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 60 SER OG : rot 180:sc= 0 USER MOD Single : B 61 THR OG1 : rot -100:sc= -0.694 USER MOD ----------------------------------------------------------------- ATOM 53 N ALA A 5 29.064 -10.571 -14.058 1.00 0.00 N ATOM 54 CA ALA A 5 28.353 -11.205 -12.956 1.00 0.00 C ATOM 55 C ALA A 5 28.777 -10.638 -11.603 1.00 0.00 C ATOM 56 O ALA A 5 28.077 -10.812 -10.608 1.00 0.00 O ATOM 57 CB ALA A 5 28.561 -12.708 -12.990 1.00 0.00 C ATOM 0 HA ALA A 5 27.292 -10.989 -13.082 1.00 0.00 H new ATOM 0 HB1 ALA A 5 28.024 -13.168 -12.161 1.00 0.00 H new ATOM 0 HB2 ALA A 5 28.184 -13.106 -13.932 1.00 0.00 H new ATOM 0 HB3 ALA A 5 29.624 -12.930 -12.902 1.00 0.00 H new ATOM 63 N GLU A 6 29.925 -9.967 -11.569 1.00 0.00 N ATOM 64 CA GLU A 6 30.445 -9.398 -10.329 1.00 0.00 C ATOM 65 C GLU A 6 29.495 -8.361 -9.754 1.00 0.00 C ATOM 66 O GLU A 6 29.047 -8.479 -8.610 1.00 0.00 O ATOM 67 CB GLU A 6 31.810 -8.759 -10.572 1.00 0.00 C ATOM 68 CG GLU A 6 32.812 -9.713 -11.178 1.00 0.00 C ATOM 69 CD GLU A 6 34.165 -9.078 -11.396 1.00 0.00 C ATOM 70 OE1 GLU A 6 34.375 -8.462 -12.464 1.00 0.00 O ATOM 71 OE2 GLU A 6 35.028 -9.189 -10.502 1.00 0.00 O ATOM 0 H GLU A 6 30.513 -9.804 -12.386 1.00 0.00 H new ATOM 0 HA GLU A 6 30.545 -10.211 -9.609 1.00 0.00 H new ATOM 0 HB2 GLU A 6 31.690 -7.900 -11.232 1.00 0.00 H new ATOM 0 HB3 GLU A 6 32.202 -8.382 -9.627 1.00 0.00 H new ATOM 0 HG2 GLU A 6 32.923 -10.579 -10.526 1.00 0.00 H new ATOM 0 HG3 GLU A 6 32.429 -10.078 -12.131 1.00 0.00 H new ATOM 78 N GLU A 7 29.179 -7.354 -10.553 1.00 0.00 N ATOM 79 CA GLU A 7 28.229 -6.330 -10.136 1.00 0.00 C ATOM 80 C GLU A 7 26.857 -6.953 -9.959 1.00 0.00 C ATOM 81 O GLU A 7 26.123 -6.627 -9.030 1.00 0.00 O ATOM 82 CB GLU A 7 28.147 -5.204 -11.164 1.00 0.00 C ATOM 83 CG GLU A 7 27.269 -4.045 -10.708 1.00 0.00 C ATOM 84 CD GLU A 7 27.177 -2.921 -11.718 1.00 0.00 C ATOM 85 OE1 GLU A 7 26.783 -3.182 -12.870 1.00 0.00 O ATOM 86 OE2 GLU A 7 27.483 -1.763 -11.356 1.00 0.00 O ATOM 0 H GLU A 7 29.563 -7.222 -11.489 1.00 0.00 H new ATOM 0 HA GLU A 7 28.572 -5.909 -9.191 1.00 0.00 H new ATOM 0 HB2 GLU A 7 29.151 -4.833 -11.369 1.00 0.00 H new ATOM 0 HB3 GLU A 7 27.756 -5.602 -12.101 1.00 0.00 H new ATOM 0 HG2 GLU A 7 26.266 -4.419 -10.501 1.00 0.00 H new ATOM 0 HG3 GLU A 7 27.661 -3.649 -9.771 1.00 0.00 H new ATOM 93 N LEU A 8 26.543 -7.873 -10.857 1.00 0.00 N ATOM 94 CA LEU A 8 25.270 -8.575 -10.848 1.00 0.00 C ATOM 95 C LEU A 8 25.023 -9.240 -9.500 1.00 0.00 C ATOM 96 O LEU A 8 23.943 -9.121 -8.927 1.00 0.00 O ATOM 97 CB LEU A 8 25.263 -9.624 -11.966 1.00 0.00 C ATOM 98 CG LEU A 8 24.452 -9.270 -13.217 1.00 0.00 C ATOM 99 CD1 LEU A 8 22.966 -9.324 -12.915 1.00 0.00 C ATOM 100 CD2 LEU A 8 24.843 -7.897 -13.747 1.00 0.00 C ATOM 0 H LEU A 8 27.165 -8.155 -11.614 1.00 0.00 H new ATOM 0 HA LEU A 8 24.470 -7.855 -11.017 1.00 0.00 H new ATOM 0 HB2 LEU A 8 26.294 -9.812 -12.267 1.00 0.00 H new ATOM 0 HB3 LEU A 8 24.875 -10.557 -11.558 1.00 0.00 H new ATOM 0 HG LEU A 8 24.676 -10.005 -13.990 1.00 0.00 H new ATOM 0 HD11 LEU A 8 22.403 -9.070 -13.813 1.00 0.00 H new ATOM 0 HD12 LEU A 8 22.697 -10.329 -12.590 1.00 0.00 H new ATOM 0 HD13 LEU A 8 22.729 -8.612 -12.125 1.00 0.00 H new ATOM 0 HD21 LEU A 8 24.254 -7.668 -14.635 1.00 0.00 H new ATOM 0 HD22 LEU A 8 24.653 -7.144 -12.982 1.00 0.00 H new ATOM 0 HD23 LEU A 8 25.902 -7.894 -14.004 1.00 0.00 H new ATOM 112 N LYS A 9 26.046 -9.911 -8.990 1.00 0.00 N ATOM 113 CA LYS A 9 25.945 -10.646 -7.739 1.00 0.00 C ATOM 114 C LYS A 9 25.737 -9.700 -6.565 1.00 0.00 C ATOM 115 O LYS A 9 24.819 -9.885 -5.770 1.00 0.00 O ATOM 116 CB LYS A 9 27.217 -11.473 -7.522 1.00 0.00 C ATOM 117 CG LYS A 9 27.020 -12.702 -6.650 1.00 0.00 C ATOM 118 CD LYS A 9 26.245 -13.785 -7.390 1.00 0.00 C ATOM 119 CE LYS A 9 26.941 -14.173 -8.688 1.00 0.00 C ATOM 120 NZ LYS A 9 26.213 -15.243 -9.422 1.00 0.00 N ATOM 0 H LYS A 9 26.965 -9.961 -9.430 1.00 0.00 H new ATOM 0 HA LYS A 9 25.083 -11.310 -7.799 1.00 0.00 H new ATOM 0 HB2 LYS A 9 27.602 -11.788 -8.492 1.00 0.00 H new ATOM 0 HB3 LYS A 9 27.977 -10.837 -7.068 1.00 0.00 H new ATOM 0 HG2 LYS A 9 27.990 -13.092 -6.342 1.00 0.00 H new ATOM 0 HG3 LYS A 9 26.485 -12.425 -5.742 1.00 0.00 H new ATOM 0 HD2 LYS A 9 26.144 -14.663 -6.752 1.00 0.00 H new ATOM 0 HD3 LYS A 9 25.237 -13.431 -7.607 1.00 0.00 H new ATOM 0 HE2 LYS A 9 27.030 -13.294 -9.326 1.00 0.00 H new ATOM 0 HE3 LYS A 9 27.954 -14.511 -8.468 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 26.725 -15.473 -10.298 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 26.150 -16.092 -8.825 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 25.255 -14.913 -9.657 1.00 0.00 H new ATOM 134 N ALA A 10 26.581 -8.680 -6.477 1.00 0.00 N ATOM 135 CA ALA A 10 26.522 -7.729 -5.374 1.00 0.00 C ATOM 136 C ALA A 10 25.219 -6.941 -5.402 1.00 0.00 C ATOM 137 O ALA A 10 24.631 -6.646 -4.357 1.00 0.00 O ATOM 138 CB ALA A 10 27.715 -6.784 -5.429 1.00 0.00 C ATOM 0 H ALA A 10 27.316 -8.490 -7.158 1.00 0.00 H new ATOM 0 HA ALA A 10 26.559 -8.288 -4.439 1.00 0.00 H new ATOM 0 HB1 ALA A 10 27.659 -6.079 -4.600 1.00 0.00 H new ATOM 0 HB2 ALA A 10 28.638 -7.359 -5.355 1.00 0.00 H new ATOM 0 HB3 ALA A 10 27.703 -6.237 -6.372 1.00 0.00 H new ATOM 144 N LYS A 11 24.767 -6.618 -6.606 1.00 0.00 N ATOM 145 CA LYS A 11 23.565 -5.821 -6.787 1.00 0.00 C ATOM 146 C LYS A 11 22.318 -6.657 -6.510 1.00 0.00 C ATOM 147 O LYS A 11 21.387 -6.196 -5.848 1.00 0.00 O ATOM 148 CB LYS A 11 23.539 -5.257 -8.209 1.00 0.00 C ATOM 149 CG LYS A 11 22.678 -4.020 -8.385 1.00 0.00 C ATOM 150 CD LYS A 11 23.028 -3.317 -9.685 1.00 0.00 C ATOM 151 CE LYS A 11 22.287 -2.002 -9.841 1.00 0.00 C ATOM 152 NZ LYS A 11 22.794 -1.227 -11.004 1.00 0.00 N ATOM 0 H LYS A 11 25.219 -6.899 -7.476 1.00 0.00 H new ATOM 0 HA LYS A 11 23.573 -4.993 -6.078 1.00 0.00 H new ATOM 0 HB2 LYS A 11 24.559 -5.019 -8.509 1.00 0.00 H new ATOM 0 HB3 LYS A 11 23.180 -6.032 -8.886 1.00 0.00 H new ATOM 0 HG2 LYS A 11 21.624 -4.299 -8.386 1.00 0.00 H new ATOM 0 HG3 LYS A 11 22.827 -3.342 -7.545 1.00 0.00 H new ATOM 0 HD2 LYS A 11 24.102 -3.134 -9.720 1.00 0.00 H new ATOM 0 HD3 LYS A 11 22.789 -3.969 -10.525 1.00 0.00 H new ATOM 0 HE2 LYS A 11 21.222 -2.196 -9.968 1.00 0.00 H new ATOM 0 HE3 LYS A 11 22.397 -1.411 -8.932 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 22.267 -0.334 -11.083 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 23.805 -1.022 -10.870 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 22.666 -1.782 -11.874 1.00 0.00 H new ATOM 166 N LEU A 12 22.312 -7.895 -7.001 1.00 0.00 N ATOM 167 CA LEU A 12 21.199 -8.803 -6.756 1.00 0.00 C ATOM 168 C LEU A 12 21.121 -9.136 -5.274 1.00 0.00 C ATOM 169 O LEU A 12 20.035 -9.210 -4.704 1.00 0.00 O ATOM 170 CB LEU A 12 21.357 -10.090 -7.573 1.00 0.00 C ATOM 171 CG LEU A 12 20.220 -11.103 -7.423 1.00 0.00 C ATOM 172 CD1 LEU A 12 18.900 -10.509 -7.900 1.00 0.00 C ATOM 173 CD2 LEU A 12 20.542 -12.376 -8.190 1.00 0.00 C ATOM 0 H LEU A 12 23.063 -8.289 -7.568 1.00 0.00 H new ATOM 0 HA LEU A 12 20.277 -8.311 -7.065 1.00 0.00 H new ATOM 0 HB2 LEU A 12 21.448 -9.824 -8.626 1.00 0.00 H new ATOM 0 HB3 LEU A 12 22.291 -10.572 -7.284 1.00 0.00 H new ATOM 0 HG LEU A 12 20.118 -11.351 -6.366 1.00 0.00 H new ATOM 0 HD11 LEU A 12 18.106 -11.247 -7.784 1.00 0.00 H new ATOM 0 HD12 LEU A 12 18.663 -9.625 -7.307 1.00 0.00 H new ATOM 0 HD13 LEU A 12 18.985 -10.230 -8.950 1.00 0.00 H new ATOM 0 HD21 LEU A 12 19.724 -13.087 -8.074 1.00 0.00 H new ATOM 0 HD22 LEU A 12 20.672 -12.141 -9.246 1.00 0.00 H new ATOM 0 HD23 LEU A 12 21.461 -12.813 -7.800 1.00 0.00 H new ATOM 185 N LYS A 13 22.284 -9.329 -4.661 1.00 0.00 N ATOM 186 CA LYS A 13 22.369 -9.582 -3.226 1.00 0.00 C ATOM 187 C LYS A 13 21.653 -8.482 -2.447 1.00 0.00 C ATOM 188 O LYS A 13 20.796 -8.757 -1.602 1.00 0.00 O ATOM 189 CB LYS A 13 23.835 -9.652 -2.795 1.00 0.00 C ATOM 190 CG LYS A 13 24.038 -10.080 -1.350 1.00 0.00 C ATOM 191 CD LYS A 13 25.504 -10.026 -0.956 1.00 0.00 C ATOM 192 CE LYS A 13 25.720 -10.519 0.465 1.00 0.00 C ATOM 193 NZ LYS A 13 25.351 -11.951 0.618 1.00 0.00 N ATOM 0 H LYS A 13 23.186 -9.315 -5.138 1.00 0.00 H new ATOM 0 HA LYS A 13 21.885 -10.535 -3.012 1.00 0.00 H new ATOM 0 HB2 LYS A 13 24.361 -10.350 -3.447 1.00 0.00 H new ATOM 0 HB3 LYS A 13 24.292 -8.673 -2.940 1.00 0.00 H new ATOM 0 HG2 LYS A 13 23.459 -9.432 -0.692 1.00 0.00 H new ATOM 0 HG3 LYS A 13 23.660 -11.093 -1.213 1.00 0.00 H new ATOM 0 HD2 LYS A 13 26.089 -10.634 -1.646 1.00 0.00 H new ATOM 0 HD3 LYS A 13 25.868 -9.003 -1.046 1.00 0.00 H new ATOM 0 HE2 LYS A 13 26.765 -10.382 0.742 1.00 0.00 H new ATOM 0 HE3 LYS A 13 25.127 -9.916 1.152 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 25.742 -12.317 1.510 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 24.315 -12.043 0.630 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 25.738 -12.496 -0.179 1.00 0.00 H new ATOM 207 N LYS A 14 22.010 -7.237 -2.751 1.00 0.00 N ATOM 208 CA LYS A 14 21.406 -6.072 -2.122 1.00 0.00 C ATOM 209 C LYS A 14 19.891 -6.066 -2.326 1.00 0.00 C ATOM 210 O LYS A 14 19.123 -5.959 -1.369 1.00 0.00 O ATOM 211 CB LYS A 14 22.010 -4.800 -2.722 1.00 0.00 C ATOM 212 CG LYS A 14 21.612 -3.533 -1.987 1.00 0.00 C ATOM 213 CD LYS A 14 22.323 -3.423 -0.650 1.00 0.00 C ATOM 214 CE LYS A 14 23.805 -3.114 -0.820 1.00 0.00 C ATOM 215 NZ LYS A 14 24.037 -1.811 -1.506 1.00 0.00 N ATOM 0 H LYS A 14 22.726 -7.010 -3.441 1.00 0.00 H new ATOM 0 HA LYS A 14 21.609 -6.110 -1.052 1.00 0.00 H new ATOM 0 HB2 LYS A 14 23.097 -4.887 -2.717 1.00 0.00 H new ATOM 0 HB3 LYS A 14 21.701 -4.718 -3.764 1.00 0.00 H new ATOM 0 HG2 LYS A 14 21.851 -2.664 -2.600 1.00 0.00 H new ATOM 0 HG3 LYS A 14 20.534 -3.525 -1.829 1.00 0.00 H new ATOM 0 HD2 LYS A 14 21.855 -2.640 -0.053 1.00 0.00 H new ATOM 0 HD3 LYS A 14 22.207 -4.356 -0.099 1.00 0.00 H new ATOM 0 HE2 LYS A 14 24.285 -3.097 0.159 1.00 0.00 H new ATOM 0 HE3 LYS A 14 24.277 -3.912 -1.393 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 25.008 -1.489 -1.320 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 23.902 -1.929 -2.530 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 23.363 -1.105 -1.147 1.00 0.00 H new ATOM 229 N LEU A 15 19.477 -6.203 -3.579 1.00 0.00 N ATOM 230 CA LEU A 15 18.067 -6.126 -3.944 1.00 0.00 C ATOM 231 C LEU A 15 17.251 -7.252 -3.311 1.00 0.00 C ATOM 232 O LEU A 15 16.130 -7.029 -2.846 1.00 0.00 O ATOM 233 CB LEU A 15 17.920 -6.164 -5.464 1.00 0.00 C ATOM 234 CG LEU A 15 18.507 -4.964 -6.212 1.00 0.00 C ATOM 235 CD1 LEU A 15 18.305 -5.127 -7.710 1.00 0.00 C ATOM 236 CD2 LEU A 15 17.873 -3.668 -5.723 1.00 0.00 C ATOM 0 H LEU A 15 20.103 -6.370 -4.367 1.00 0.00 H new ATOM 0 HA LEU A 15 17.677 -5.183 -3.561 1.00 0.00 H new ATOM 0 HB2 LEU A 15 18.397 -7.071 -5.835 1.00 0.00 H new ATOM 0 HB3 LEU A 15 16.860 -6.239 -5.708 1.00 0.00 H new ATOM 0 HG LEU A 15 19.577 -4.918 -6.010 1.00 0.00 H new ATOM 0 HD11 LEU A 15 18.727 -4.267 -8.230 1.00 0.00 H new ATOM 0 HD12 LEU A 15 18.804 -6.036 -8.048 1.00 0.00 H new ATOM 0 HD13 LEU A 15 17.239 -5.196 -7.928 1.00 0.00 H new ATOM 0 HD21 LEU A 15 18.302 -2.826 -6.266 1.00 0.00 H new ATOM 0 HD22 LEU A 15 16.797 -3.701 -5.896 1.00 0.00 H new ATOM 0 HD23 LEU A 15 18.065 -3.549 -4.657 1.00 0.00 H new ATOM 248 N ASN A 16 17.815 -8.453 -3.286 1.00 0.00 N ATOM 249 CA ASN A 16 17.129 -9.614 -2.731 1.00 0.00 C ATOM 250 C ASN A 16 16.873 -9.426 -1.239 1.00 0.00 C ATOM 251 O ASN A 16 15.776 -9.702 -0.746 1.00 0.00 O ATOM 252 CB ASN A 16 17.952 -10.884 -2.968 1.00 0.00 C ATOM 253 CG ASN A 16 17.190 -12.146 -2.615 1.00 0.00 C ATOM 254 OD1 ASN A 16 17.216 -12.604 -1.473 1.00 0.00 O ATOM 255 ND2 ASN A 16 16.512 -12.720 -3.599 1.00 0.00 N ATOM 0 H ASN A 16 18.749 -8.649 -3.645 1.00 0.00 H new ATOM 0 HA ASN A 16 16.169 -9.717 -3.237 1.00 0.00 H new ATOM 0 HB2 ASN A 16 18.254 -10.927 -4.014 1.00 0.00 H new ATOM 0 HB3 ASN A 16 18.865 -10.837 -2.374 1.00 0.00 H new ATOM 0 HD21 ASN A 16 15.985 -13.575 -3.424 1.00 0.00 H new ATOM 0 HD22 ASN A 16 16.518 -12.306 -4.531 1.00 0.00 H new ATOM 262 N ALA A 17 17.881 -8.936 -0.528 1.00 0.00 N ATOM 263 CA ALA A 17 17.752 -8.685 0.901 1.00 0.00 C ATOM 264 C ALA A 17 16.763 -7.555 1.157 1.00 0.00 C ATOM 265 O ALA A 17 15.971 -7.606 2.101 1.00 0.00 O ATOM 266 CB ALA A 17 19.110 -8.364 1.507 1.00 0.00 C ATOM 0 H ALA A 17 18.795 -8.705 -0.917 1.00 0.00 H new ATOM 0 HA ALA A 17 17.369 -9.586 1.380 1.00 0.00 H new ATOM 0 HB1 ALA A 17 18.997 -8.179 2.575 1.00 0.00 H new ATOM 0 HB2 ALA A 17 19.785 -9.206 1.354 1.00 0.00 H new ATOM 0 HB3 ALA A 17 19.522 -7.477 1.027 1.00 0.00 H new ATOM 272 N GLN A 18 16.808 -6.545 0.296 1.00 0.00 N ATOM 273 CA GLN A 18 15.894 -5.412 0.371 1.00 0.00 C ATOM 274 C GLN A 18 14.442 -5.885 0.292 1.00 0.00 C ATOM 275 O GLN A 18 13.638 -5.599 1.177 1.00 0.00 O ATOM 276 CB GLN A 18 16.200 -4.428 -0.762 1.00 0.00 C ATOM 277 CG GLN A 18 15.259 -3.237 -0.833 1.00 0.00 C ATOM 278 CD GLN A 18 15.652 -2.260 -1.920 1.00 0.00 C ATOM 279 OE1 GLN A 18 16.414 -1.325 -1.684 1.00 0.00 O ATOM 280 NE2 GLN A 18 15.148 -2.481 -3.123 1.00 0.00 N ATOM 0 H GLN A 18 17.477 -6.489 -0.472 1.00 0.00 H new ATOM 0 HA GLN A 18 16.033 -4.908 1.327 1.00 0.00 H new ATOM 0 HB2 GLN A 18 17.220 -4.063 -0.643 1.00 0.00 H new ATOM 0 HB3 GLN A 18 16.161 -4.963 -1.711 1.00 0.00 H new ATOM 0 HG2 GLN A 18 14.243 -3.589 -1.014 1.00 0.00 H new ATOM 0 HG3 GLN A 18 15.252 -2.724 0.129 1.00 0.00 H new ATOM 0 HE21 GLN A 18 14.519 -3.269 -3.275 1.00 0.00 H new ATOM 0 HE22 GLN A 18 15.389 -1.863 -3.898 1.00 0.00 H new ATOM 289 N ALA A 19 14.128 -6.639 -0.758 1.00 0.00 N ATOM 290 CA ALA A 19 12.771 -7.132 -0.974 1.00 0.00 C ATOM 291 C ALA A 19 12.287 -7.984 0.198 1.00 0.00 C ATOM 292 O ALA A 19 11.153 -7.841 0.657 1.00 0.00 O ATOM 293 CB ALA A 19 12.705 -7.931 -2.265 1.00 0.00 C ATOM 0 H ALA A 19 14.797 -6.922 -1.474 1.00 0.00 H new ATOM 0 HA ALA A 19 12.111 -6.268 -1.050 1.00 0.00 H new ATOM 0 HB1 ALA A 19 11.689 -8.294 -2.417 1.00 0.00 H new ATOM 0 HB2 ALA A 19 12.991 -7.294 -3.102 1.00 0.00 H new ATOM 0 HB3 ALA A 19 13.388 -8.779 -2.204 1.00 0.00 H new ATOM 299 N THR A 20 13.164 -8.856 0.683 1.00 0.00 N ATOM 300 CA THR A 20 12.830 -9.763 1.773 1.00 0.00 C ATOM 301 C THR A 20 12.458 -8.989 3.042 1.00 0.00 C ATOM 302 O THR A 20 11.475 -9.312 3.715 1.00 0.00 O ATOM 303 CB THR A 20 14.003 -10.720 2.071 1.00 0.00 C ATOM 304 OG1 THR A 20 14.426 -11.374 0.862 1.00 0.00 O ATOM 305 CG2 THR A 20 13.609 -11.771 3.101 1.00 0.00 C ATOM 0 H THR A 20 14.118 -8.953 0.335 1.00 0.00 H new ATOM 0 HA THR A 20 11.967 -10.349 1.457 1.00 0.00 H new ATOM 0 HB THR A 20 14.823 -10.127 2.476 1.00 0.00 H new ATOM 0 HG1 THR A 20 15.116 -10.834 0.422 1.00 0.00 H new ATOM 0 HG21 THR A 20 14.456 -12.430 3.290 1.00 0.00 H new ATOM 0 HG22 THR A 20 13.317 -11.279 4.029 1.00 0.00 H new ATOM 0 HG23 THR A 20 12.771 -12.356 2.722 1.00 0.00 H new ATOM 313 N ALA A 21 13.228 -7.951 3.353 1.00 0.00 N ATOM 314 CA ALA A 21 12.976 -7.159 4.550 1.00 0.00 C ATOM 315 C ALA A 21 11.687 -6.355 4.414 1.00 0.00 C ATOM 316 O ALA A 21 10.898 -6.260 5.358 1.00 0.00 O ATOM 317 CB ALA A 21 14.150 -6.240 4.829 1.00 0.00 C ATOM 0 H ALA A 21 14.025 -7.641 2.797 1.00 0.00 H new ATOM 0 HA ALA A 21 12.858 -7.842 5.391 1.00 0.00 H new ATOM 0 HB1 ALA A 21 13.948 -5.654 5.726 1.00 0.00 H new ATOM 0 HB2 ALA A 21 15.050 -6.835 4.979 1.00 0.00 H new ATOM 0 HB3 ALA A 21 14.296 -5.569 3.983 1.00 0.00 H new ATOM 323 N LEU A 22 11.470 -5.789 3.230 1.00 0.00 N ATOM 324 CA LEU A 22 10.279 -4.989 2.968 1.00 0.00 C ATOM 325 C LEU A 22 9.011 -5.832 3.055 1.00 0.00 C ATOM 326 O LEU A 22 7.965 -5.335 3.473 1.00 0.00 O ATOM 327 CB LEU A 22 10.370 -4.300 1.600 1.00 0.00 C ATOM 328 CG LEU A 22 10.954 -2.879 1.623 1.00 0.00 C ATOM 329 CD1 LEU A 22 10.105 -1.975 2.504 1.00 0.00 C ATOM 330 CD2 LEU A 22 12.401 -2.888 2.099 1.00 0.00 C ATOM 0 H LEU A 22 12.105 -5.870 2.436 1.00 0.00 H new ATOM 0 HA LEU A 22 10.227 -4.221 3.739 1.00 0.00 H new ATOM 0 HB2 LEU A 22 10.981 -4.916 0.940 1.00 0.00 H new ATOM 0 HB3 LEU A 22 9.372 -4.259 1.164 1.00 0.00 H new ATOM 0 HG LEU A 22 10.940 -2.488 0.605 1.00 0.00 H new ATOM 0 HD11 LEU A 22 10.530 -0.971 2.512 1.00 0.00 H new ATOM 0 HD12 LEU A 22 9.088 -1.936 2.113 1.00 0.00 H new ATOM 0 HD13 LEU A 22 10.088 -2.369 3.520 1.00 0.00 H new ATOM 0 HD21 LEU A 22 12.788 -1.869 2.105 1.00 0.00 H new ATOM 0 HD22 LEU A 22 12.450 -3.301 3.107 1.00 0.00 H new ATOM 0 HD23 LEU A 22 13.002 -3.500 1.426 1.00 0.00 H new ATOM 342 N LYS A 23 9.107 -7.104 2.669 1.00 0.00 N ATOM 343 CA LYS A 23 7.971 -8.011 2.775 1.00 0.00 C ATOM 344 C LYS A 23 7.500 -8.118 4.220 1.00 0.00 C ATOM 345 O LYS A 23 6.320 -7.933 4.516 1.00 0.00 O ATOM 346 CB LYS A 23 8.324 -9.408 2.244 1.00 0.00 C ATOM 347 CG LYS A 23 7.198 -10.413 2.434 1.00 0.00 C ATOM 348 CD LYS A 23 7.611 -11.827 2.051 1.00 0.00 C ATOM 349 CE LYS A 23 6.480 -12.814 2.302 1.00 0.00 C ATOM 350 NZ LYS A 23 6.895 -14.221 2.064 1.00 0.00 N ATOM 0 H LYS A 23 9.953 -7.524 2.284 1.00 0.00 H new ATOM 0 HA LYS A 23 7.166 -7.600 2.166 1.00 0.00 H new ATOM 0 HB2 LYS A 23 8.567 -9.338 1.184 1.00 0.00 H new ATOM 0 HB3 LYS A 23 9.218 -9.770 2.753 1.00 0.00 H new ATOM 0 HG2 LYS A 23 6.876 -10.401 3.475 1.00 0.00 H new ATOM 0 HG3 LYS A 23 6.341 -10.112 1.832 1.00 0.00 H new ATOM 0 HD2 LYS A 23 7.895 -11.854 0.999 1.00 0.00 H new ATOM 0 HD3 LYS A 23 8.489 -12.121 2.626 1.00 0.00 H new ATOM 0 HE2 LYS A 23 6.131 -12.709 3.329 1.00 0.00 H new ATOM 0 HE3 LYS A 23 5.638 -12.571 1.653 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 6.092 -14.856 2.248 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 7.203 -14.330 1.077 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 7.681 -14.464 2.701 1.00 0.00 H new ATOM 364 N MET A 24 8.435 -8.401 5.118 1.00 0.00 N ATOM 365 CA MET A 24 8.109 -8.614 6.523 1.00 0.00 C ATOM 366 C MET A 24 7.631 -7.320 7.174 1.00 0.00 C ATOM 367 O MET A 24 6.691 -7.325 7.969 1.00 0.00 O ATOM 368 CB MET A 24 9.322 -9.168 7.276 1.00 0.00 C ATOM 369 CG MET A 24 9.804 -10.512 6.753 1.00 0.00 C ATOM 370 SD MET A 24 11.164 -11.197 7.723 1.00 0.00 S ATOM 371 CE MET A 24 12.416 -9.940 7.485 1.00 0.00 C ATOM 0 H MET A 24 9.427 -8.489 4.898 1.00 0.00 H new ATOM 0 HA MET A 24 7.300 -9.343 6.575 1.00 0.00 H new ATOM 0 HB2 MET A 24 10.138 -8.449 7.211 1.00 0.00 H new ATOM 0 HB3 MET A 24 9.069 -9.268 8.331 1.00 0.00 H new ATOM 0 HG2 MET A 24 8.972 -11.216 6.755 1.00 0.00 H new ATOM 0 HG3 MET A 24 10.124 -10.399 5.717 1.00 0.00 H new ATOM 0 HE1 MET A 24 13.357 -10.277 7.919 1.00 0.00 H new ATOM 0 HE2 MET A 24 12.552 -9.760 6.419 1.00 0.00 H new ATOM 0 HE3 MET A 24 12.102 -9.017 7.972 1.00 0.00 H new ATOM 381 N ASP A 25 8.258 -6.210 6.804 1.00 0.00 N ATOM 382 CA ASP A 25 7.940 -4.922 7.413 1.00 0.00 C ATOM 383 C ASP A 25 6.538 -4.466 7.018 1.00 0.00 C ATOM 384 O ASP A 25 5.770 -3.995 7.859 1.00 0.00 O ATOM 385 CB ASP A 25 8.975 -3.865 7.020 1.00 0.00 C ATOM 386 CG ASP A 25 8.803 -2.579 7.801 1.00 0.00 C ATOM 387 OD1 ASP A 25 8.922 -2.618 9.047 1.00 0.00 O ATOM 388 OD2 ASP A 25 8.541 -1.532 7.180 1.00 0.00 O ATOM 0 H ASP A 25 8.985 -6.174 6.090 1.00 0.00 H new ATOM 0 HA ASP A 25 7.968 -5.046 8.496 1.00 0.00 H new ATOM 0 HB2 ASP A 25 9.977 -4.259 7.189 1.00 0.00 H new ATOM 0 HB3 ASP A 25 8.891 -3.655 5.954 1.00 0.00 H new ATOM 393 N LEU A 26 6.200 -4.626 5.741 1.00 0.00 N ATOM 394 CA LEU A 26 4.865 -4.288 5.255 1.00 0.00 C ATOM 395 C LEU A 26 3.837 -5.268 5.814 1.00 0.00 C ATOM 396 O LEU A 26 2.717 -4.886 6.160 1.00 0.00 O ATOM 397 CB LEU A 26 4.831 -4.304 3.723 1.00 0.00 C ATOM 398 CG LEU A 26 3.483 -3.943 3.090 1.00 0.00 C ATOM 399 CD1 LEU A 26 3.100 -2.512 3.428 1.00 0.00 C ATOM 400 CD2 LEU A 26 3.537 -4.142 1.583 1.00 0.00 C ATOM 0 H LEU A 26 6.831 -4.987 5.025 1.00 0.00 H new ATOM 0 HA LEU A 26 4.617 -3.283 5.597 1.00 0.00 H new ATOM 0 HB2 LEU A 26 5.584 -3.609 3.353 1.00 0.00 H new ATOM 0 HB3 LEU A 26 5.119 -5.298 3.381 1.00 0.00 H new ATOM 0 HG LEU A 26 2.720 -4.605 3.499 1.00 0.00 H new ATOM 0 HD11 LEU A 26 2.140 -2.274 2.970 1.00 0.00 H new ATOM 0 HD12 LEU A 26 3.023 -2.402 4.510 1.00 0.00 H new ATOM 0 HD13 LEU A 26 3.862 -1.832 3.047 1.00 0.00 H new ATOM 0 HD21 LEU A 26 2.573 -3.882 1.147 1.00 0.00 H new ATOM 0 HD22 LEU A 26 4.311 -3.503 1.159 1.00 0.00 H new ATOM 0 HD23 LEU A 26 3.766 -5.184 1.362 1.00 0.00 H new ATOM 412 N HIS A 27 4.237 -6.532 5.904 1.00 0.00 N ATOM 413 CA HIS A 27 3.391 -7.578 6.471 1.00 0.00 C ATOM 414 C HIS A 27 2.937 -7.202 7.875 1.00 0.00 C ATOM 415 O HIS A 27 1.742 -7.183 8.173 1.00 0.00 O ATOM 416 CB HIS A 27 4.156 -8.906 6.519 1.00 0.00 C ATOM 417 CG HIS A 27 3.405 -10.018 7.182 1.00 0.00 C ATOM 418 ND1 HIS A 27 3.556 -10.345 8.515 1.00 0.00 N ATOM 419 CD2 HIS A 27 2.490 -10.877 6.685 1.00 0.00 C ATOM 420 CE1 HIS A 27 2.764 -11.364 8.804 1.00 0.00 C ATOM 421 NE2 HIS A 27 2.108 -11.704 7.709 1.00 0.00 N ATOM 0 H HIS A 27 5.150 -6.860 5.589 1.00 0.00 H new ATOM 0 HA HIS A 27 2.513 -7.688 5.835 1.00 0.00 H new ATOM 0 HB2 HIS A 27 4.406 -9.206 5.501 1.00 0.00 H new ATOM 0 HB3 HIS A 27 5.097 -8.752 7.046 1.00 0.00 H new ATOM 0 HD2 HIS A 27 2.126 -10.907 5.669 1.00 0.00 H new ATOM 0 HE1 HIS A 27 2.670 -11.837 9.770 1.00 0.00 H new ATOM 0 HE2 HIS A 27 1.427 -12.460 7.637 1.00 0.00 H new ATOM 430 N ASP A 28 3.901 -6.893 8.725 1.00 0.00 N ATOM 431 CA ASP A 28 3.624 -6.584 10.120 1.00 0.00 C ATOM 432 C ASP A 28 2.918 -5.243 10.255 1.00 0.00 C ATOM 433 O ASP A 28 2.196 -5.011 11.219 1.00 0.00 O ATOM 434 CB ASP A 28 4.912 -6.608 10.944 1.00 0.00 C ATOM 435 CG ASP A 28 5.511 -8.000 11.036 1.00 0.00 C ATOM 436 OD1 ASP A 28 4.887 -8.963 10.534 1.00 0.00 O ATOM 437 OD2 ASP A 28 6.607 -8.138 11.615 1.00 0.00 O ATOM 0 H ASP A 28 4.888 -6.849 8.473 1.00 0.00 H new ATOM 0 HA ASP A 28 2.956 -7.352 10.509 1.00 0.00 H new ATOM 0 HB2 ASP A 28 5.640 -5.931 10.497 1.00 0.00 H new ATOM 0 HB3 ASP A 28 4.706 -6.237 11.948 1.00 0.00 H new ATOM 442 N LEU A 29 3.125 -4.363 9.284 1.00 0.00 N ATOM 443 CA LEU A 29 2.408 -3.094 9.242 1.00 0.00 C ATOM 444 C LEU A 29 0.910 -3.341 9.059 1.00 0.00 C ATOM 445 O LEU A 29 0.080 -2.688 9.690 1.00 0.00 O ATOM 446 CB LEU A 29 2.946 -2.220 8.106 1.00 0.00 C ATOM 447 CG LEU A 29 2.285 -0.847 7.955 1.00 0.00 C ATOM 448 CD1 LEU A 29 2.491 -0.002 9.204 1.00 0.00 C ATOM 449 CD2 LEU A 29 2.837 -0.132 6.733 1.00 0.00 C ATOM 0 H LEU A 29 3.782 -4.503 8.516 1.00 0.00 H new ATOM 0 HA LEU A 29 2.563 -2.572 10.186 1.00 0.00 H new ATOM 0 HB2 LEU A 29 4.015 -2.073 8.260 1.00 0.00 H new ATOM 0 HB3 LEU A 29 2.831 -2.763 7.168 1.00 0.00 H new ATOM 0 HG LEU A 29 1.213 -0.996 7.822 1.00 0.00 H new ATOM 0 HD11 LEU A 29 2.012 0.968 9.070 1.00 0.00 H new ATOM 0 HD12 LEU A 29 2.051 -0.509 10.063 1.00 0.00 H new ATOM 0 HD13 LEU A 29 3.558 0.141 9.375 1.00 0.00 H new ATOM 0 HD21 LEU A 29 2.360 0.843 6.636 1.00 0.00 H new ATOM 0 HD22 LEU A 29 3.913 0.000 6.844 1.00 0.00 H new ATOM 0 HD23 LEU A 29 2.634 -0.726 5.842 1.00 0.00 H new ATOM 461 N ALA A 30 0.577 -4.303 8.202 1.00 0.00 N ATOM 462 CA ALA A 30 -0.814 -4.678 7.972 1.00 0.00 C ATOM 463 C ALA A 30 -1.371 -5.458 9.163 1.00 0.00 C ATOM 464 O ALA A 30 -2.578 -5.461 9.412 1.00 0.00 O ATOM 465 CB ALA A 30 -0.941 -5.496 6.694 1.00 0.00 C ATOM 0 H ALA A 30 1.253 -4.837 7.655 1.00 0.00 H new ATOM 0 HA ALA A 30 -1.398 -3.765 7.859 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -1.985 -5.767 6.538 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -0.589 -4.906 5.848 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -0.340 -6.401 6.780 1.00 0.00 H new ATOM 471 N GLU A 31 -0.484 -6.135 9.885 1.00 0.00 N ATOM 472 CA GLU A 31 -0.855 -6.834 11.103 1.00 0.00 C ATOM 473 C GLU A 31 -1.110 -5.841 12.236 1.00 0.00 C ATOM 474 O GLU A 31 -1.859 -6.123 13.173 1.00 0.00 O ATOM 475 CB GLU A 31 0.258 -7.807 11.495 1.00 0.00 C ATOM 476 CG GLU A 31 0.333 -9.052 10.622 1.00 0.00 C ATOM 477 CD GLU A 31 -0.840 -9.985 10.842 1.00 0.00 C ATOM 478 OE1 GLU A 31 -1.966 -9.637 10.440 1.00 0.00 O ATOM 479 OE2 GLU A 31 -0.642 -11.075 11.417 1.00 0.00 O ATOM 0 H GLU A 31 0.504 -6.212 9.642 1.00 0.00 H new ATOM 0 HA GLU A 31 -1.774 -7.391 10.924 1.00 0.00 H new ATOM 0 HB2 GLU A 31 1.214 -7.286 11.448 1.00 0.00 H new ATOM 0 HB3 GLU A 31 0.111 -8.112 12.531 1.00 0.00 H new ATOM 0 HG2 GLU A 31 0.366 -8.755 9.574 1.00 0.00 H new ATOM 0 HG3 GLU A 31 1.261 -9.584 10.832 1.00 0.00 H new ATOM 486 N ASP A 32 -0.486 -4.673 12.139 1.00 0.00 N ATOM 487 CA ASP A 32 -0.598 -3.649 13.171 1.00 0.00 C ATOM 488 C ASP A 32 -1.350 -2.439 12.626 1.00 0.00 C ATOM 489 O ASP A 32 -0.868 -1.309 12.685 1.00 0.00 O ATOM 490 CB ASP A 32 0.796 -3.234 13.648 1.00 0.00 C ATOM 491 CG ASP A 32 0.800 -2.733 15.079 1.00 0.00 C ATOM 492 OD1 ASP A 32 0.625 -1.515 15.301 1.00 0.00 O ATOM 493 OD2 ASP A 32 0.992 -3.564 15.990 1.00 0.00 O ATOM 0 H ASP A 32 0.106 -4.410 11.351 1.00 0.00 H new ATOM 0 HA ASP A 32 -1.153 -4.055 14.017 1.00 0.00 H new ATOM 0 HB2 ASP A 32 1.473 -4.084 13.563 1.00 0.00 H new ATOM 0 HB3 ASP A 32 1.182 -2.453 12.993 1.00 0.00 H new ATOM 498 N LEU A 33 -2.535 -2.698 12.090 1.00 0.00 N ATOM 499 CA LEU A 33 -3.369 -1.661 11.493 1.00 0.00 C ATOM 500 C LEU A 33 -3.756 -0.575 12.496 1.00 0.00 C ATOM 501 O LEU A 33 -3.594 -0.754 13.704 1.00 0.00 O ATOM 502 CB LEU A 33 -4.566 -2.285 10.779 1.00 0.00 C ATOM 503 CG LEU A 33 -4.317 -2.578 9.297 1.00 0.00 C ATOM 504 CD1 LEU A 33 -5.566 -3.145 8.646 1.00 0.00 C ATOM 505 CD2 LEU A 33 -3.857 -1.314 8.570 1.00 0.00 C ATOM 0 H LEU A 33 -2.946 -3.631 12.056 1.00 0.00 H new ATOM 0 HA LEU A 33 -2.780 -1.143 10.736 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -4.835 -3.213 11.283 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -5.421 -1.615 10.869 1.00 0.00 H new ATOM 0 HG LEU A 33 -3.525 -3.324 9.223 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -5.368 -3.346 7.593 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -5.848 -4.072 9.146 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -6.380 -2.425 8.731 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -3.685 -1.542 7.518 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -4.626 -0.546 8.654 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -2.932 -0.952 9.019 1.00 0.00 H new ATOM 517 N PRO A 34 -4.349 0.535 11.991 1.00 0.00 N ATOM 518 CA PRO A 34 -4.061 1.888 12.396 1.00 0.00 C ATOM 519 C PRO A 34 -3.086 2.049 13.553 1.00 0.00 C ATOM 520 O PRO A 34 -3.313 1.625 14.684 1.00 0.00 O ATOM 521 CB PRO A 34 -5.462 2.383 12.726 1.00 0.00 C ATOM 522 CG PRO A 34 -6.326 1.722 11.685 1.00 0.00 C ATOM 523 CD PRO A 34 -5.506 0.588 11.090 1.00 0.00 C ATOM 0 HA PRO A 34 -3.531 2.449 11.626 1.00 0.00 H new ATOM 0 HB2 PRO A 34 -5.761 2.098 13.735 1.00 0.00 H new ATOM 0 HB3 PRO A 34 -5.527 3.470 12.670 1.00 0.00 H new ATOM 0 HG2 PRO A 34 -7.246 1.342 12.130 1.00 0.00 H new ATOM 0 HG3 PRO A 34 -6.616 2.435 10.914 1.00 0.00 H new ATOM 0 HD2 PRO A 34 -6.058 -0.352 11.081 1.00 0.00 H new ATOM 0 HD3 PRO A 34 -5.212 0.795 10.061 1.00 0.00 H new ATOM 531 N THR A 35 -2.049 2.783 13.203 1.00 0.00 N ATOM 532 CA THR A 35 -0.971 3.243 14.073 1.00 0.00 C ATOM 533 C THR A 35 0.036 3.937 13.168 1.00 0.00 C ATOM 534 O THR A 35 0.396 5.094 13.371 1.00 0.00 O ATOM 535 CB THR A 35 -0.263 2.102 14.860 1.00 0.00 C ATOM 536 OG1 THR A 35 -1.111 1.608 15.903 1.00 0.00 O ATOM 537 CG2 THR A 35 1.041 2.590 15.475 1.00 0.00 C ATOM 0 H THR A 35 -1.923 3.098 12.241 1.00 0.00 H new ATOM 0 HA THR A 35 -1.391 3.901 14.834 1.00 0.00 H new ATOM 0 HB THR A 35 -0.048 1.301 14.152 1.00 0.00 H new ATOM 0 HG1 THR A 35 -2.035 1.889 15.734 1.00 0.00 H new ATOM 0 HG21 THR A 35 1.515 1.773 16.019 1.00 0.00 H new ATOM 0 HG22 THR A 35 1.709 2.936 14.686 1.00 0.00 H new ATOM 0 HG23 THR A 35 0.835 3.411 16.161 1.00 0.00 H new ATOM 545 N GLY A 36 0.450 3.209 12.137 1.00 0.00 N ATOM 546 CA GLY A 36 1.276 3.774 11.092 1.00 0.00 C ATOM 547 C GLY A 36 0.622 3.654 9.725 1.00 0.00 C ATOM 548 O GLY A 36 1.311 3.595 8.711 1.00 0.00 O ATOM 0 H GLY A 36 0.223 2.223 12.008 1.00 0.00 H new ATOM 0 HA2 GLY A 36 1.470 4.824 11.311 1.00 0.00 H new ATOM 0 HA3 GLY A 36 2.241 3.268 11.078 1.00 0.00 H new ATOM 552 N TRP A 37 -0.714 3.610 9.701 1.00 0.00 N ATOM 553 CA TRP A 37 -1.472 3.509 8.454 1.00 0.00 C ATOM 554 C TRP A 37 -1.142 4.647 7.481 1.00 0.00 C ATOM 555 O TRP A 37 -1.207 4.468 6.267 1.00 0.00 O ATOM 556 CB TRP A 37 -2.980 3.487 8.745 1.00 0.00 C ATOM 557 CG TRP A 37 -3.477 4.683 9.509 1.00 0.00 C ATOM 558 CD1 TRP A 37 -3.518 4.833 10.867 1.00 0.00 C ATOM 559 CD2 TRP A 37 -4.006 5.899 8.960 1.00 0.00 C ATOM 560 NE1 TRP A 37 -4.039 6.058 11.193 1.00 0.00 N ATOM 561 CE2 TRP A 37 -4.344 6.734 10.041 1.00 0.00 C ATOM 562 CE3 TRP A 37 -4.218 6.366 7.659 1.00 0.00 C ATOM 563 CZ2 TRP A 37 -4.892 8.003 9.861 1.00 0.00 C ATOM 564 CZ3 TRP A 37 -4.762 7.625 7.482 1.00 0.00 C ATOM 565 CH2 TRP A 37 -5.090 8.432 8.577 1.00 0.00 C ATOM 0 H TRP A 37 -1.295 3.643 10.539 1.00 0.00 H new ATOM 0 HA TRP A 37 -1.181 2.574 7.976 1.00 0.00 H new ATOM 0 HB2 TRP A 37 -3.520 3.423 7.800 1.00 0.00 H new ATOM 0 HB3 TRP A 37 -3.217 2.585 9.309 1.00 0.00 H new ATOM 0 HD1 TRP A 37 -3.187 4.093 11.580 1.00 0.00 H new ATOM 0 HE1 TRP A 37 -4.177 6.410 12.140 1.00 0.00 H new ATOM 0 HE3 TRP A 37 -3.961 5.754 6.807 1.00 0.00 H new ATOM 0 HZ2 TRP A 37 -5.151 8.625 10.705 1.00 0.00 H new ATOM 0 HZ3 TRP A 37 -4.937 7.992 6.481 1.00 0.00 H new ATOM 0 HH2 TRP A 37 -5.508 9.413 8.405 1.00 0.00 H new ATOM 576 N ASN A 38 -0.782 5.810 8.013 1.00 0.00 N ATOM 577 CA ASN A 38 -0.418 6.947 7.173 1.00 0.00 C ATOM 578 C ASN A 38 0.883 6.653 6.433 1.00 0.00 C ATOM 579 O ASN A 38 1.111 7.128 5.324 1.00 0.00 O ATOM 580 CB ASN A 38 -0.277 8.217 8.024 1.00 0.00 C ATOM 581 CG ASN A 38 0.092 9.439 7.202 1.00 0.00 C ATOM 582 OD1 ASN A 38 1.269 9.746 7.015 1.00 0.00 O ATOM 583 ND2 ASN A 38 -0.913 10.153 6.715 1.00 0.00 N ATOM 0 H ASN A 38 -0.734 5.991 9.016 1.00 0.00 H new ATOM 0 HA ASN A 38 -1.208 7.111 6.440 1.00 0.00 H new ATOM 0 HB2 ASN A 38 -1.216 8.405 8.545 1.00 0.00 H new ATOM 0 HB3 ASN A 38 0.484 8.055 8.787 1.00 0.00 H new ATOM 0 HD21 ASN A 38 -0.724 10.990 6.163 1.00 0.00 H new ATOM 0 HD22 ASN A 38 -1.876 9.866 6.892 1.00 0.00 H new ATOM 590 N ARG A 39 1.708 5.818 7.048 1.00 0.00 N ATOM 591 CA ARG A 39 3.004 5.463 6.496 1.00 0.00 C ATOM 592 C ARG A 39 2.888 4.236 5.586 1.00 0.00 C ATOM 593 O ARG A 39 3.857 3.832 4.942 1.00 0.00 O ATOM 594 CB ARG A 39 4.002 5.240 7.645 1.00 0.00 C ATOM 595 CG ARG A 39 5.343 4.657 7.229 1.00 0.00 C ATOM 596 CD ARG A 39 6.466 5.166 8.114 1.00 0.00 C ATOM 597 NE ARG A 39 7.019 6.420 7.611 1.00 0.00 N ATOM 598 CZ ARG A 39 7.437 7.424 8.376 1.00 0.00 C ATOM 599 NH1 ARG A 39 7.273 7.384 9.691 1.00 0.00 N ATOM 600 NH2 ARG A 39 7.996 8.486 7.814 1.00 0.00 N ATOM 0 H ARG A 39 1.498 5.370 7.940 1.00 0.00 H new ATOM 0 HA ARG A 39 3.375 6.279 5.876 1.00 0.00 H new ATOM 0 HB2 ARG A 39 4.177 6.193 8.144 1.00 0.00 H new ATOM 0 HB3 ARG A 39 3.546 4.575 8.378 1.00 0.00 H new ATOM 0 HG2 ARG A 39 5.301 3.569 7.282 1.00 0.00 H new ATOM 0 HG3 ARG A 39 5.549 4.918 6.191 1.00 0.00 H new ATOM 0 HD2 ARG A 39 6.093 5.313 9.128 1.00 0.00 H new ATOM 0 HD3 ARG A 39 7.255 4.416 8.170 1.00 0.00 H new ATOM 0 HE ARG A 39 7.090 6.534 6.600 1.00 0.00 H new ATOM 0 HH11 ARG A 39 6.823 6.578 10.125 1.00 0.00 H new ATOM 0 HH12 ARG A 39 7.597 8.159 10.269 1.00 0.00 H new ATOM 0 HH21 ARG A 39 8.103 8.530 6.801 1.00 0.00 H new ATOM 0 HH22 ARG A 39 8.319 9.260 8.395 1.00 0.00 H new ATOM 614 N ILE A 40 1.686 3.671 5.508 1.00 0.00 N ATOM 615 CA ILE A 40 1.418 2.550 4.608 1.00 0.00 C ATOM 616 C ILE A 40 1.823 2.901 3.178 1.00 0.00 C ATOM 617 O ILE A 40 2.473 2.109 2.501 1.00 0.00 O ATOM 618 CB ILE A 40 -0.077 2.139 4.648 1.00 0.00 C ATOM 619 CG1 ILE A 40 -0.371 1.354 5.930 1.00 0.00 C ATOM 620 CG2 ILE A 40 -0.469 1.325 3.419 1.00 0.00 C ATOM 621 CD1 ILE A 40 -1.815 0.913 6.068 1.00 0.00 C ATOM 0 H ILE A 40 0.881 3.971 6.057 1.00 0.00 H new ATOM 0 HA ILE A 40 2.014 1.704 4.949 1.00 0.00 H new ATOM 0 HB ILE A 40 -0.677 3.049 4.642 1.00 0.00 H new ATOM 0 HG12 ILE A 40 0.271 0.474 5.960 1.00 0.00 H new ATOM 0 HG13 ILE A 40 -0.107 1.970 6.789 1.00 0.00 H new ATOM 0 HG21 ILE A 40 -1.523 1.055 3.482 1.00 0.00 H new ATOM 0 HG22 ILE A 40 -0.300 1.918 2.520 1.00 0.00 H new ATOM 0 HG23 ILE A 40 0.135 0.419 3.375 1.00 0.00 H new ATOM 0 HD11 ILE A 40 -1.940 0.364 7.001 1.00 0.00 H new ATOM 0 HD12 ILE A 40 -2.464 1.789 6.072 1.00 0.00 H new ATOM 0 HD13 ILE A 40 -2.080 0.269 5.230 1.00 0.00 H new ATOM 633 N MET A 41 1.467 4.107 2.747 1.00 0.00 N ATOM 634 CA MET A 41 1.804 4.580 1.409 1.00 0.00 C ATOM 635 C MET A 41 3.317 4.635 1.213 1.00 0.00 C ATOM 636 O MET A 41 3.823 4.359 0.126 1.00 0.00 O ATOM 637 CB MET A 41 1.194 5.966 1.176 1.00 0.00 C ATOM 638 CG MET A 41 1.552 6.580 -0.169 1.00 0.00 C ATOM 639 SD MET A 41 0.942 5.612 -1.564 1.00 0.00 S ATOM 640 CE MET A 41 -0.828 5.763 -1.332 1.00 0.00 C ATOM 0 H MET A 41 0.942 4.778 3.309 1.00 0.00 H new ATOM 0 HA MET A 41 1.392 3.878 0.684 1.00 0.00 H new ATOM 0 HB2 MET A 41 0.109 5.892 1.253 1.00 0.00 H new ATOM 0 HB3 MET A 41 1.525 6.636 1.970 1.00 0.00 H new ATOM 0 HG2 MET A 41 1.140 7.588 -0.224 1.00 0.00 H new ATOM 0 HG3 MET A 41 2.635 6.674 -0.244 1.00 0.00 H new ATOM 0 HE1 MET A 41 -1.307 5.947 -2.294 1.00 0.00 H new ATOM 0 HE2 MET A 41 -1.219 4.840 -0.903 1.00 0.00 H new ATOM 0 HE3 MET A 41 -1.037 6.594 -0.658 1.00 0.00 H new ATOM 650 N GLU A 42 4.031 4.974 2.276 1.00 0.00 N ATOM 651 CA GLU A 42 5.481 5.093 2.219 1.00 0.00 C ATOM 652 C GLU A 42 6.129 3.716 2.150 1.00 0.00 C ATOM 653 O GLU A 42 6.976 3.455 1.291 1.00 0.00 O ATOM 654 CB GLU A 42 5.995 5.836 3.450 1.00 0.00 C ATOM 655 CG GLU A 42 7.440 6.285 3.335 1.00 0.00 C ATOM 656 CD GLU A 42 7.968 6.858 4.630 1.00 0.00 C ATOM 657 OE1 GLU A 42 7.514 7.947 5.033 1.00 0.00 O ATOM 658 OE2 GLU A 42 8.819 6.208 5.266 1.00 0.00 O ATOM 0 H GLU A 42 3.628 5.172 3.192 1.00 0.00 H new ATOM 0 HA GLU A 42 5.743 5.653 1.321 1.00 0.00 H new ATOM 0 HB2 GLU A 42 5.366 6.709 3.625 1.00 0.00 H new ATOM 0 HB3 GLU A 42 5.893 5.190 4.322 1.00 0.00 H new ATOM 0 HG2 GLU A 42 8.058 5.439 3.036 1.00 0.00 H new ATOM 0 HG3 GLU A 42 7.524 7.034 2.548 1.00 0.00 H new ATOM 665 N VAL A 43 5.724 2.844 3.063 1.00 0.00 N ATOM 666 CA VAL A 43 6.271 1.493 3.132 1.00 0.00 C ATOM 667 C VAL A 43 5.928 0.700 1.874 1.00 0.00 C ATOM 668 O VAL A 43 6.804 0.094 1.260 1.00 0.00 O ATOM 669 CB VAL A 43 5.760 0.729 4.374 1.00 0.00 C ATOM 670 CG1 VAL A 43 6.350 -0.674 4.429 1.00 0.00 C ATOM 671 CG2 VAL A 43 6.095 1.489 5.648 1.00 0.00 C ATOM 0 H VAL A 43 5.016 3.047 3.769 1.00 0.00 H new ATOM 0 HA VAL A 43 7.353 1.596 3.211 1.00 0.00 H new ATOM 0 HB VAL A 43 4.676 0.645 4.293 1.00 0.00 H new ATOM 0 HG11 VAL A 43 5.975 -1.192 5.312 1.00 0.00 H new ATOM 0 HG12 VAL A 43 6.061 -1.226 3.535 1.00 0.00 H new ATOM 0 HG13 VAL A 43 7.437 -0.610 4.480 1.00 0.00 H new ATOM 0 HG21 VAL A 43 5.726 0.934 6.510 1.00 0.00 H new ATOM 0 HG22 VAL A 43 7.176 1.607 5.728 1.00 0.00 H new ATOM 0 HG23 VAL A 43 5.623 2.471 5.620 1.00 0.00 H new ATOM 681 N ALA A 44 4.659 0.730 1.479 1.00 0.00 N ATOM 682 CA ALA A 44 4.208 -0.013 0.310 1.00 0.00 C ATOM 683 C ALA A 44 4.916 0.469 -0.949 1.00 0.00 C ATOM 684 O ALA A 44 5.192 -0.315 -1.858 1.00 0.00 O ATOM 685 CB ALA A 44 2.704 0.107 0.157 1.00 0.00 C ATOM 0 H ALA A 44 3.927 1.260 1.951 1.00 0.00 H new ATOM 0 HA ALA A 44 4.460 -1.064 0.455 1.00 0.00 H new ATOM 0 HB1 ALA A 44 2.382 -0.453 -0.721 1.00 0.00 H new ATOM 0 HB2 ALA A 44 2.215 -0.295 1.044 1.00 0.00 H new ATOM 0 HB3 ALA A 44 2.433 1.156 0.037 1.00 0.00 H new ATOM 691 N GLU A 45 5.203 1.764 -0.992 1.00 0.00 N ATOM 692 CA GLU A 45 5.982 2.342 -2.077 1.00 0.00 C ATOM 693 C GLU A 45 7.336 1.647 -2.171 1.00 0.00 C ATOM 694 O GLU A 45 7.735 1.186 -3.239 1.00 0.00 O ATOM 695 CB GLU A 45 6.182 3.839 -1.841 1.00 0.00 C ATOM 696 CG GLU A 45 6.913 4.549 -2.966 1.00 0.00 C ATOM 697 CD GLU A 45 7.333 5.948 -2.572 1.00 0.00 C ATOM 698 OE1 GLU A 45 6.503 6.875 -2.672 1.00 0.00 O ATOM 699 OE2 GLU A 45 8.491 6.120 -2.136 1.00 0.00 O ATOM 0 H GLU A 45 4.906 2.436 -0.284 1.00 0.00 H new ATOM 0 HA GLU A 45 5.442 2.201 -3.013 1.00 0.00 H new ATOM 0 HB2 GLU A 45 5.208 4.308 -1.702 1.00 0.00 H new ATOM 0 HB3 GLU A 45 6.739 3.979 -0.914 1.00 0.00 H new ATOM 0 HG2 GLU A 45 7.793 3.972 -3.248 1.00 0.00 H new ATOM 0 HG3 GLU A 45 6.269 4.597 -3.844 1.00 0.00 H new ATOM 706 N LYS A 46 8.025 1.562 -1.034 1.00 0.00 N ATOM 707 CA LYS A 46 9.326 0.903 -0.958 1.00 0.00 C ATOM 708 C LYS A 46 9.223 -0.549 -1.395 1.00 0.00 C ATOM 709 O LYS A 46 10.011 -1.018 -2.215 1.00 0.00 O ATOM 710 CB LYS A 46 9.869 0.936 0.463 1.00 0.00 C ATOM 711 CG LYS A 46 10.131 2.323 0.997 1.00 0.00 C ATOM 712 CD LYS A 46 10.547 2.243 2.450 1.00 0.00 C ATOM 713 CE LYS A 46 10.693 3.614 3.081 1.00 0.00 C ATOM 714 NZ LYS A 46 11.060 3.521 4.519 1.00 0.00 N ATOM 0 H LYS A 46 7.700 1.945 -0.146 1.00 0.00 H new ATOM 0 HA LYS A 46 10.000 1.443 -1.623 1.00 0.00 H new ATOM 0 HB2 LYS A 46 9.160 0.434 1.122 1.00 0.00 H new ATOM 0 HB3 LYS A 46 10.797 0.365 0.498 1.00 0.00 H new ATOM 0 HG2 LYS A 46 10.913 2.806 0.411 1.00 0.00 H new ATOM 0 HG3 LYS A 46 9.235 2.936 0.899 1.00 0.00 H new ATOM 0 HD2 LYS A 46 9.808 1.666 3.006 1.00 0.00 H new ATOM 0 HD3 LYS A 46 11.493 1.707 2.526 1.00 0.00 H new ATOM 0 HE2 LYS A 46 11.455 4.181 2.547 1.00 0.00 H new ATOM 0 HE3 LYS A 46 9.757 4.163 2.979 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 11.151 4.478 4.917 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 10.320 3.001 5.033 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 11.966 3.019 4.614 1.00 0.00 H new ATOM 728 N THR A 47 8.247 -1.248 -0.829 1.00 0.00 N ATOM 729 CA THR A 47 8.039 -2.658 -1.110 1.00 0.00 C ATOM 730 C THR A 47 7.821 -2.896 -2.605 1.00 0.00 C ATOM 731 O THR A 47 8.457 -3.766 -3.204 1.00 0.00 O ATOM 732 CB THR A 47 6.832 -3.195 -0.311 1.00 0.00 C ATOM 733 OG1 THR A 47 6.930 -2.774 1.056 1.00 0.00 O ATOM 734 CG2 THR A 47 6.776 -4.712 -0.359 1.00 0.00 C ATOM 0 H THR A 47 7.581 -0.853 -0.165 1.00 0.00 H new ATOM 0 HA THR A 47 8.937 -3.195 -0.804 1.00 0.00 H new ATOM 0 HB THR A 47 5.924 -2.796 -0.763 1.00 0.00 H new ATOM 0 HG1 THR A 47 6.728 -1.817 1.119 1.00 0.00 H new ATOM 0 HG21 THR A 47 5.916 -5.063 0.212 1.00 0.00 H new ATOM 0 HG22 THR A 47 6.682 -5.040 -1.394 1.00 0.00 H new ATOM 0 HG23 THR A 47 7.689 -5.124 0.071 1.00 0.00 H new ATOM 742 N TYR A 48 6.944 -2.103 -3.213 1.00 0.00 N ATOM 743 CA TYR A 48 6.651 -2.251 -4.631 1.00 0.00 C ATOM 744 C TYR A 48 7.857 -1.848 -5.476 1.00 0.00 C ATOM 745 O TYR A 48 8.193 -2.526 -6.450 1.00 0.00 O ATOM 746 CB TYR A 48 5.426 -1.428 -5.027 1.00 0.00 C ATOM 747 CG TYR A 48 4.983 -1.673 -6.455 1.00 0.00 C ATOM 748 CD1 TYR A 48 4.586 -2.939 -6.864 1.00 0.00 C ATOM 749 CD2 TYR A 48 4.977 -0.649 -7.392 1.00 0.00 C ATOM 750 CE1 TYR A 48 4.195 -3.178 -8.165 1.00 0.00 C ATOM 751 CE2 TYR A 48 4.587 -0.880 -8.697 1.00 0.00 C ATOM 752 CZ TYR A 48 4.196 -2.149 -9.079 1.00 0.00 C ATOM 753 OH TYR A 48 3.808 -2.390 -10.378 1.00 0.00 O ATOM 0 H TYR A 48 6.428 -1.356 -2.748 1.00 0.00 H new ATOM 0 HA TYR A 48 6.431 -3.302 -4.819 1.00 0.00 H new ATOM 0 HB2 TYR A 48 4.603 -1.664 -4.352 1.00 0.00 H new ATOM 0 HB3 TYR A 48 5.650 -0.369 -4.899 1.00 0.00 H new ATOM 0 HD1 TYR A 48 4.583 -3.750 -6.151 1.00 0.00 H new ATOM 0 HD2 TYR A 48 5.282 0.344 -7.096 1.00 0.00 H new ATOM 0 HE1 TYR A 48 3.889 -4.169 -8.465 1.00 0.00 H new ATOM 0 HE2 TYR A 48 4.588 -0.073 -9.415 1.00 0.00 H new ATOM 0 HH TYR A 48 3.150 -3.117 -10.394 1.00 0.00 H new ATOM 763 N GLU A 49 8.510 -0.754 -5.089 1.00 0.00 N ATOM 764 CA GLU A 49 9.712 -0.293 -5.772 1.00 0.00 C ATOM 765 C GLU A 49 10.791 -1.364 -5.756 1.00 0.00 C ATOM 766 O GLU A 49 11.483 -1.562 -6.748 1.00 0.00 O ATOM 767 CB GLU A 49 10.239 0.987 -5.127 1.00 0.00 C ATOM 768 CG GLU A 49 9.723 2.255 -5.786 1.00 0.00 C ATOM 769 CD GLU A 49 10.264 2.433 -7.190 1.00 0.00 C ATOM 770 OE1 GLU A 49 9.628 1.951 -8.151 1.00 0.00 O ATOM 771 OE2 GLU A 49 11.332 3.064 -7.344 1.00 0.00 O ATOM 0 H GLU A 49 8.224 -0.170 -4.303 1.00 0.00 H new ATOM 0 HA GLU A 49 9.448 -0.083 -6.808 1.00 0.00 H new ATOM 0 HB2 GLU A 49 9.960 0.995 -4.073 1.00 0.00 H new ATOM 0 HB3 GLU A 49 11.328 0.983 -5.168 1.00 0.00 H new ATOM 0 HG2 GLU A 49 8.634 2.227 -5.819 1.00 0.00 H new ATOM 0 HG3 GLU A 49 10.002 3.117 -5.179 1.00 0.00 H new ATOM 778 N ALA A 50 10.920 -2.055 -4.631 1.00 0.00 N ATOM 779 CA ALA A 50 11.883 -3.140 -4.506 1.00 0.00 C ATOM 780 C ALA A 50 11.632 -4.212 -5.557 1.00 0.00 C ATOM 781 O ALA A 50 12.532 -4.571 -6.309 1.00 0.00 O ATOM 782 CB ALA A 50 11.830 -3.741 -3.109 1.00 0.00 C ATOM 0 H ALA A 50 10.368 -1.883 -3.791 1.00 0.00 H new ATOM 0 HA ALA A 50 12.880 -2.730 -4.670 1.00 0.00 H new ATOM 0 HB1 ALA A 50 12.556 -4.550 -3.033 1.00 0.00 H new ATOM 0 HB2 ALA A 50 12.065 -2.972 -2.373 1.00 0.00 H new ATOM 0 HB3 ALA A 50 10.830 -4.131 -2.919 1.00 0.00 H new ATOM 788 N TYR A 51 10.401 -4.705 -5.623 1.00 0.00 N ATOM 789 CA TYR A 51 10.054 -5.745 -6.577 1.00 0.00 C ATOM 790 C TYR A 51 10.227 -5.240 -8.002 1.00 0.00 C ATOM 791 O TYR A 51 10.653 -5.985 -8.883 1.00 0.00 O ATOM 792 CB TYR A 51 8.618 -6.216 -6.359 1.00 0.00 C ATOM 793 CG TYR A 51 8.358 -6.756 -4.970 1.00 0.00 C ATOM 794 CD1 TYR A 51 9.233 -7.658 -4.379 1.00 0.00 C ATOM 795 CD2 TYR A 51 7.248 -6.351 -4.247 1.00 0.00 C ATOM 796 CE1 TYR A 51 9.003 -8.143 -3.106 1.00 0.00 C ATOM 797 CE2 TYR A 51 7.014 -6.829 -2.974 1.00 0.00 C ATOM 798 CZ TYR A 51 7.892 -7.722 -2.408 1.00 0.00 C ATOM 799 OH TYR A 51 7.658 -8.196 -1.137 1.00 0.00 O ATOM 0 H TYR A 51 9.630 -4.401 -5.028 1.00 0.00 H new ATOM 0 HA TYR A 51 10.726 -6.589 -6.420 1.00 0.00 H new ATOM 0 HB2 TYR A 51 7.940 -5.384 -6.548 1.00 0.00 H new ATOM 0 HB3 TYR A 51 8.384 -6.990 -7.090 1.00 0.00 H new ATOM 0 HD1 TYR A 51 10.107 -7.985 -4.923 1.00 0.00 H new ATOM 0 HD2 TYR A 51 6.554 -5.650 -4.687 1.00 0.00 H new ATOM 0 HE1 TYR A 51 9.690 -8.848 -2.661 1.00 0.00 H new ATOM 0 HE2 TYR A 51 6.144 -6.502 -2.424 1.00 0.00 H new ATOM 0 HH TYR A 51 6.834 -7.799 -0.786 1.00 0.00 H new ATOM 809 N ARG A 52 9.904 -3.969 -8.216 1.00 0.00 N ATOM 810 CA ARG A 52 10.094 -3.343 -9.516 1.00 0.00 C ATOM 811 C ARG A 52 11.575 -3.305 -9.871 1.00 0.00 C ATOM 812 O ARG A 52 11.964 -3.682 -10.972 1.00 0.00 O ATOM 813 CB ARG A 52 9.517 -1.926 -9.523 1.00 0.00 C ATOM 814 CG ARG A 52 9.615 -1.243 -10.874 1.00 0.00 C ATOM 815 CD ARG A 52 8.824 -1.995 -11.934 1.00 0.00 C ATOM 816 NE ARG A 52 8.961 -1.391 -13.261 1.00 0.00 N ATOM 817 CZ ARG A 52 8.442 -1.912 -14.375 1.00 0.00 C ATOM 818 NH1 ARG A 52 7.735 -3.032 -14.323 1.00 0.00 N ATOM 819 NH2 ARG A 52 8.619 -1.304 -15.542 1.00 0.00 N ATOM 0 H ARG A 52 9.509 -3.353 -7.505 1.00 0.00 H new ATOM 0 HA ARG A 52 9.565 -3.936 -10.262 1.00 0.00 H new ATOM 0 HB2 ARG A 52 8.471 -1.966 -9.219 1.00 0.00 H new ATOM 0 HB3 ARG A 52 10.042 -1.324 -8.781 1.00 0.00 H new ATOM 0 HG2 ARG A 52 9.242 -0.222 -10.795 1.00 0.00 H new ATOM 0 HG3 ARG A 52 10.660 -1.178 -11.176 1.00 0.00 H new ATOM 0 HD2 ARG A 52 9.163 -3.030 -11.971 1.00 0.00 H new ATOM 0 HD3 ARG A 52 7.771 -2.015 -11.653 1.00 0.00 H new ATOM 0 HE ARG A 52 9.485 -0.519 -13.339 1.00 0.00 H new ATOM 0 HH11 ARG A 52 7.585 -3.500 -13.429 1.00 0.00 H new ATOM 0 HH12 ARG A 52 7.340 -3.426 -15.177 1.00 0.00 H new ATOM 0 HH21 ARG A 52 9.153 -0.436 -15.589 1.00 0.00 H new ATOM 0 HH22 ARG A 52 8.221 -1.705 -16.391 1.00 0.00 H new ATOM 833 N GLN A 53 12.386 -2.842 -8.927 1.00 0.00 N ATOM 834 CA GLN A 53 13.841 -2.825 -9.078 1.00 0.00 C ATOM 835 C GLN A 53 14.372 -4.206 -9.449 1.00 0.00 C ATOM 836 O GLN A 53 15.152 -4.340 -10.389 1.00 0.00 O ATOM 837 CB GLN A 53 14.502 -2.336 -7.786 1.00 0.00 C ATOM 838 CG GLN A 53 14.347 -0.842 -7.560 1.00 0.00 C ATOM 839 CD GLN A 53 14.774 -0.401 -6.171 1.00 0.00 C ATOM 840 OE1 GLN A 53 15.648 -1.008 -5.545 1.00 0.00 O ATOM 841 NE2 GLN A 53 14.159 0.661 -5.678 1.00 0.00 N ATOM 0 H GLN A 53 12.057 -2.468 -8.037 1.00 0.00 H new ATOM 0 HA GLN A 53 14.088 -2.138 -9.887 1.00 0.00 H new ATOM 0 HB2 GLN A 53 14.070 -2.871 -6.940 1.00 0.00 H new ATOM 0 HB3 GLN A 53 15.563 -2.584 -7.812 1.00 0.00 H new ATOM 0 HG2 GLN A 53 14.938 -0.305 -8.302 1.00 0.00 H new ATOM 0 HG3 GLN A 53 13.305 -0.563 -7.719 1.00 0.00 H new ATOM 0 HE21 GLN A 53 13.442 1.135 -6.227 1.00 0.00 H new ATOM 0 HE22 GLN A 53 14.402 1.006 -4.749 1.00 0.00 H new ATOM 850 N LEU A 54 13.939 -5.228 -8.715 1.00 0.00 N ATOM 851 CA LEU A 54 14.342 -6.597 -9.006 1.00 0.00 C ATOM 852 C LEU A 54 13.937 -7.000 -10.421 1.00 0.00 C ATOM 853 O LEU A 54 14.750 -7.515 -11.186 1.00 0.00 O ATOM 854 CB LEU A 54 13.726 -7.579 -8.001 1.00 0.00 C ATOM 855 CG LEU A 54 14.558 -7.862 -6.745 1.00 0.00 C ATOM 856 CD1 LEU A 54 14.586 -6.654 -5.824 1.00 0.00 C ATOM 857 CD2 LEU A 54 14.015 -9.082 -6.015 1.00 0.00 C ATOM 0 H LEU A 54 13.311 -5.132 -7.917 1.00 0.00 H new ATOM 0 HA LEU A 54 15.428 -6.638 -8.923 1.00 0.00 H new ATOM 0 HB2 LEU A 54 12.756 -7.190 -7.691 1.00 0.00 H new ATOM 0 HB3 LEU A 54 13.542 -8.524 -8.512 1.00 0.00 H new ATOM 0 HG LEU A 54 15.582 -8.069 -7.055 1.00 0.00 H new ATOM 0 HD11 LEU A 54 15.183 -6.883 -4.941 1.00 0.00 H new ATOM 0 HD12 LEU A 54 15.026 -5.806 -6.349 1.00 0.00 H new ATOM 0 HD13 LEU A 54 13.569 -6.405 -5.520 1.00 0.00 H new ATOM 0 HD21 LEU A 54 14.616 -9.271 -5.125 1.00 0.00 H new ATOM 0 HD22 LEU A 54 12.981 -8.901 -5.723 1.00 0.00 H new ATOM 0 HD23 LEU A 54 14.059 -9.950 -6.673 1.00 0.00 H new ATOM 869 N ASP A 55 12.681 -6.743 -10.764 1.00 0.00 N ATOM 870 CA ASP A 55 12.135 -7.147 -12.056 1.00 0.00 C ATOM 871 C ASP A 55 12.828 -6.409 -13.200 1.00 0.00 C ATOM 872 O ASP A 55 13.206 -7.017 -14.202 1.00 0.00 O ATOM 873 CB ASP A 55 10.628 -6.891 -12.096 1.00 0.00 C ATOM 874 CG ASP A 55 9.971 -7.528 -13.301 1.00 0.00 C ATOM 875 OD1 ASP A 55 9.839 -8.769 -13.320 1.00 0.00 O ATOM 876 OD2 ASP A 55 9.570 -6.798 -14.229 1.00 0.00 O ATOM 0 H ASP A 55 12.018 -6.254 -10.163 1.00 0.00 H new ATOM 0 HA ASP A 55 12.317 -8.214 -12.183 1.00 0.00 H new ATOM 0 HB2 ASP A 55 10.171 -7.281 -11.187 1.00 0.00 H new ATOM 0 HB3 ASP A 55 10.444 -5.817 -12.110 1.00 0.00 H new ATOM 881 N GLU A 56 13.012 -5.104 -13.034 1.00 0.00 N ATOM 882 CA GLU A 56 13.682 -4.284 -14.007 1.00 0.00 C ATOM 883 C GLU A 56 15.123 -4.748 -14.199 1.00 0.00 C ATOM 884 O GLU A 56 15.638 -4.797 -15.322 1.00 0.00 O ATOM 885 CB GLU A 56 13.644 -2.843 -13.517 1.00 0.00 C ATOM 886 CG GLU A 56 14.095 -1.865 -14.557 1.00 0.00 C ATOM 887 CD GLU A 56 14.256 -0.458 -14.021 1.00 0.00 C ATOM 888 OE1 GLU A 56 15.363 -0.119 -13.562 1.00 0.00 O ATOM 889 OE2 GLU A 56 13.283 0.321 -14.065 1.00 0.00 O ATOM 0 H GLU A 56 12.694 -4.592 -12.211 1.00 0.00 H new ATOM 0 HA GLU A 56 13.181 -4.364 -14.972 1.00 0.00 H new ATOM 0 HB2 GLU A 56 12.628 -2.596 -13.208 1.00 0.00 H new ATOM 0 HB3 GLU A 56 14.278 -2.747 -12.635 1.00 0.00 H new ATOM 0 HG2 GLU A 56 15.045 -2.199 -14.974 1.00 0.00 H new ATOM 0 HG3 GLU A 56 13.374 -1.855 -15.375 1.00 0.00 H new ATOM 896 N PHE A 57 15.765 -5.099 -13.095 1.00 0.00 N ATOM 897 CA PHE A 57 17.125 -5.611 -13.123 1.00 0.00 C ATOM 898 C PHE A 57 17.163 -6.953 -13.853 1.00 0.00 C ATOM 899 O PHE A 57 18.072 -7.223 -14.635 1.00 0.00 O ATOM 900 CB PHE A 57 17.648 -5.757 -11.691 1.00 0.00 C ATOM 901 CG PHE A 57 19.120 -6.032 -11.595 1.00 0.00 C ATOM 902 CD1 PHE A 57 20.035 -5.196 -12.215 1.00 0.00 C ATOM 903 CD2 PHE A 57 19.588 -7.119 -10.875 1.00 0.00 C ATOM 904 CE1 PHE A 57 21.390 -5.441 -12.120 1.00 0.00 C ATOM 905 CE2 PHE A 57 20.943 -7.367 -10.774 1.00 0.00 C ATOM 906 CZ PHE A 57 21.845 -6.527 -11.397 1.00 0.00 C ATOM 0 H PHE A 57 15.360 -5.037 -12.161 1.00 0.00 H new ATOM 0 HA PHE A 57 17.766 -4.912 -13.660 1.00 0.00 H new ATOM 0 HB2 PHE A 57 17.425 -4.843 -11.140 1.00 0.00 H new ATOM 0 HB3 PHE A 57 17.107 -6.566 -11.200 1.00 0.00 H new ATOM 0 HD1 PHE A 57 19.684 -4.344 -12.778 1.00 0.00 H new ATOM 0 HD2 PHE A 57 18.886 -7.779 -10.388 1.00 0.00 H new ATOM 0 HE1 PHE A 57 22.094 -4.785 -12.610 1.00 0.00 H new ATOM 0 HE2 PHE A 57 21.297 -8.217 -10.209 1.00 0.00 H new ATOM 0 HZ PHE A 57 22.905 -6.719 -11.319 1.00 0.00 H new ATOM 916 N ARG A 58 16.153 -7.780 -13.603 1.00 0.00 N ATOM 917 CA ARG A 58 16.025 -9.076 -14.250 1.00 0.00 C ATOM 918 C ARG A 58 15.794 -8.917 -15.751 1.00 0.00 C ATOM 919 O ARG A 58 16.400 -9.627 -16.551 1.00 0.00 O ATOM 920 CB ARG A 58 14.878 -9.858 -13.607 1.00 0.00 C ATOM 921 CG ARG A 58 15.219 -10.438 -12.242 1.00 0.00 C ATOM 922 CD ARG A 58 15.763 -11.861 -12.337 1.00 0.00 C ATOM 923 NE ARG A 58 16.994 -11.962 -13.126 1.00 0.00 N ATOM 924 CZ ARG A 58 17.706 -13.086 -13.241 1.00 0.00 C ATOM 925 NH1 ARG A 58 17.360 -14.166 -12.551 1.00 0.00 N ATOM 926 NH2 ARG A 58 18.778 -13.120 -14.023 1.00 0.00 N ATOM 0 H ARG A 58 15.402 -7.569 -12.946 1.00 0.00 H new ATOM 0 HA ARG A 58 16.954 -9.629 -14.115 1.00 0.00 H new ATOM 0 HB2 ARG A 58 14.014 -9.201 -13.507 1.00 0.00 H new ATOM 0 HB3 ARG A 58 14.586 -10.669 -14.273 1.00 0.00 H new ATOM 0 HG2 ARG A 58 15.956 -9.801 -11.753 1.00 0.00 H new ATOM 0 HG3 ARG A 58 14.328 -10.433 -11.615 1.00 0.00 H new ATOM 0 HD2 ARG A 58 15.953 -12.237 -11.332 1.00 0.00 H new ATOM 0 HD3 ARG A 58 15.002 -12.504 -12.780 1.00 0.00 H new ATOM 0 HE ARG A 58 17.325 -11.129 -13.613 1.00 0.00 H new ATOM 0 HH11 ARG A 58 16.550 -14.138 -11.932 1.00 0.00 H new ATOM 0 HH12 ARG A 58 17.905 -15.024 -12.640 1.00 0.00 H new ATOM 0 HH21 ARG A 58 19.060 -12.286 -14.538 1.00 0.00 H new ATOM 0 HH22 ARG A 58 19.320 -13.980 -14.109 1.00 0.00 H new ATOM 940 N LYS A 59 14.928 -7.975 -16.126 1.00 0.00 N ATOM 941 CA LYS A 59 14.644 -7.702 -17.534 1.00 0.00 C ATOM 942 C LYS A 59 15.914 -7.320 -18.286 1.00 0.00 C ATOM 943 O LYS A 59 16.212 -7.868 -19.352 1.00 0.00 O ATOM 944 CB LYS A 59 13.626 -6.567 -17.677 1.00 0.00 C ATOM 945 CG LYS A 59 12.223 -7.018 -18.054 1.00 0.00 C ATOM 946 CD LYS A 59 11.527 -7.739 -16.915 1.00 0.00 C ATOM 947 CE LYS A 59 10.094 -8.085 -17.281 1.00 0.00 C ATOM 948 NZ LYS A 59 9.359 -8.677 -16.137 1.00 0.00 N ATOM 0 H LYS A 59 14.410 -7.387 -15.472 1.00 0.00 H new ATOM 0 HA LYS A 59 14.232 -8.616 -17.961 1.00 0.00 H new ATOM 0 HB2 LYS A 59 13.577 -6.020 -16.735 1.00 0.00 H new ATOM 0 HB3 LYS A 59 13.984 -5.868 -18.433 1.00 0.00 H new ATOM 0 HG2 LYS A 59 11.631 -6.151 -18.348 1.00 0.00 H new ATOM 0 HG3 LYS A 59 12.276 -7.677 -18.921 1.00 0.00 H new ATOM 0 HD2 LYS A 59 12.073 -8.650 -16.670 1.00 0.00 H new ATOM 0 HD3 LYS A 59 11.537 -7.112 -16.024 1.00 0.00 H new ATOM 0 HE2 LYS A 59 9.578 -7.186 -17.618 1.00 0.00 H new ATOM 0 HE3 LYS A 59 10.092 -8.786 -18.116 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 8.561 -9.242 -16.492 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 10.000 -9.287 -15.591 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 8.999 -7.917 -15.525 1.00 0.00 H new ATOM 962 N SER A 60 16.665 -6.384 -17.721 1.00 0.00 N ATOM 963 CA SER A 60 17.844 -5.854 -18.387 1.00 0.00 C ATOM 964 C SER A 60 18.953 -6.899 -18.485 1.00 0.00 C ATOM 965 O SER A 60 19.575 -7.060 -19.537 1.00 0.00 O ATOM 966 CB SER A 60 18.335 -4.590 -17.672 1.00 0.00 C ATOM 967 OG SER A 60 18.331 -4.753 -16.260 1.00 0.00 O ATOM 0 H SER A 60 16.478 -5.978 -16.804 1.00 0.00 H new ATOM 0 HA SER A 60 17.565 -5.588 -19.406 1.00 0.00 H new ATOM 0 HB2 SER A 60 19.344 -4.350 -18.008 1.00 0.00 H new ATOM 0 HB3 SER A 60 17.699 -3.747 -17.943 1.00 0.00 H new ATOM 0 HG SER A 60 17.422 -4.624 -15.918 1.00 0.00 H new ATOM 973 N THR A 61 19.178 -7.628 -17.404 1.00 0.00 N ATOM 974 CA THR A 61 20.232 -8.629 -17.384 1.00 0.00 C ATOM 975 C THR A 61 19.877 -9.821 -18.284 1.00 0.00 C ATOM 976 O THR A 61 20.749 -10.389 -18.939 1.00 0.00 O ATOM 977 CB THR A 61 20.550 -9.114 -15.947 1.00 0.00 C ATOM 978 OG1 THR A 61 21.710 -9.952 -15.962 1.00 0.00 O ATOM 979 CG2 THR A 61 19.385 -9.882 -15.342 1.00 0.00 C ATOM 0 H THR A 61 18.650 -7.547 -16.535 1.00 0.00 H new ATOM 0 HA THR A 61 21.130 -8.150 -17.775 1.00 0.00 H new ATOM 0 HB THR A 61 20.732 -8.231 -15.334 1.00 0.00 H new ATOM 0 HG1 THR A 61 21.648 -10.610 -15.238 1.00 0.00 H new ATOM 0 HG21 THR A 61 19.646 -10.205 -14.334 1.00 0.00 H new ATOM 0 HG22 THR A 61 18.507 -9.237 -15.300 1.00 0.00 H new ATOM 0 HG23 THR A 61 19.165 -10.754 -15.958 1.00 0.00 H new ATOM 1204 N ALA B 5 -27.899 14.458 10.652 1.00 0.00 N ATOM 1205 CA ALA B 5 -27.626 13.231 11.402 1.00 0.00 C ATOM 1206 C ALA B 5 -27.906 11.970 10.586 1.00 0.00 C ATOM 1207 O ALA B 5 -27.195 10.972 10.707 1.00 0.00 O ATOM 1208 CB ALA B 5 -28.443 13.213 12.684 1.00 0.00 C ATOM 0 HA ALA B 5 -26.562 13.230 11.640 1.00 0.00 H new ATOM 0 HB1 ALA B 5 -28.234 12.297 13.236 1.00 0.00 H new ATOM 0 HB2 ALA B 5 -28.177 14.074 13.297 1.00 0.00 H new ATOM 0 HB3 ALA B 5 -29.504 13.255 12.440 1.00 0.00 H new ATOM 1214 N GLU B 6 -28.936 12.022 9.754 1.00 0.00 N ATOM 1215 CA GLU B 6 -29.328 10.870 8.952 1.00 0.00 C ATOM 1216 C GLU B 6 -28.340 10.644 7.821 1.00 0.00 C ATOM 1217 O GLU B 6 -27.816 9.543 7.644 1.00 0.00 O ATOM 1218 CB GLU B 6 -30.735 11.082 8.399 1.00 0.00 C ATOM 1219 CG GLU B 6 -31.771 11.250 9.490 1.00 0.00 C ATOM 1220 CD GLU B 6 -33.155 11.533 8.952 1.00 0.00 C ATOM 1221 OE1 GLU B 6 -33.764 10.620 8.350 1.00 0.00 O ATOM 1222 OE2 GLU B 6 -33.652 12.661 9.148 1.00 0.00 O ATOM 0 H GLU B 6 -29.516 12.849 9.616 1.00 0.00 H new ATOM 0 HA GLU B 6 -29.326 9.983 9.585 1.00 0.00 H new ATOM 0 HB2 GLU B 6 -30.741 11.964 7.759 1.00 0.00 H new ATOM 0 HB3 GLU B 6 -31.007 10.232 7.773 1.00 0.00 H new ATOM 0 HG2 GLU B 6 -31.801 10.345 10.097 1.00 0.00 H new ATOM 0 HG3 GLU B 6 -31.469 12.065 10.148 1.00 0.00 H new ATOM 1229 N GLU B 7 -28.087 11.703 7.071 1.00 0.00 N ATOM 1230 CA GLU B 7 -27.117 11.673 5.995 1.00 0.00 C ATOM 1231 C GLU B 7 -25.733 11.332 6.533 1.00 0.00 C ATOM 1232 O GLU B 7 -24.976 10.590 5.909 1.00 0.00 O ATOM 1233 CB GLU B 7 -27.098 13.028 5.304 1.00 0.00 C ATOM 1234 CG GLU B 7 -28.384 13.356 4.564 1.00 0.00 C ATOM 1235 CD GLU B 7 -28.316 14.688 3.850 1.00 0.00 C ATOM 1236 OE1 GLU B 7 -27.548 14.803 2.869 1.00 0.00 O ATOM 1237 OE2 GLU B 7 -29.037 15.620 4.256 1.00 0.00 O ATOM 0 H GLU B 7 -28.548 12.605 7.192 1.00 0.00 H new ATOM 0 HA GLU B 7 -27.399 10.903 5.277 1.00 0.00 H new ATOM 0 HB2 GLU B 7 -26.910 13.802 6.048 1.00 0.00 H new ATOM 0 HB3 GLU B 7 -26.267 13.055 4.599 1.00 0.00 H new ATOM 0 HG2 GLU B 7 -28.594 12.569 3.840 1.00 0.00 H new ATOM 0 HG3 GLU B 7 -29.214 13.368 5.271 1.00 0.00 H new ATOM 1244 N LEU B 8 -25.425 11.874 7.704 1.00 0.00 N ATOM 1245 CA LEU B 8 -24.173 11.611 8.387 1.00 0.00 C ATOM 1246 C LEU B 8 -23.985 10.112 8.566 1.00 0.00 C ATOM 1247 O LEU B 8 -22.962 9.550 8.182 1.00 0.00 O ATOM 1248 CB LEU B 8 -24.206 12.294 9.760 1.00 0.00 C ATOM 1249 CG LEU B 8 -22.861 12.731 10.339 1.00 0.00 C ATOM 1250 CD1 LEU B 8 -23.074 13.457 11.655 1.00 0.00 C ATOM 1251 CD2 LEU B 8 -21.921 11.551 10.540 1.00 0.00 C ATOM 0 H LEU B 8 -26.043 12.512 8.206 1.00 0.00 H new ATOM 0 HA LEU B 8 -23.344 12.002 7.797 1.00 0.00 H new ATOM 0 HB2 LEU B 8 -24.848 13.172 9.688 1.00 0.00 H new ATOM 0 HB3 LEU B 8 -24.677 11.612 10.468 1.00 0.00 H new ATOM 0 HG LEU B 8 -22.395 13.406 9.621 1.00 0.00 H new ATOM 0 HD11 LEU B 8 -22.110 13.765 12.061 1.00 0.00 H new ATOM 0 HD12 LEU B 8 -23.696 14.337 11.489 1.00 0.00 H new ATOM 0 HD13 LEU B 8 -23.569 12.791 12.362 1.00 0.00 H new ATOM 0 HD21 LEU B 8 -20.976 11.905 10.953 1.00 0.00 H new ATOM 0 HD22 LEU B 8 -22.374 10.838 11.229 1.00 0.00 H new ATOM 0 HD23 LEU B 8 -21.738 11.064 9.582 1.00 0.00 H new ATOM 1263 N LYS B 9 -25.001 9.469 9.123 1.00 0.00 N ATOM 1264 CA LYS B 9 -24.926 8.056 9.450 1.00 0.00 C ATOM 1265 C LYS B 9 -24.832 7.215 8.186 1.00 0.00 C ATOM 1266 O LYS B 9 -24.055 6.265 8.123 1.00 0.00 O ATOM 1267 CB LYS B 9 -26.146 7.636 10.275 1.00 0.00 C ATOM 1268 CG LYS B 9 -25.924 6.392 11.119 1.00 0.00 C ATOM 1269 CD LYS B 9 -24.785 6.603 12.104 1.00 0.00 C ATOM 1270 CE LYS B 9 -24.659 5.450 13.084 1.00 0.00 C ATOM 1271 NZ LYS B 9 -25.885 5.293 13.907 1.00 0.00 N ATOM 0 H LYS B 9 -25.891 9.908 9.358 1.00 0.00 H new ATOM 0 HA LYS B 9 -24.026 7.889 10.042 1.00 0.00 H new ATOM 0 HB2 LYS B 9 -26.430 8.460 10.929 1.00 0.00 H new ATOM 0 HB3 LYS B 9 -26.984 7.460 9.601 1.00 0.00 H new ATOM 0 HG2 LYS B 9 -26.838 6.147 11.660 1.00 0.00 H new ATOM 0 HG3 LYS B 9 -25.699 5.544 10.472 1.00 0.00 H new ATOM 0 HD2 LYS B 9 -23.849 6.718 11.557 1.00 0.00 H new ATOM 0 HD3 LYS B 9 -24.948 7.530 12.654 1.00 0.00 H new ATOM 0 HE2 LYS B 9 -24.467 4.527 12.537 1.00 0.00 H new ATOM 0 HE3 LYS B 9 -23.802 5.618 13.736 1.00 0.00 H new ATOM 0 HZ1 LYS B 9 -25.667 4.722 14.749 1.00 0.00 H new ATOM 0 HZ2 LYS B 9 -26.227 6.230 14.203 1.00 0.00 H new ATOM 0 HZ3 LYS B 9 -26.621 4.817 13.347 1.00 0.00 H new ATOM 1285 N ALA B 10 -25.613 7.583 7.177 1.00 0.00 N ATOM 1286 CA ALA B 10 -25.619 6.862 5.910 1.00 0.00 C ATOM 1287 C ALA B 10 -24.285 7.009 5.181 1.00 0.00 C ATOM 1288 O ALA B 10 -23.776 6.047 4.598 1.00 0.00 O ATOM 1289 CB ALA B 10 -26.760 7.352 5.032 1.00 0.00 C ATOM 0 H ALA B 10 -26.251 8.378 7.212 1.00 0.00 H new ATOM 0 HA ALA B 10 -25.767 5.804 6.125 1.00 0.00 H new ATOM 0 HB1 ALA B 10 -26.754 6.806 4.089 1.00 0.00 H new ATOM 0 HB2 ALA B 10 -27.709 7.185 5.542 1.00 0.00 H new ATOM 0 HB3 ALA B 10 -26.636 8.417 4.835 1.00 0.00 H new ATOM 1295 N LYS B 11 -23.719 8.210 5.221 1.00 0.00 N ATOM 1296 CA LYS B 11 -22.454 8.485 4.547 1.00 0.00 C ATOM 1297 C LYS B 11 -21.306 7.829 5.305 1.00 0.00 C ATOM 1298 O LYS B 11 -20.435 7.194 4.707 1.00 0.00 O ATOM 1299 CB LYS B 11 -22.222 9.996 4.434 1.00 0.00 C ATOM 1300 CG LYS B 11 -21.165 10.384 3.406 1.00 0.00 C ATOM 1301 CD LYS B 11 -21.577 9.966 2.002 1.00 0.00 C ATOM 1302 CE LYS B 11 -20.575 10.426 0.952 1.00 0.00 C ATOM 1303 NZ LYS B 11 -20.509 11.909 0.841 1.00 0.00 N ATOM 0 H LYS B 11 -24.116 9.010 5.713 1.00 0.00 H new ATOM 0 HA LYS B 11 -22.497 8.068 3.541 1.00 0.00 H new ATOM 0 HB2 LYS B 11 -23.163 10.480 4.173 1.00 0.00 H new ATOM 0 HB3 LYS B 11 -21.925 10.382 5.409 1.00 0.00 H new ATOM 0 HG2 LYS B 11 -21.006 11.462 3.434 1.00 0.00 H new ATOM 0 HG3 LYS B 11 -20.215 9.915 3.663 1.00 0.00 H new ATOM 0 HD2 LYS B 11 -21.673 8.881 1.960 1.00 0.00 H new ATOM 0 HD3 LYS B 11 -22.558 10.382 1.773 1.00 0.00 H new ATOM 0 HE2 LYS B 11 -19.587 10.039 1.202 1.00 0.00 H new ATOM 0 HE3 LYS B 11 -20.847 10.004 -0.015 1.00 0.00 H new ATOM 0 HZ1 LYS B 11 -19.961 12.170 -0.003 1.00 0.00 H new ATOM 0 HZ2 LYS B 11 -21.472 12.294 0.761 1.00 0.00 H new ATOM 0 HZ3 LYS B 11 -20.049 12.300 1.687 1.00 0.00 H new ATOM 1317 N LEU B 12 -21.321 7.978 6.627 1.00 0.00 N ATOM 1318 CA LEU B 12 -20.318 7.360 7.485 1.00 0.00 C ATOM 1319 C LEU B 12 -20.345 5.847 7.317 1.00 0.00 C ATOM 1320 O LEU B 12 -19.302 5.205 7.247 1.00 0.00 O ATOM 1321 CB LEU B 12 -20.572 7.727 8.950 1.00 0.00 C ATOM 1322 CG LEU B 12 -19.585 7.130 9.958 1.00 0.00 C ATOM 1323 CD1 LEU B 12 -18.178 7.650 9.707 1.00 0.00 C ATOM 1324 CD2 LEU B 12 -20.023 7.442 11.382 1.00 0.00 C ATOM 0 H LEU B 12 -22.021 8.525 7.128 1.00 0.00 H new ATOM 0 HA LEU B 12 -19.335 7.732 7.195 1.00 0.00 H new ATOM 0 HB2 LEU B 12 -20.549 8.813 9.044 1.00 0.00 H new ATOM 0 HB3 LEU B 12 -21.578 7.405 9.218 1.00 0.00 H new ATOM 0 HG LEU B 12 -19.577 6.048 9.828 1.00 0.00 H new ATOM 0 HD11 LEU B 12 -17.494 7.213 10.434 1.00 0.00 H new ATOM 0 HD12 LEU B 12 -17.862 7.375 8.701 1.00 0.00 H new ATOM 0 HD13 LEU B 12 -18.168 8.735 9.806 1.00 0.00 H new ATOM 0 HD21 LEU B 12 -19.310 7.010 12.085 1.00 0.00 H new ATOM 0 HD22 LEU B 12 -20.062 8.522 11.522 1.00 0.00 H new ATOM 0 HD23 LEU B 12 -21.011 7.017 11.560 1.00 0.00 H new ATOM 1336 N LYS B 13 -21.550 5.293 7.246 1.00 0.00 N ATOM 1337 CA LYS B 13 -21.737 3.864 7.042 1.00 0.00 C ATOM 1338 C LYS B 13 -21.060 3.409 5.754 1.00 0.00 C ATOM 1339 O LYS B 13 -20.287 2.448 5.753 1.00 0.00 O ATOM 1340 CB LYS B 13 -23.230 3.549 6.992 1.00 0.00 C ATOM 1341 CG LYS B 13 -23.559 2.072 6.855 1.00 0.00 C ATOM 1342 CD LYS B 13 -25.047 1.831 7.054 1.00 0.00 C ATOM 1343 CE LYS B 13 -25.442 0.404 6.719 1.00 0.00 C ATOM 1344 NZ LYS B 13 -25.240 0.095 5.279 1.00 0.00 N ATOM 0 H LYS B 13 -22.420 5.820 7.328 1.00 0.00 H new ATOM 0 HA LYS B 13 -21.280 3.327 7.873 1.00 0.00 H new ATOM 0 HB2 LYS B 13 -23.699 3.930 7.899 1.00 0.00 H new ATOM 0 HB3 LYS B 13 -23.674 4.086 6.154 1.00 0.00 H new ATOM 0 HG2 LYS B 13 -23.257 1.717 5.870 1.00 0.00 H new ATOM 0 HG3 LYS B 13 -22.992 1.499 7.588 1.00 0.00 H new ATOM 0 HD2 LYS B 13 -25.314 2.048 8.088 1.00 0.00 H new ATOM 0 HD3 LYS B 13 -25.613 2.520 6.427 1.00 0.00 H new ATOM 0 HE2 LYS B 13 -24.855 -0.287 7.324 1.00 0.00 H new ATOM 0 HE3 LYS B 13 -26.488 0.246 6.981 1.00 0.00 H new ATOM 0 HZ1 LYS B 13 -25.774 -0.762 5.029 1.00 0.00 H new ATOM 0 HZ2 LYS B 13 -25.576 0.893 4.702 1.00 0.00 H new ATOM 0 HZ3 LYS B 13 -24.228 -0.063 5.096 1.00 0.00 H new ATOM 1358 N LYS B 14 -21.358 4.109 4.667 1.00 0.00 N ATOM 1359 CA LYS B 14 -20.788 3.802 3.364 1.00 0.00 C ATOM 1360 C LYS B 14 -19.260 3.873 3.391 1.00 0.00 C ATOM 1361 O LYS B 14 -18.578 2.976 2.889 1.00 0.00 O ATOM 1362 CB LYS B 14 -21.341 4.778 2.324 1.00 0.00 C ATOM 1363 CG LYS B 14 -21.063 4.379 0.884 1.00 0.00 C ATOM 1364 CD LYS B 14 -22.099 3.395 0.344 1.00 0.00 C ATOM 1365 CE LYS B 14 -21.947 1.998 0.929 1.00 0.00 C ATOM 1366 NZ LYS B 14 -22.832 1.015 0.251 1.00 0.00 N ATOM 0 H LYS B 14 -21.999 4.902 4.665 1.00 0.00 H new ATOM 0 HA LYS B 14 -21.068 2.782 3.098 1.00 0.00 H new ATOM 0 HB2 LYS B 14 -22.418 4.867 2.463 1.00 0.00 H new ATOM 0 HB3 LYS B 14 -20.914 5.764 2.505 1.00 0.00 H new ATOM 0 HG2 LYS B 14 -21.052 5.271 0.258 1.00 0.00 H new ATOM 0 HG3 LYS B 14 -20.071 3.931 0.818 1.00 0.00 H new ATOM 0 HD2 LYS B 14 -23.099 3.769 0.565 1.00 0.00 H new ATOM 0 HD3 LYS B 14 -22.011 3.341 -0.741 1.00 0.00 H new ATOM 0 HE2 LYS B 14 -20.910 1.677 0.837 1.00 0.00 H new ATOM 0 HE3 LYS B 14 -22.180 2.023 1.994 1.00 0.00 H new ATOM 0 HZ1 LYS B 14 -22.699 0.076 0.678 1.00 0.00 H new ATOM 0 HZ2 LYS B 14 -23.824 1.308 0.360 1.00 0.00 H new ATOM 0 HZ3 LYS B 14 -22.593 0.972 -0.760 1.00 0.00 H new ATOM 1380 N LEU B 15 -18.725 4.936 3.979 1.00 0.00 N ATOM 1381 CA LEU B 15 -17.277 5.118 4.062 1.00 0.00 C ATOM 1382 C LEU B 15 -16.646 4.089 4.992 1.00 0.00 C ATOM 1383 O LEU B 15 -15.568 3.561 4.711 1.00 0.00 O ATOM 1384 CB LEU B 15 -16.925 6.534 4.536 1.00 0.00 C ATOM 1385 CG LEU B 15 -16.754 7.583 3.429 1.00 0.00 C ATOM 1386 CD1 LEU B 15 -15.648 7.167 2.471 1.00 0.00 C ATOM 1387 CD2 LEU B 15 -18.057 7.803 2.675 1.00 0.00 C ATOM 0 H LEU B 15 -19.269 5.686 4.406 1.00 0.00 H new ATOM 0 HA LEU B 15 -16.874 4.975 3.060 1.00 0.00 H new ATOM 0 HB2 LEU B 15 -17.706 6.874 5.216 1.00 0.00 H new ATOM 0 HB3 LEU B 15 -16.000 6.485 5.111 1.00 0.00 H new ATOM 0 HG LEU B 15 -16.474 8.526 3.898 1.00 0.00 H new ATOM 0 HD11 LEU B 15 -15.539 7.921 1.692 1.00 0.00 H new ATOM 0 HD12 LEU B 15 -14.710 7.072 3.018 1.00 0.00 H new ATOM 0 HD13 LEU B 15 -15.902 6.209 2.016 1.00 0.00 H new ATOM 0 HD21 LEU B 15 -17.905 8.551 1.897 1.00 0.00 H new ATOM 0 HD22 LEU B 15 -18.377 6.866 2.220 1.00 0.00 H new ATOM 0 HD23 LEU B 15 -18.824 8.150 3.367 1.00 0.00 H new ATOM 1399 N ASN B 16 -17.321 3.804 6.096 1.00 0.00 N ATOM 1400 CA ASN B 16 -16.830 2.834 7.063 1.00 0.00 C ATOM 1401 C ASN B 16 -16.788 1.443 6.446 1.00 0.00 C ATOM 1402 O ASN B 16 -15.804 0.719 6.599 1.00 0.00 O ATOM 1403 CB ASN B 16 -17.707 2.828 8.318 1.00 0.00 C ATOM 1404 CG ASN B 16 -17.109 2.006 9.443 1.00 0.00 C ATOM 1405 OD1 ASN B 16 -17.368 0.808 9.561 1.00 0.00 O ATOM 1406 ND2 ASN B 16 -16.315 2.647 10.287 1.00 0.00 N ATOM 0 H ASN B 16 -18.213 4.232 6.345 1.00 0.00 H new ATOM 0 HA ASN B 16 -15.819 3.122 7.350 1.00 0.00 H new ATOM 0 HB2 ASN B 16 -17.853 3.853 8.660 1.00 0.00 H new ATOM 0 HB3 ASN B 16 -18.691 2.432 8.067 1.00 0.00 H new ATOM 0 HD21 ASN B 16 -15.893 2.147 11.070 1.00 0.00 H new ATOM 0 HD22 ASN B 16 -16.125 3.640 10.154 1.00 0.00 H new ATOM 1413 N ALA B 17 -17.853 1.082 5.735 1.00 0.00 N ATOM 1414 CA ALA B 17 -17.917 -0.202 5.051 1.00 0.00 C ATOM 1415 C ALA B 17 -16.810 -0.307 4.008 1.00 0.00 C ATOM 1416 O ALA B 17 -16.219 -1.371 3.819 1.00 0.00 O ATOM 1417 CB ALA B 17 -19.281 -0.393 4.404 1.00 0.00 C ATOM 0 H ALA B 17 -18.683 1.663 5.619 1.00 0.00 H new ATOM 0 HA ALA B 17 -17.772 -0.993 5.787 1.00 0.00 H new ATOM 0 HB1 ALA B 17 -19.311 -1.358 3.897 1.00 0.00 H new ATOM 0 HB2 ALA B 17 -20.055 -0.361 5.171 1.00 0.00 H new ATOM 0 HB3 ALA B 17 -19.455 0.403 3.680 1.00 0.00 H new ATOM 1423 N GLN B 18 -16.534 0.808 3.342 1.00 0.00 N ATOM 1424 CA GLN B 18 -15.445 0.872 2.377 1.00 0.00 C ATOM 1425 C GLN B 18 -14.112 0.599 3.067 1.00 0.00 C ATOM 1426 O GLN B 18 -13.405 -0.339 2.708 1.00 0.00 O ATOM 1427 CB GLN B 18 -15.415 2.246 1.700 1.00 0.00 C ATOM 1428 CG GLN B 18 -14.284 2.411 0.694 1.00 0.00 C ATOM 1429 CD GLN B 18 -14.232 3.801 0.089 1.00 0.00 C ATOM 1430 OE1 GLN B 18 -13.160 4.301 -0.259 1.00 0.00 O ATOM 1431 NE2 GLN B 18 -15.387 4.437 -0.045 1.00 0.00 N ATOM 0 H GLN B 18 -17.050 1.681 3.453 1.00 0.00 H new ATOM 0 HA GLN B 18 -15.610 0.110 1.616 1.00 0.00 H new ATOM 0 HB2 GLN B 18 -16.366 2.412 1.194 1.00 0.00 H new ATOM 0 HB3 GLN B 18 -15.323 3.016 2.466 1.00 0.00 H new ATOM 0 HG2 GLN B 18 -13.334 2.198 1.184 1.00 0.00 H new ATOM 0 HG3 GLN B 18 -14.403 1.677 -0.103 1.00 0.00 H new ATOM 0 HE21 GLN B 18 -16.253 3.990 0.255 1.00 0.00 H new ATOM 0 HE22 GLN B 18 -15.410 5.374 -0.448 1.00 0.00 H new ATOM 1440 N ALA B 19 -13.793 1.404 4.080 1.00 0.00 N ATOM 1441 CA ALA B 19 -12.532 1.273 4.814 1.00 0.00 C ATOM 1442 C ALA B 19 -12.379 -0.123 5.417 1.00 0.00 C ATOM 1443 O ALA B 19 -11.277 -0.672 5.469 1.00 0.00 O ATOM 1444 CB ALA B 19 -12.438 2.337 5.904 1.00 0.00 C ATOM 0 H ALA B 19 -14.393 2.158 4.413 1.00 0.00 H new ATOM 0 HA ALA B 19 -11.717 1.421 4.105 1.00 0.00 H new ATOM 0 HB1 ALA B 19 -11.496 2.226 6.440 1.00 0.00 H new ATOM 0 HB2 ALA B 19 -12.483 3.327 5.451 1.00 0.00 H new ATOM 0 HB3 ALA B 19 -13.268 2.219 6.601 1.00 0.00 H new ATOM 1450 N THR B 20 -13.491 -0.694 5.857 1.00 0.00 N ATOM 1451 CA THR B 20 -13.499 -2.037 6.421 1.00 0.00 C ATOM 1452 C THR B 20 -13.150 -3.080 5.355 1.00 0.00 C ATOM 1453 O THR B 20 -12.490 -4.078 5.641 1.00 0.00 O ATOM 1454 CB THR B 20 -14.874 -2.350 7.049 1.00 0.00 C ATOM 1455 OG1 THR B 20 -15.155 -1.391 8.078 1.00 0.00 O ATOM 1456 CG2 THR B 20 -14.919 -3.752 7.640 1.00 0.00 C ATOM 0 H THR B 20 -14.406 -0.244 5.834 1.00 0.00 H new ATOM 0 HA THR B 20 -12.740 -2.081 7.202 1.00 0.00 H new ATOM 0 HB THR B 20 -15.625 -2.294 6.261 1.00 0.00 H new ATOM 0 HG1 THR B 20 -15.505 -0.570 7.673 1.00 0.00 H new ATOM 0 HG21 THR B 20 -15.903 -3.933 8.072 1.00 0.00 H new ATOM 0 HG22 THR B 20 -14.727 -4.484 6.856 1.00 0.00 H new ATOM 0 HG23 THR B 20 -14.159 -3.844 8.416 1.00 0.00 H new ATOM 1464 N ALA B 21 -13.562 -2.820 4.118 1.00 0.00 N ATOM 1465 CA ALA B 21 -13.307 -3.739 3.018 1.00 0.00 C ATOM 1466 C ALA B 21 -11.823 -3.769 2.653 1.00 0.00 C ATOM 1467 O ALA B 21 -11.265 -4.833 2.381 1.00 0.00 O ATOM 1468 CB ALA B 21 -14.144 -3.358 1.806 1.00 0.00 C ATOM 0 H ALA B 21 -14.075 -1.979 3.854 1.00 0.00 H new ATOM 0 HA ALA B 21 -13.592 -4.740 3.343 1.00 0.00 H new ATOM 0 HB1 ALA B 21 -13.943 -4.054 0.992 1.00 0.00 H new ATOM 0 HB2 ALA B 21 -15.202 -3.400 2.066 1.00 0.00 H new ATOM 0 HB3 ALA B 21 -13.888 -2.347 1.491 1.00 0.00 H new ATOM 1474 N LEU B 22 -11.185 -2.598 2.660 1.00 0.00 N ATOM 1475 CA LEU B 22 -9.768 -2.501 2.318 1.00 0.00 C ATOM 1476 C LEU B 22 -8.896 -3.205 3.348 1.00 0.00 C ATOM 1477 O LEU B 22 -7.794 -3.648 3.031 1.00 0.00 O ATOM 1478 CB LEU B 22 -9.314 -1.043 2.154 1.00 0.00 C ATOM 1479 CG LEU B 22 -9.728 -0.363 0.842 1.00 0.00 C ATOM 1480 CD1 LEU B 22 -9.676 -1.351 -0.316 1.00 0.00 C ATOM 1481 CD2 LEU B 22 -11.108 0.261 0.955 1.00 0.00 C ATOM 0 H LEU B 22 -11.625 -1.709 2.897 1.00 0.00 H new ATOM 0 HA LEU B 22 -9.647 -3.003 1.358 1.00 0.00 H new ATOM 0 HB2 LEU B 22 -9.713 -0.461 2.985 1.00 0.00 H new ATOM 0 HB3 LEU B 22 -8.227 -1.009 2.233 1.00 0.00 H new ATOM 0 HG LEU B 22 -9.016 0.438 0.643 1.00 0.00 H new ATOM 0 HD11 LEU B 22 -9.973 -0.849 -1.237 1.00 0.00 H new ATOM 0 HD12 LEU B 22 -8.661 -1.733 -0.423 1.00 0.00 H new ATOM 0 HD13 LEU B 22 -10.357 -2.179 -0.119 1.00 0.00 H new ATOM 0 HD21 LEU B 22 -11.372 0.734 0.009 1.00 0.00 H new ATOM 0 HD22 LEU B 22 -11.839 -0.513 1.190 1.00 0.00 H new ATOM 0 HD23 LEU B 22 -11.105 1.010 1.747 1.00 0.00 H new ATOM 1493 N LYS B 23 -9.386 -3.311 4.577 1.00 0.00 N ATOM 1494 CA LYS B 23 -8.673 -4.045 5.613 1.00 0.00 C ATOM 1495 C LYS B 23 -8.420 -5.479 5.148 1.00 0.00 C ATOM 1496 O LYS B 23 -7.313 -5.998 5.278 1.00 0.00 O ATOM 1497 CB LYS B 23 -9.465 -4.016 6.929 1.00 0.00 C ATOM 1498 CG LYS B 23 -8.821 -4.783 8.085 1.00 0.00 C ATOM 1499 CD LYS B 23 -9.211 -6.257 8.077 1.00 0.00 C ATOM 1500 CE LYS B 23 -8.551 -7.037 9.203 1.00 0.00 C ATOM 1501 NZ LYS B 23 -8.889 -6.484 10.541 1.00 0.00 N ATOM 0 H LYS B 23 -10.269 -2.900 4.879 1.00 0.00 H new ATOM 0 HA LYS B 23 -7.710 -3.569 5.795 1.00 0.00 H new ATOM 0 HB2 LYS B 23 -9.600 -2.978 7.232 1.00 0.00 H new ATOM 0 HB3 LYS B 23 -10.458 -4.427 6.748 1.00 0.00 H new ATOM 0 HG2 LYS B 23 -7.737 -4.694 8.020 1.00 0.00 H new ATOM 0 HG3 LYS B 23 -9.122 -4.333 9.031 1.00 0.00 H new ATOM 0 HD2 LYS B 23 -10.294 -6.344 8.164 1.00 0.00 H new ATOM 0 HD3 LYS B 23 -8.932 -6.699 7.120 1.00 0.00 H new ATOM 0 HE2 LYS B 23 -8.864 -8.080 9.153 1.00 0.00 H new ATOM 0 HE3 LYS B 23 -7.469 -7.022 9.068 1.00 0.00 H new ATOM 0 HZ1 LYS B 23 -8.562 -7.139 11.280 1.00 0.00 H new ATOM 0 HZ2 LYS B 23 -8.423 -5.562 10.664 1.00 0.00 H new ATOM 0 HZ3 LYS B 23 -9.919 -6.364 10.617 1.00 0.00 H new ATOM 1515 N MET B 24 -9.450 -6.105 4.586 1.00 0.00 N ATOM 1516 CA MET B 24 -9.319 -7.452 4.045 1.00 0.00 C ATOM 1517 C MET B 24 -8.485 -7.434 2.771 1.00 0.00 C ATOM 1518 O MET B 24 -7.622 -8.290 2.579 1.00 0.00 O ATOM 1519 CB MET B 24 -10.692 -8.067 3.751 1.00 0.00 C ATOM 1520 CG MET B 24 -11.441 -8.559 4.980 1.00 0.00 C ATOM 1521 SD MET B 24 -11.922 -7.230 6.104 1.00 0.00 S ATOM 1522 CE MET B 24 -12.799 -8.160 7.359 1.00 0.00 C ATOM 0 H MET B 24 -10.382 -5.701 4.494 1.00 0.00 H new ATOM 0 HA MET B 24 -8.819 -8.063 4.796 1.00 0.00 H new ATOM 0 HB2 MET B 24 -11.306 -7.325 3.240 1.00 0.00 H new ATOM 0 HB3 MET B 24 -10.562 -8.902 3.062 1.00 0.00 H new ATOM 0 HG2 MET B 24 -12.334 -9.097 4.661 1.00 0.00 H new ATOM 0 HG3 MET B 24 -10.815 -9.271 5.518 1.00 0.00 H new ATOM 0 HE1 MET B 24 -13.161 -7.479 8.130 1.00 0.00 H new ATOM 0 HE2 MET B 24 -13.644 -8.677 6.905 1.00 0.00 H new ATOM 0 HE3 MET B 24 -12.126 -8.891 7.807 1.00 0.00 H new ATOM 1532 N ASP B 25 -8.737 -6.440 1.920 1.00 0.00 N ATOM 1533 CA ASP B 25 -8.060 -6.327 0.626 1.00 0.00 C ATOM 1534 C ASP B 25 -6.543 -6.269 0.807 1.00 0.00 C ATOM 1535 O ASP B 25 -5.795 -6.946 0.098 1.00 0.00 O ATOM 1536 CB ASP B 25 -8.551 -5.075 -0.115 1.00 0.00 C ATOM 1537 CG ASP B 25 -8.280 -5.119 -1.612 1.00 0.00 C ATOM 1538 OD1 ASP B 25 -8.835 -6.011 -2.288 1.00 0.00 O ATOM 1539 OD2 ASP B 25 -7.551 -4.242 -2.127 1.00 0.00 O ATOM 0 H ASP B 25 -9.410 -5.696 2.104 1.00 0.00 H new ATOM 0 HA ASP B 25 -8.299 -7.211 0.035 1.00 0.00 H new ATOM 0 HB2 ASP B 25 -9.622 -4.960 0.050 1.00 0.00 H new ATOM 0 HB3 ASP B 25 -8.066 -4.196 0.310 1.00 0.00 H new ATOM 1544 N LEU B 26 -6.102 -5.476 1.778 1.00 0.00 N ATOM 1545 CA LEU B 26 -4.681 -5.327 2.066 1.00 0.00 C ATOM 1546 C LEU B 26 -4.138 -6.520 2.847 1.00 0.00 C ATOM 1547 O LEU B 26 -3.097 -7.076 2.499 1.00 0.00 O ATOM 1548 CB LEU B 26 -4.436 -4.038 2.855 1.00 0.00 C ATOM 1549 CG LEU B 26 -2.978 -3.772 3.247 1.00 0.00 C ATOM 1550 CD1 LEU B 26 -2.109 -3.585 2.012 1.00 0.00 C ATOM 1551 CD2 LEU B 26 -2.888 -2.554 4.154 1.00 0.00 C ATOM 0 H LEU B 26 -6.712 -4.924 2.381 1.00 0.00 H new ATOM 0 HA LEU B 26 -4.154 -5.279 1.113 1.00 0.00 H new ATOM 0 HB2 LEU B 26 -4.794 -3.196 2.262 1.00 0.00 H new ATOM 0 HB3 LEU B 26 -5.039 -4.068 3.763 1.00 0.00 H new ATOM 0 HG LEU B 26 -2.607 -4.640 3.792 1.00 0.00 H new ATOM 0 HD11 LEU B 26 -1.079 -3.398 2.317 1.00 0.00 H new ATOM 0 HD12 LEU B 26 -2.148 -4.486 1.400 1.00 0.00 H new ATOM 0 HD13 LEU B 26 -2.476 -2.737 1.434 1.00 0.00 H new ATOM 0 HD21 LEU B 26 -1.847 -2.378 4.424 1.00 0.00 H new ATOM 0 HD22 LEU B 26 -3.280 -1.681 3.632 1.00 0.00 H new ATOM 0 HD23 LEU B 26 -3.472 -2.729 5.057 1.00 0.00 H new ATOM 1563 N HIS B 27 -4.852 -6.920 3.895 1.00 0.00 N ATOM 1564 CA HIS B 27 -4.375 -7.978 4.782 1.00 0.00 C ATOM 1565 C HIS B 27 -4.205 -9.294 4.030 1.00 0.00 C ATOM 1566 O HIS B 27 -3.247 -10.032 4.265 1.00 0.00 O ATOM 1567 CB HIS B 27 -5.331 -8.173 5.961 1.00 0.00 C ATOM 1568 CG HIS B 27 -4.805 -9.106 7.003 1.00 0.00 C ATOM 1569 ND1 HIS B 27 -5.486 -10.223 7.437 1.00 0.00 N ATOM 1570 CD2 HIS B 27 -3.650 -9.077 7.700 1.00 0.00 C ATOM 1571 CE1 HIS B 27 -4.768 -10.839 8.358 1.00 0.00 C ATOM 1572 NE2 HIS B 27 -3.648 -10.163 8.534 1.00 0.00 N ATOM 0 H HIS B 27 -5.759 -6.530 4.151 1.00 0.00 H new ATOM 0 HA HIS B 27 -3.402 -7.670 5.164 1.00 0.00 H new ATOM 0 HB2 HIS B 27 -5.533 -7.205 6.419 1.00 0.00 H new ATOM 0 HB3 HIS B 27 -6.282 -8.554 5.589 1.00 0.00 H new ATOM 0 HD2 HIS B 27 -2.871 -8.334 7.616 1.00 0.00 H new ATOM 0 HE1 HIS B 27 -5.049 -11.742 8.879 1.00 0.00 H new ATOM 0 HE2 HIS B 27 -2.903 -10.409 9.185 1.00 0.00 H new ATOM 1581 N ASP B 28 -5.132 -9.577 3.126 1.00 0.00 N ATOM 1582 CA ASP B 28 -5.087 -10.803 2.338 1.00 0.00 C ATOM 1583 C ASP B 28 -3.844 -10.818 1.449 1.00 0.00 C ATOM 1584 O ASP B 28 -3.179 -11.844 1.300 1.00 0.00 O ATOM 1585 CB ASP B 28 -6.351 -10.922 1.487 1.00 0.00 C ATOM 1586 CG ASP B 28 -6.401 -12.206 0.684 1.00 0.00 C ATOM 1587 OD1 ASP B 28 -6.595 -13.283 1.291 1.00 0.00 O ATOM 1588 OD2 ASP B 28 -6.265 -12.143 -0.556 1.00 0.00 O ATOM 0 H ASP B 28 -5.927 -8.973 2.919 1.00 0.00 H new ATOM 0 HA ASP B 28 -5.037 -11.656 3.015 1.00 0.00 H new ATOM 0 HB2 ASP B 28 -7.226 -10.870 2.135 1.00 0.00 H new ATOM 0 HB3 ASP B 28 -6.407 -10.072 0.807 1.00 0.00 H new ATOM 1593 N LEU B 29 -3.523 -9.659 0.887 1.00 0.00 N ATOM 1594 CA LEU B 29 -2.370 -9.521 0.009 1.00 0.00 C ATOM 1595 C LEU B 29 -1.067 -9.602 0.806 1.00 0.00 C ATOM 1596 O LEU B 29 -0.082 -10.169 0.341 1.00 0.00 O ATOM 1597 CB LEU B 29 -2.441 -8.190 -0.746 1.00 0.00 C ATOM 1598 CG LEU B 29 -1.353 -7.977 -1.800 1.00 0.00 C ATOM 1599 CD1 LEU B 29 -1.465 -9.025 -2.896 1.00 0.00 C ATOM 1600 CD2 LEU B 29 -1.448 -6.574 -2.382 1.00 0.00 C ATOM 0 H LEU B 29 -4.050 -8.796 1.026 1.00 0.00 H new ATOM 0 HA LEU B 29 -2.385 -10.341 -0.709 1.00 0.00 H new ATOM 0 HB2 LEU B 29 -3.414 -8.119 -1.232 1.00 0.00 H new ATOM 0 HB3 LEU B 29 -2.386 -7.377 -0.022 1.00 0.00 H new ATOM 0 HG LEU B 29 -0.379 -8.084 -1.324 1.00 0.00 H new ATOM 0 HD11 LEU B 29 -0.684 -8.860 -3.638 1.00 0.00 H new ATOM 0 HD12 LEU B 29 -1.350 -10.018 -2.463 1.00 0.00 H new ATOM 0 HD13 LEU B 29 -2.442 -8.949 -3.374 1.00 0.00 H new ATOM 0 HD21 LEU B 29 -0.668 -6.437 -3.131 1.00 0.00 H new ATOM 0 HD22 LEU B 29 -2.425 -6.438 -2.847 1.00 0.00 H new ATOM 0 HD23 LEU B 29 -1.320 -5.840 -1.586 1.00 0.00 H new ATOM 1612 N ALA B 30 -1.079 -9.042 2.011 1.00 0.00 N ATOM 1613 CA ALA B 30 0.100 -9.034 2.874 1.00 0.00 C ATOM 1614 C ALA B 30 0.500 -10.450 3.288 1.00 0.00 C ATOM 1615 O ALA B 30 1.680 -10.738 3.492 1.00 0.00 O ATOM 1616 CB ALA B 30 -0.155 -8.171 4.102 1.00 0.00 C ATOM 0 H ALA B 30 -1.896 -8.585 2.415 1.00 0.00 H new ATOM 0 HA ALA B 30 0.929 -8.609 2.308 1.00 0.00 H new ATOM 0 HB1 ALA B 30 0.730 -8.172 4.738 1.00 0.00 H new ATOM 0 HB2 ALA B 30 -0.376 -7.150 3.790 1.00 0.00 H new ATOM 0 HB3 ALA B 30 -1.002 -8.572 4.659 1.00 0.00 H new ATOM 1622 N GLU B 31 -0.484 -11.329 3.408 1.00 0.00 N ATOM 1623 CA GLU B 31 -0.236 -12.712 3.774 1.00 0.00 C ATOM 1624 C GLU B 31 0.296 -13.503 2.581 1.00 0.00 C ATOM 1625 O GLU B 31 1.144 -14.383 2.735 1.00 0.00 O ATOM 1626 CB GLU B 31 -1.529 -13.339 4.291 1.00 0.00 C ATOM 1627 CG GLU B 31 -1.986 -12.779 5.629 1.00 0.00 C ATOM 1628 CD GLU B 31 -1.170 -13.302 6.795 1.00 0.00 C ATOM 1629 OE1 GLU B 31 0.055 -13.073 6.827 1.00 0.00 O ATOM 1630 OE2 GLU B 31 -1.757 -13.943 7.689 1.00 0.00 O ATOM 0 H GLU B 31 -1.467 -11.105 3.256 1.00 0.00 H new ATOM 0 HA GLU B 31 0.520 -12.739 4.559 1.00 0.00 H new ATOM 0 HB2 GLU B 31 -2.317 -13.185 3.554 1.00 0.00 H new ATOM 0 HB3 GLU B 31 -1.388 -14.416 4.387 1.00 0.00 H new ATOM 0 HG2 GLU B 31 -1.920 -11.691 5.604 1.00 0.00 H new ATOM 0 HG3 GLU B 31 -3.035 -13.031 5.784 1.00 0.00 H new ATOM 1637 N ASP B 32 -0.183 -13.162 1.391 1.00 0.00 N ATOM 1638 CA ASP B 32 0.186 -13.885 0.177 1.00 0.00 C ATOM 1639 C ASP B 32 1.186 -13.078 -0.645 1.00 0.00 C ATOM 1640 O ASP B 32 1.255 -13.204 -1.865 1.00 0.00 O ATOM 1641 CB ASP B 32 -1.051 -14.224 -0.653 1.00 0.00 C ATOM 1642 CG ASP B 32 -0.741 -15.225 -1.753 1.00 0.00 C ATOM 1643 OD1 ASP B 32 0.047 -16.167 -1.500 1.00 0.00 O ATOM 1644 OD2 ASP B 32 -1.269 -15.069 -2.877 1.00 0.00 O ATOM 0 H ASP B 32 -0.829 -12.388 1.239 1.00 0.00 H new ATOM 0 HA ASP B 32 0.661 -14.821 0.470 1.00 0.00 H new ATOM 0 HB2 ASP B 32 -1.825 -14.629 -0.001 1.00 0.00 H new ATOM 0 HB3 ASP B 32 -1.452 -13.312 -1.095 1.00 0.00 H new ATOM 1649 N LEU B 33 1.935 -12.231 0.051 1.00 0.00 N ATOM 1650 CA LEU B 33 3.028 -11.437 -0.523 1.00 0.00 C ATOM 1651 C LEU B 33 3.931 -12.240 -1.488 1.00 0.00 C ATOM 1652 O LEU B 33 3.830 -13.467 -1.569 1.00 0.00 O ATOM 1653 CB LEU B 33 3.814 -10.745 0.590 1.00 0.00 C ATOM 1654 CG LEU B 33 3.263 -9.366 0.966 1.00 0.00 C ATOM 1655 CD1 LEU B 33 4.092 -8.730 2.070 1.00 0.00 C ATOM 1656 CD2 LEU B 33 3.221 -8.460 -0.263 1.00 0.00 C ATOM 0 H LEU B 33 1.802 -12.070 1.049 1.00 0.00 H new ATOM 0 HA LEU B 33 2.580 -10.667 -1.151 1.00 0.00 H new ATOM 0 HB2 LEU B 33 3.811 -11.381 1.475 1.00 0.00 H new ATOM 0 HB3 LEU B 33 4.853 -10.639 0.277 1.00 0.00 H new ATOM 0 HG LEU B 33 2.248 -9.495 1.341 1.00 0.00 H new ATOM 0 HD11 LEU B 33 3.679 -7.752 2.318 1.00 0.00 H new ATOM 0 HD12 LEU B 33 4.071 -9.367 2.954 1.00 0.00 H new ATOM 0 HD13 LEU B 33 5.121 -8.614 1.731 1.00 0.00 H new ATOM 0 HD21 LEU B 33 2.827 -7.483 0.018 1.00 0.00 H new ATOM 0 HD22 LEU B 33 4.228 -8.344 -0.664 1.00 0.00 H new ATOM 0 HD23 LEU B 33 2.578 -8.906 -1.022 1.00 0.00 H new ATOM 1668 N PRO B 34 4.903 -11.569 -2.165 1.00 0.00 N ATOM 1669 CA PRO B 34 5.361 -11.837 -3.519 1.00 0.00 C ATOM 1670 C PRO B 34 4.437 -12.616 -4.467 1.00 0.00 C ATOM 1671 O PRO B 34 4.888 -13.166 -5.469 1.00 0.00 O ATOM 1672 CB PRO B 34 6.689 -12.477 -3.181 1.00 0.00 C ATOM 1673 CG PRO B 34 7.183 -11.564 -2.067 1.00 0.00 C ATOM 1674 CD PRO B 34 5.960 -10.766 -1.588 1.00 0.00 C ATOM 0 HA PRO B 34 5.407 -10.953 -4.155 1.00 0.00 H new ATOM 0 HB2 PRO B 34 6.576 -13.509 -2.848 1.00 0.00 H new ATOM 0 HB3 PRO B 34 7.368 -12.490 -4.034 1.00 0.00 H new ATOM 0 HG2 PRO B 34 7.612 -12.144 -1.250 1.00 0.00 H new ATOM 0 HG3 PRO B 34 7.965 -10.897 -2.429 1.00 0.00 H new ATOM 0 HD2 PRO B 34 5.897 -10.710 -0.501 1.00 0.00 H new ATOM 0 HD3 PRO B 34 5.957 -9.742 -1.960 1.00 0.00 H new ATOM 1682 N THR B 35 3.151 -12.648 -4.157 1.00 0.00 N ATOM 1683 CA THR B 35 2.137 -12.970 -5.144 1.00 0.00 C ATOM 1684 C THR B 35 1.070 -11.878 -5.123 1.00 0.00 C ATOM 1685 O THR B 35 0.622 -11.463 -4.054 1.00 0.00 O ATOM 1686 CB THR B 35 1.485 -14.339 -4.891 1.00 0.00 C ATOM 1687 OG1 THR B 35 2.072 -14.961 -3.742 1.00 0.00 O ATOM 1688 CG2 THR B 35 1.648 -15.245 -6.098 1.00 0.00 C ATOM 0 H THR B 35 2.785 -12.454 -3.225 1.00 0.00 H new ATOM 0 HA THR B 35 2.619 -13.023 -6.120 1.00 0.00 H new ATOM 0 HB THR B 35 0.421 -14.180 -4.713 1.00 0.00 H new ATOM 0 HG1 THR B 35 1.738 -14.528 -2.929 1.00 0.00 H new ATOM 0 HG21 THR B 35 1.179 -16.208 -5.896 1.00 0.00 H new ATOM 0 HG22 THR B 35 1.174 -14.785 -6.965 1.00 0.00 H new ATOM 0 HG23 THR B 35 2.709 -15.393 -6.301 1.00 0.00 H new ATOM 1696 N GLY B 36 0.680 -11.402 -6.296 1.00 0.00 N ATOM 1697 CA GLY B 36 -0.235 -10.275 -6.371 1.00 0.00 C ATOM 1698 C GLY B 36 0.430 -8.967 -5.968 1.00 0.00 C ATOM 1699 O GLY B 36 -0.237 -7.945 -5.811 1.00 0.00 O ATOM 0 H GLY B 36 0.979 -11.773 -7.198 1.00 0.00 H new ATOM 0 HA2 GLY B 36 -0.618 -10.188 -7.388 1.00 0.00 H new ATOM 0 HA3 GLY B 36 -1.091 -10.460 -5.722 1.00 0.00 H new ATOM 1703 N TRP B 37 1.752 -9.003 -5.808 1.00 0.00 N ATOM 1704 CA TRP B 37 2.533 -7.841 -5.387 1.00 0.00 C ATOM 1705 C TRP B 37 2.366 -6.655 -6.335 1.00 0.00 C ATOM 1706 O TRP B 37 2.615 -5.513 -5.952 1.00 0.00 O ATOM 1707 CB TRP B 37 4.017 -8.211 -5.267 1.00 0.00 C ATOM 1708 CG TRP B 37 4.615 -8.751 -6.534 1.00 0.00 C ATOM 1709 CD1 TRP B 37 4.703 -10.062 -6.903 1.00 0.00 C ATOM 1710 CD2 TRP B 37 5.219 -7.996 -7.595 1.00 0.00 C ATOM 1711 NE1 TRP B 37 5.316 -10.168 -8.127 1.00 0.00 N ATOM 1712 CE2 TRP B 37 5.641 -8.914 -8.573 1.00 0.00 C ATOM 1713 CE3 TRP B 37 5.438 -6.631 -7.814 1.00 0.00 C ATOM 1714 CZ2 TRP B 37 6.271 -8.513 -9.751 1.00 0.00 C ATOM 1715 CZ3 TRP B 37 6.062 -6.234 -8.983 1.00 0.00 C ATOM 1716 CH2 TRP B 37 6.473 -7.171 -9.938 1.00 0.00 C ATOM 0 H TRP B 37 2.313 -9.840 -5.967 1.00 0.00 H new ATOM 0 HA TRP B 37 2.153 -7.536 -4.412 1.00 0.00 H new ATOM 0 HB2 TRP B 37 4.578 -7.328 -4.960 1.00 0.00 H new ATOM 0 HB3 TRP B 37 4.133 -8.953 -4.477 1.00 0.00 H new ATOM 0 HD1 TRP B 37 4.343 -10.895 -6.317 1.00 0.00 H new ATOM 0 HE1 TRP B 37 5.500 -11.040 -8.624 1.00 0.00 H new ATOM 0 HE3 TRP B 37 5.125 -5.900 -7.083 1.00 0.00 H new ATOM 0 HZ2 TRP B 37 6.588 -9.235 -10.489 1.00 0.00 H new ATOM 0 HZ3 TRP B 37 6.235 -5.183 -9.162 1.00 0.00 H new ATOM 0 HH2 TRP B 37 6.959 -6.829 -10.840 1.00 0.00 H new ATOM 1727 N ASN B 38 1.942 -6.922 -7.563 1.00 0.00 N ATOM 1728 CA ASN B 38 1.704 -5.860 -8.532 1.00 0.00 C ATOM 1729 C ASN B 38 0.610 -4.919 -8.030 1.00 0.00 C ATOM 1730 O ASN B 38 0.572 -3.740 -8.379 1.00 0.00 O ATOM 1731 CB ASN B 38 1.302 -6.450 -9.888 1.00 0.00 C ATOM 1732 CG ASN B 38 1.195 -5.398 -10.979 1.00 0.00 C ATOM 1733 OD1 ASN B 38 1.931 -4.413 -10.983 1.00 0.00 O ATOM 1734 ND2 ASN B 38 0.274 -5.600 -11.910 1.00 0.00 N ATOM 0 H ASN B 38 1.756 -7.862 -7.911 1.00 0.00 H new ATOM 0 HA ASN B 38 2.628 -5.295 -8.655 1.00 0.00 H new ATOM 0 HB2 ASN B 38 2.035 -7.201 -10.184 1.00 0.00 H new ATOM 0 HB3 ASN B 38 0.345 -6.961 -9.787 1.00 0.00 H new ATOM 0 HD21 ASN B 38 0.156 -4.925 -12.666 1.00 0.00 H new ATOM 0 HD22 ASN B 38 -0.317 -6.430 -11.871 1.00 0.00 H new ATOM 1741 N ARG B 39 -0.261 -5.439 -7.175 1.00 0.00 N ATOM 1742 CA ARG B 39 -1.395 -4.678 -6.691 1.00 0.00 C ATOM 1743 C ARG B 39 -1.085 -3.958 -5.382 1.00 0.00 C ATOM 1744 O ARG B 39 -1.943 -3.259 -4.847 1.00 0.00 O ATOM 1745 CB ARG B 39 -2.588 -5.602 -6.485 1.00 0.00 C ATOM 1746 CG ARG B 39 -3.008 -6.359 -7.735 1.00 0.00 C ATOM 1747 CD ARG B 39 -4.343 -7.056 -7.536 1.00 0.00 C ATOM 1748 NE ARG B 39 -5.439 -6.098 -7.378 1.00 0.00 N ATOM 1749 CZ ARG B 39 -6.492 -6.291 -6.585 1.00 0.00 C ATOM 1750 NH1 ARG B 39 -6.566 -7.377 -5.824 1.00 0.00 N ATOM 1751 NH2 ARG B 39 -7.462 -5.386 -6.544 1.00 0.00 N ATOM 0 H ARG B 39 -0.200 -6.387 -6.804 1.00 0.00 H new ATOM 0 HA ARG B 39 -1.626 -3.924 -7.444 1.00 0.00 H new ATOM 0 HB2 ARG B 39 -2.347 -6.320 -5.702 1.00 0.00 H new ATOM 0 HB3 ARG B 39 -3.433 -5.013 -6.128 1.00 0.00 H new ATOM 0 HG2 ARG B 39 -3.078 -5.668 -8.575 1.00 0.00 H new ATOM 0 HG3 ARG B 39 -2.246 -7.095 -7.990 1.00 0.00 H new ATOM 0 HD2 ARG B 39 -4.546 -7.703 -8.390 1.00 0.00 H new ATOM 0 HD3 ARG B 39 -4.291 -7.697 -6.656 1.00 0.00 H new ATOM 0 HE ARG B 39 -5.393 -5.228 -7.909 1.00 0.00 H new ATOM 0 HH11 ARG B 39 -5.815 -8.067 -5.845 1.00 0.00 H new ATOM 0 HH12 ARG B 39 -7.374 -7.521 -5.218 1.00 0.00 H new ATOM 0 HH21 ARG B 39 -7.400 -4.546 -7.119 1.00 0.00 H new ATOM 0 HH22 ARG B 39 -8.269 -5.531 -5.938 1.00 0.00 H new ATOM 1765 N ILE B 40 0.139 -4.116 -4.877 1.00 0.00 N ATOM 1766 CA ILE B 40 0.522 -3.527 -3.592 1.00 0.00 C ATOM 1767 C ILE B 40 0.267 -2.024 -3.571 1.00 0.00 C ATOM 1768 O ILE B 40 -0.368 -1.512 -2.652 1.00 0.00 O ATOM 1769 CB ILE B 40 2.003 -3.815 -3.243 1.00 0.00 C ATOM 1770 CG1 ILE B 40 2.190 -5.294 -2.894 1.00 0.00 C ATOM 1771 CG2 ILE B 40 2.471 -2.936 -2.087 1.00 0.00 C ATOM 1772 CD1 ILE B 40 3.620 -5.659 -2.554 1.00 0.00 C ATOM 0 H ILE B 40 0.881 -4.645 -5.336 1.00 0.00 H new ATOM 0 HA ILE B 40 -0.104 -3.999 -2.835 1.00 0.00 H new ATOM 0 HB ILE B 40 2.610 -3.580 -4.118 1.00 0.00 H new ATOM 0 HG12 ILE B 40 1.549 -5.543 -2.048 1.00 0.00 H new ATOM 0 HG13 ILE B 40 1.858 -5.902 -3.736 1.00 0.00 H new ATOM 0 HG21 ILE B 40 3.514 -3.157 -1.861 1.00 0.00 H new ATOM 0 HG22 ILE B 40 2.375 -1.887 -2.366 1.00 0.00 H new ATOM 0 HG23 ILE B 40 1.859 -3.135 -1.207 1.00 0.00 H new ATOM 0 HD11 ILE B 40 3.678 -6.721 -2.317 1.00 0.00 H new ATOM 0 HD12 ILE B 40 4.264 -5.442 -3.406 1.00 0.00 H new ATOM 0 HD13 ILE B 40 3.949 -5.077 -1.693 1.00 0.00 H new ATOM 1784 N MET B 41 0.727 -1.325 -4.599 1.00 0.00 N ATOM 1785 CA MET B 41 0.575 0.126 -4.647 1.00 0.00 C ATOM 1786 C MET B 41 -0.891 0.515 -4.816 1.00 0.00 C ATOM 1787 O MET B 41 -1.344 1.507 -4.250 1.00 0.00 O ATOM 1788 CB MET B 41 1.431 0.724 -5.766 1.00 0.00 C ATOM 1789 CG MET B 41 1.370 2.241 -5.845 1.00 0.00 C ATOM 1790 SD MET B 41 2.709 2.936 -6.835 1.00 0.00 S ATOM 1791 CE MET B 41 4.128 2.474 -5.842 1.00 0.00 C ATOM 0 H MET B 41 1.204 -1.732 -5.404 1.00 0.00 H new ATOM 0 HA MET B 41 0.923 0.535 -3.698 1.00 0.00 H new ATOM 0 HB2 MET B 41 2.467 0.419 -5.620 1.00 0.00 H new ATOM 0 HB3 MET B 41 1.108 0.307 -6.720 1.00 0.00 H new ATOM 0 HG2 MET B 41 0.413 2.541 -6.272 1.00 0.00 H new ATOM 0 HG3 MET B 41 1.414 2.656 -4.838 1.00 0.00 H new ATOM 0 HE1 MET B 41 5.042 2.786 -6.347 1.00 0.00 H new ATOM 0 HE2 MET B 41 4.066 2.962 -4.869 1.00 0.00 H new ATOM 0 HE3 MET B 41 4.140 1.393 -5.705 1.00 0.00 H new ATOM 1801 N GLU B 42 -1.628 -0.290 -5.571 1.00 0.00 N ATOM 1802 CA GLU B 42 -3.059 -0.068 -5.767 1.00 0.00 C ATOM 1803 C GLU B 42 -3.799 -0.165 -4.438 1.00 0.00 C ATOM 1804 O GLU B 42 -4.546 0.735 -4.055 1.00 0.00 O ATOM 1805 CB GLU B 42 -3.625 -1.109 -6.731 1.00 0.00 C ATOM 1806 CG GLU B 42 -5.080 -0.873 -7.105 1.00 0.00 C ATOM 1807 CD GLU B 42 -5.724 -2.080 -7.762 1.00 0.00 C ATOM 1808 OE1 GLU B 42 -6.184 -2.985 -7.032 1.00 0.00 O ATOM 1809 OE2 GLU B 42 -5.783 -2.120 -9.005 1.00 0.00 O ATOM 0 H GLU B 42 -1.259 -1.106 -6.060 1.00 0.00 H new ATOM 0 HA GLU B 42 -3.196 0.930 -6.184 1.00 0.00 H new ATOM 0 HB2 GLU B 42 -3.023 -1.115 -7.639 1.00 0.00 H new ATOM 0 HB3 GLU B 42 -3.531 -2.097 -6.280 1.00 0.00 H new ATOM 0 HG2 GLU B 42 -5.642 -0.610 -6.209 1.00 0.00 H new ATOM 0 HG3 GLU B 42 -5.142 -0.021 -7.782 1.00 0.00 H new ATOM 1816 N VAL B 43 -3.584 -1.272 -3.743 1.00 0.00 N ATOM 1817 CA VAL B 43 -4.229 -1.509 -2.458 1.00 0.00 C ATOM 1818 C VAL B 43 -3.779 -0.477 -1.426 1.00 0.00 C ATOM 1819 O VAL B 43 -4.581 -0.008 -0.620 1.00 0.00 O ATOM 1820 CB VAL B 43 -3.948 -2.933 -1.935 1.00 0.00 C ATOM 1821 CG1 VAL B 43 -4.666 -3.169 -0.621 1.00 0.00 C ATOM 1822 CG2 VAL B 43 -4.359 -3.976 -2.964 1.00 0.00 C ATOM 0 H VAL B 43 -2.966 -2.024 -4.048 1.00 0.00 H new ATOM 0 HA VAL B 43 -5.303 -1.410 -2.613 1.00 0.00 H new ATOM 0 HB VAL B 43 -2.876 -3.028 -1.763 1.00 0.00 H new ATOM 0 HG11 VAL B 43 -4.456 -4.179 -0.268 1.00 0.00 H new ATOM 0 HG12 VAL B 43 -4.319 -2.447 0.118 1.00 0.00 H new ATOM 0 HG13 VAL B 43 -5.740 -3.052 -0.767 1.00 0.00 H new ATOM 0 HG21 VAL B 43 -4.152 -4.973 -2.574 1.00 0.00 H new ATOM 0 HG22 VAL B 43 -5.425 -3.882 -3.172 1.00 0.00 H new ATOM 0 HG23 VAL B 43 -3.795 -3.822 -3.884 1.00 0.00 H new ATOM 1832 N ALA B 44 -2.501 -0.112 -1.465 1.00 0.00 N ATOM 1833 CA ALA B 44 -1.981 0.918 -0.577 1.00 0.00 C ATOM 1834 C ALA B 44 -2.700 2.242 -0.815 1.00 0.00 C ATOM 1835 O ALA B 44 -3.040 2.953 0.131 1.00 0.00 O ATOM 1836 CB ALA B 44 -0.487 1.090 -0.773 1.00 0.00 C ATOM 0 H ALA B 44 -1.810 -0.513 -2.100 1.00 0.00 H new ATOM 0 HA ALA B 44 -2.161 0.603 0.451 1.00 0.00 H new ATOM 0 HB1 ALA B 44 -0.119 1.864 -0.100 1.00 0.00 H new ATOM 0 HB2 ALA B 44 0.019 0.149 -0.556 1.00 0.00 H new ATOM 0 HB3 ALA B 44 -0.286 1.380 -1.804 1.00 0.00 H new ATOM 1842 N GLU B 45 -2.934 2.555 -2.087 1.00 0.00 N ATOM 1843 CA GLU B 45 -3.684 3.741 -2.468 1.00 0.00 C ATOM 1844 C GLU B 45 -5.093 3.704 -1.877 1.00 0.00 C ATOM 1845 O GLU B 45 -5.537 4.675 -1.273 1.00 0.00 O ATOM 1846 CB GLU B 45 -3.727 3.858 -3.992 1.00 0.00 C ATOM 1847 CG GLU B 45 -2.558 4.643 -4.568 1.00 0.00 C ATOM 1848 CD GLU B 45 -2.573 4.712 -6.083 1.00 0.00 C ATOM 1849 OE1 GLU B 45 -3.621 5.082 -6.659 1.00 0.00 O ATOM 1850 OE2 GLU B 45 -1.529 4.417 -6.704 1.00 0.00 O ATOM 0 H GLU B 45 -2.610 1.995 -2.876 1.00 0.00 H new ATOM 0 HA GLU B 45 -3.183 4.622 -2.066 1.00 0.00 H new ATOM 0 HB2 GLU B 45 -3.734 2.858 -4.426 1.00 0.00 H new ATOM 0 HB3 GLU B 45 -4.659 4.340 -4.286 1.00 0.00 H new ATOM 0 HG2 GLU B 45 -2.575 5.655 -4.164 1.00 0.00 H new ATOM 0 HG3 GLU B 45 -1.625 4.185 -4.241 1.00 0.00 H new ATOM 1857 N LYS B 46 -5.772 2.568 -2.024 1.00 0.00 N ATOM 1858 CA LYS B 46 -7.119 2.406 -1.474 1.00 0.00 C ATOM 1859 C LYS B 46 -7.106 2.583 0.040 1.00 0.00 C ATOM 1860 O LYS B 46 -7.900 3.338 0.599 1.00 0.00 O ATOM 1861 CB LYS B 46 -7.659 1.015 -1.762 1.00 0.00 C ATOM 1862 CG LYS B 46 -7.550 0.572 -3.202 1.00 0.00 C ATOM 1863 CD LYS B 46 -7.941 -0.886 -3.316 1.00 0.00 C ATOM 1864 CE LYS B 46 -7.412 -1.513 -4.586 1.00 0.00 C ATOM 1865 NZ LYS B 46 -7.593 -2.988 -4.599 1.00 0.00 N ATOM 0 H LYS B 46 -5.415 1.749 -2.516 1.00 0.00 H new ATOM 0 HA LYS B 46 -7.748 3.162 -1.944 1.00 0.00 H new ATOM 0 HB2 LYS B 46 -7.127 0.299 -1.136 1.00 0.00 H new ATOM 0 HB3 LYS B 46 -8.707 0.980 -1.466 1.00 0.00 H new ATOM 0 HG2 LYS B 46 -8.198 1.183 -3.831 1.00 0.00 H new ATOM 0 HG3 LYS B 46 -6.531 0.715 -3.561 1.00 0.00 H new ATOM 0 HD2 LYS B 46 -7.559 -1.433 -2.454 1.00 0.00 H new ATOM 0 HD3 LYS B 46 -9.027 -0.974 -3.293 1.00 0.00 H new ATOM 0 HE2 LYS B 46 -7.923 -1.078 -5.445 1.00 0.00 H new ATOM 0 HE3 LYS B 46 -6.353 -1.277 -4.692 1.00 0.00 H new ATOM 0 HZ1 LYS B 46 -6.863 -3.422 -5.200 1.00 0.00 H new ATOM 0 HZ2 LYS B 46 -7.508 -3.357 -3.630 1.00 0.00 H new ATOM 0 HZ3 LYS B 46 -8.534 -3.219 -4.976 1.00 0.00 H new ATOM 1879 N THR B 47 -6.185 1.875 0.686 1.00 0.00 N ATOM 1880 CA THR B 47 -6.086 1.861 2.137 1.00 0.00 C ATOM 1881 C THR B 47 -5.819 3.258 2.685 1.00 0.00 C ATOM 1882 O THR B 47 -6.510 3.723 3.595 1.00 0.00 O ATOM 1883 CB THR B 47 -4.970 0.901 2.598 1.00 0.00 C ATOM 1884 OG1 THR B 47 -5.183 -0.395 2.023 1.00 0.00 O ATOM 1885 CG2 THR B 47 -4.938 0.782 4.114 1.00 0.00 C ATOM 0 H THR B 47 -5.488 1.296 0.217 1.00 0.00 H new ATOM 0 HA THR B 47 -7.042 1.511 2.527 1.00 0.00 H new ATOM 0 HB THR B 47 -4.014 1.305 2.265 1.00 0.00 H new ATOM 0 HG1 THR B 47 -4.947 -0.374 1.072 1.00 0.00 H new ATOM 0 HG21 THR B 47 -4.141 0.099 4.409 1.00 0.00 H new ATOM 0 HG22 THR B 47 -4.755 1.763 4.552 1.00 0.00 H new ATOM 0 HG23 THR B 47 -5.895 0.399 4.469 1.00 0.00 H new ATOM 1893 N TYR B 48 -4.827 3.928 2.110 1.00 0.00 N ATOM 1894 CA TYR B 48 -4.479 5.278 2.526 1.00 0.00 C ATOM 1895 C TYR B 48 -5.668 6.216 2.327 1.00 0.00 C ATOM 1896 O TYR B 48 -6.048 6.954 3.235 1.00 0.00 O ATOM 1897 CB TYR B 48 -3.265 5.790 1.740 1.00 0.00 C ATOM 1898 CG TYR B 48 -2.899 7.225 2.057 1.00 0.00 C ATOM 1899 CD1 TYR B 48 -2.106 7.541 3.155 1.00 0.00 C ATOM 1900 CD2 TYR B 48 -3.362 8.267 1.262 1.00 0.00 C ATOM 1901 CE1 TYR B 48 -1.789 8.854 3.448 1.00 0.00 C ATOM 1902 CE2 TYR B 48 -3.044 9.579 1.547 1.00 0.00 C ATOM 1903 CZ TYR B 48 -2.259 9.868 2.641 1.00 0.00 C ATOM 1904 OH TYR B 48 -1.958 11.176 2.934 1.00 0.00 O ATOM 0 H TYR B 48 -4.251 3.557 1.355 1.00 0.00 H new ATOM 0 HA TYR B 48 -4.221 5.255 3.585 1.00 0.00 H new ATOM 0 HB2 TYR B 48 -2.409 5.150 1.953 1.00 0.00 H new ATOM 0 HB3 TYR B 48 -3.471 5.703 0.673 1.00 0.00 H new ATOM 0 HD1 TYR B 48 -1.733 6.749 3.788 1.00 0.00 H new ATOM 0 HD2 TYR B 48 -3.982 8.046 0.406 1.00 0.00 H new ATOM 0 HE1 TYR B 48 -1.175 9.085 4.306 1.00 0.00 H new ATOM 0 HE2 TYR B 48 -3.409 10.375 0.915 1.00 0.00 H new ATOM 0 HH TYR B 48 -1.611 11.619 2.132 1.00 0.00 H new ATOM 1914 N GLU B 49 -6.255 6.161 1.138 1.00 0.00 N ATOM 1915 CA GLU B 49 -7.383 7.010 0.790 1.00 0.00 C ATOM 1916 C GLU B 49 -8.582 6.768 1.701 1.00 0.00 C ATOM 1917 O GLU B 49 -9.187 7.715 2.201 1.00 0.00 O ATOM 1918 CB GLU B 49 -7.772 6.773 -0.670 1.00 0.00 C ATOM 1919 CG GLU B 49 -6.990 7.627 -1.656 1.00 0.00 C ATOM 1920 CD GLU B 49 -7.265 9.108 -1.493 1.00 0.00 C ATOM 1921 OE1 GLU B 49 -6.688 9.732 -0.579 1.00 0.00 O ATOM 1922 OE2 GLU B 49 -8.055 9.660 -2.287 1.00 0.00 O ATOM 0 H GLU B 49 -5.963 5.529 0.392 1.00 0.00 H new ATOM 0 HA GLU B 49 -7.077 8.047 0.926 1.00 0.00 H new ATOM 0 HB2 GLU B 49 -7.618 5.721 -0.912 1.00 0.00 H new ATOM 0 HB3 GLU B 49 -8.836 6.976 -0.791 1.00 0.00 H new ATOM 0 HG2 GLU B 49 -5.924 7.443 -1.524 1.00 0.00 H new ATOM 0 HG3 GLU B 49 -7.242 7.324 -2.672 1.00 0.00 H new ATOM 1929 N ALA B 50 -8.912 5.502 1.925 1.00 0.00 N ATOM 1930 CA ALA B 50 -10.080 5.140 2.718 1.00 0.00 C ATOM 1931 C ALA B 50 -9.973 5.657 4.149 1.00 0.00 C ATOM 1932 O ALA B 50 -10.882 6.324 4.645 1.00 0.00 O ATOM 1933 CB ALA B 50 -10.274 3.631 2.717 1.00 0.00 C ATOM 0 H ALA B 50 -8.385 4.706 1.567 1.00 0.00 H new ATOM 0 HA ALA B 50 -10.948 5.612 2.259 1.00 0.00 H new ATOM 0 HB1 ALA B 50 -11.150 3.376 3.313 1.00 0.00 H new ATOM 0 HB2 ALA B 50 -10.418 3.283 1.694 1.00 0.00 H new ATOM 0 HB3 ALA B 50 -9.393 3.151 3.143 1.00 0.00 H new ATOM 1939 N TYR B 51 -8.859 5.357 4.808 1.00 0.00 N ATOM 1940 CA TYR B 51 -8.667 5.755 6.191 1.00 0.00 C ATOM 1941 C TYR B 51 -8.496 7.266 6.317 1.00 0.00 C ATOM 1942 O TYR B 51 -8.985 7.873 7.273 1.00 0.00 O ATOM 1943 CB TYR B 51 -7.471 5.026 6.803 1.00 0.00 C ATOM 1944 CG TYR B 51 -7.748 3.571 7.111 1.00 0.00 C ATOM 1945 CD1 TYR B 51 -8.556 3.213 8.182 1.00 0.00 C ATOM 1946 CD2 TYR B 51 -7.201 2.559 6.336 1.00 0.00 C ATOM 1947 CE1 TYR B 51 -8.811 1.886 8.470 1.00 0.00 C ATOM 1948 CE2 TYR B 51 -7.452 1.230 6.618 1.00 0.00 C ATOM 1949 CZ TYR B 51 -8.257 0.899 7.686 1.00 0.00 C ATOM 1950 OH TYR B 51 -8.514 -0.426 7.970 1.00 0.00 O ATOM 0 H TYR B 51 -8.078 4.840 4.404 1.00 0.00 H new ATOM 0 HA TYR B 51 -9.564 5.474 6.743 1.00 0.00 H new ATOM 0 HB2 TYR B 51 -6.626 5.090 6.117 1.00 0.00 H new ATOM 0 HB3 TYR B 51 -7.176 5.534 7.721 1.00 0.00 H new ATOM 0 HD1 TYR B 51 -8.992 3.984 8.800 1.00 0.00 H new ATOM 0 HD2 TYR B 51 -6.569 2.814 5.499 1.00 0.00 H new ATOM 0 HE1 TYR B 51 -9.442 1.624 9.306 1.00 0.00 H new ATOM 0 HE2 TYR B 51 -7.019 0.454 6.004 1.00 0.00 H new ATOM 0 HH TYR B 51 -8.049 -0.996 7.322 1.00 0.00 H new ATOM 1960 N ARG B 52 -7.815 7.875 5.350 1.00 0.00 N ATOM 1961 CA ARG B 52 -7.644 9.322 5.353 1.00 0.00 C ATOM 1962 C ARG B 52 -8.989 10.019 5.185 1.00 0.00 C ATOM 1963 O ARG B 52 -9.338 10.897 5.971 1.00 0.00 O ATOM 1964 CB ARG B 52 -6.679 9.777 4.255 1.00 0.00 C ATOM 1965 CG ARG B 52 -6.612 11.290 4.131 1.00 0.00 C ATOM 1966 CD ARG B 52 -5.595 11.748 3.102 1.00 0.00 C ATOM 1967 NE ARG B 52 -5.675 13.193 2.890 1.00 0.00 N ATOM 1968 CZ ARG B 52 -4.616 13.998 2.792 1.00 0.00 C ATOM 1969 NH1 ARG B 52 -3.385 13.509 2.860 1.00 0.00 N ATOM 1970 NH2 ARG B 52 -4.784 15.301 2.617 1.00 0.00 N ATOM 0 H ARG B 52 -7.378 7.395 4.564 1.00 0.00 H new ATOM 0 HA ARG B 52 -7.215 9.599 6.316 1.00 0.00 H new ATOM 0 HB2 ARG B 52 -5.683 9.388 4.467 1.00 0.00 H new ATOM 0 HB3 ARG B 52 -6.991 9.351 3.302 1.00 0.00 H new ATOM 0 HG2 ARG B 52 -7.596 11.672 3.859 1.00 0.00 H new ATOM 0 HG3 ARG B 52 -6.360 11.719 5.101 1.00 0.00 H new ATOM 0 HD2 ARG B 52 -4.592 11.481 3.434 1.00 0.00 H new ATOM 0 HD3 ARG B 52 -5.768 11.229 2.159 1.00 0.00 H new ATOM 0 HE ARG B 52 -6.601 13.613 2.812 1.00 0.00 H new ATOM 0 HH11 ARG B 52 -3.240 12.508 2.989 1.00 0.00 H new ATOM 0 HH12 ARG B 52 -2.583 14.134 2.784 1.00 0.00 H new ATOM 0 HH21 ARG B 52 -5.725 15.690 2.557 1.00 0.00 H new ATOM 0 HH22 ARG B 52 -3.972 15.914 2.542 1.00 0.00 H new ATOM 1984 N GLN B 53 -9.741 9.606 4.169 1.00 0.00 N ATOM 1985 CA GLN B 53 -11.057 10.177 3.892 1.00 0.00 C ATOM 1986 C GLN B 53 -11.983 9.993 5.088 1.00 0.00 C ATOM 1987 O GLN B 53 -12.753 10.889 5.428 1.00 0.00 O ATOM 1988 CB GLN B 53 -11.675 9.523 2.652 1.00 0.00 C ATOM 1989 CG GLN B 53 -13.060 10.046 2.304 1.00 0.00 C ATOM 1990 CD GLN B 53 -13.067 11.528 1.981 1.00 0.00 C ATOM 1991 OE1 GLN B 53 -12.088 12.071 1.472 1.00 0.00 O ATOM 1992 NE2 GLN B 53 -14.172 12.192 2.273 1.00 0.00 N ATOM 0 H GLN B 53 -9.459 8.872 3.519 1.00 0.00 H new ATOM 0 HA GLN B 53 -10.932 11.243 3.704 1.00 0.00 H new ATOM 0 HB2 GLN B 53 -11.013 9.683 1.801 1.00 0.00 H new ATOM 0 HB3 GLN B 53 -11.734 8.446 2.812 1.00 0.00 H new ATOM 0 HG2 GLN B 53 -13.448 9.491 1.450 1.00 0.00 H new ATOM 0 HG3 GLN B 53 -13.734 9.858 3.139 1.00 0.00 H new ATOM 0 HE21 GLN B 53 -14.963 11.705 2.695 1.00 0.00 H new ATOM 0 HE22 GLN B 53 -14.234 13.191 2.076 1.00 0.00 H new ATOM 2001 N LEU B 54 -11.902 8.829 5.721 1.00 0.00 N ATOM 2002 CA LEU B 54 -12.710 8.546 6.898 1.00 0.00 C ATOM 2003 C LEU B 54 -12.423 9.573 7.988 1.00 0.00 C ATOM 2004 O LEU B 54 -13.341 10.183 8.535 1.00 0.00 O ATOM 2005 CB LEU B 54 -12.426 7.132 7.415 1.00 0.00 C ATOM 2006 CG LEU B 54 -13.329 6.657 8.555 1.00 0.00 C ATOM 2007 CD1 LEU B 54 -14.779 6.602 8.100 1.00 0.00 C ATOM 2008 CD2 LEU B 54 -12.874 5.297 9.060 1.00 0.00 C ATOM 0 H LEU B 54 -11.285 8.067 5.438 1.00 0.00 H new ATOM 0 HA LEU B 54 -13.763 8.608 6.622 1.00 0.00 H new ATOM 0 HB2 LEU B 54 -12.521 6.433 6.584 1.00 0.00 H new ATOM 0 HB3 LEU B 54 -11.390 7.088 7.752 1.00 0.00 H new ATOM 0 HG LEU B 54 -13.255 7.371 9.375 1.00 0.00 H new ATOM 0 HD11 LEU B 54 -15.406 6.262 8.924 1.00 0.00 H new ATOM 0 HD12 LEU B 54 -15.100 7.595 7.786 1.00 0.00 H new ATOM 0 HD13 LEU B 54 -14.872 5.909 7.264 1.00 0.00 H new ATOM 0 HD21 LEU B 54 -13.526 4.973 9.871 1.00 0.00 H new ATOM 0 HD22 LEU B 54 -12.919 4.573 8.246 1.00 0.00 H new ATOM 0 HD23 LEU B 54 -11.850 5.369 9.425 1.00 0.00 H new ATOM 2020 N ASP B 55 -11.144 9.782 8.274 1.00 0.00 N ATOM 2021 CA ASP B 55 -10.726 10.753 9.282 1.00 0.00 C ATOM 2022 C ASP B 55 -11.085 12.175 8.855 1.00 0.00 C ATOM 2023 O ASP B 55 -11.522 12.984 9.673 1.00 0.00 O ATOM 2024 CB ASP B 55 -9.220 10.648 9.530 1.00 0.00 C ATOM 2025 CG ASP B 55 -8.720 11.710 10.490 1.00 0.00 C ATOM 2026 OD1 ASP B 55 -8.950 11.569 11.713 1.00 0.00 O ATOM 2027 OD2 ASP B 55 -8.103 12.692 10.024 1.00 0.00 O ATOM 0 H ASP B 55 -10.374 9.290 7.821 1.00 0.00 H new ATOM 0 HA ASP B 55 -11.257 10.527 10.207 1.00 0.00 H new ATOM 0 HB2 ASP B 55 -8.988 9.661 9.930 1.00 0.00 H new ATOM 0 HB3 ASP B 55 -8.690 10.740 8.582 1.00 0.00 H new ATOM 2032 N GLU B 56 -10.908 12.468 7.571 1.00 0.00 N ATOM 2033 CA GLU B 56 -11.254 13.776 7.028 1.00 0.00 C ATOM 2034 C GLU B 56 -12.748 14.042 7.165 1.00 0.00 C ATOM 2035 O GLU B 56 -13.159 15.144 7.531 1.00 0.00 O ATOM 2036 CB GLU B 56 -10.814 13.889 5.565 1.00 0.00 C ATOM 2037 CG GLU B 56 -9.319 14.120 5.406 1.00 0.00 C ATOM 2038 CD GLU B 56 -8.935 14.566 4.008 1.00 0.00 C ATOM 2039 OE1 GLU B 56 -9.266 15.713 3.637 1.00 0.00 O ATOM 2040 OE2 GLU B 56 -8.276 13.792 3.290 1.00 0.00 O ATOM 0 H GLU B 56 -10.526 11.816 6.886 1.00 0.00 H new ATOM 0 HA GLU B 56 -10.722 14.534 7.603 1.00 0.00 H new ATOM 0 HB2 GLU B 56 -11.093 12.977 5.037 1.00 0.00 H new ATOM 0 HB3 GLU B 56 -11.354 14.709 5.092 1.00 0.00 H new ATOM 0 HG2 GLU B 56 -8.995 14.873 6.124 1.00 0.00 H new ATOM 0 HG3 GLU B 56 -8.787 13.200 5.647 1.00 0.00 H new ATOM 2047 N PHE B 57 -13.556 13.027 6.886 1.00 0.00 N ATOM 2048 CA PHE B 57 -14.995 13.121 7.075 1.00 0.00 C ATOM 2049 C PHE B 57 -15.314 13.388 8.544 1.00 0.00 C ATOM 2050 O PHE B 57 -16.156 14.225 8.863 1.00 0.00 O ATOM 2051 CB PHE B 57 -15.678 11.831 6.605 1.00 0.00 C ATOM 2052 CG PHE B 57 -17.168 11.814 6.810 1.00 0.00 C ATOM 2053 CD1 PHE B 57 -18.007 12.528 5.968 1.00 0.00 C ATOM 2054 CD2 PHE B 57 -17.728 11.082 7.845 1.00 0.00 C ATOM 2055 CE1 PHE B 57 -19.376 12.514 6.158 1.00 0.00 C ATOM 2056 CE2 PHE B 57 -19.096 11.066 8.039 1.00 0.00 C ATOM 2057 CZ PHE B 57 -19.921 11.781 7.195 1.00 0.00 C ATOM 0 H PHE B 57 -13.236 12.127 6.527 1.00 0.00 H new ATOM 0 HA PHE B 57 -15.375 13.950 6.479 1.00 0.00 H new ATOM 0 HB2 PHE B 57 -15.466 11.686 5.546 1.00 0.00 H new ATOM 0 HB3 PHE B 57 -15.239 10.986 7.136 1.00 0.00 H new ATOM 0 HD1 PHE B 57 -17.586 13.101 5.155 1.00 0.00 H new ATOM 0 HD2 PHE B 57 -17.088 10.518 8.507 1.00 0.00 H new ATOM 0 HE1 PHE B 57 -20.019 13.075 5.497 1.00 0.00 H new ATOM 0 HE2 PHE B 57 -19.520 10.494 8.851 1.00 0.00 H new ATOM 0 HZ PHE B 57 -20.991 11.768 7.345 1.00 0.00 H new ATOM 2067 N ARG B 58 -14.611 12.688 9.431 1.00 0.00 N ATOM 2068 CA ARG B 58 -14.802 12.840 10.863 1.00 0.00 C ATOM 2069 C ARG B 58 -14.418 14.245 11.324 1.00 0.00 C ATOM 2070 O ARG B 58 -15.089 14.835 12.165 1.00 0.00 O ATOM 2071 CB ARG B 58 -13.979 11.791 11.607 1.00 0.00 C ATOM 2072 CG ARG B 58 -14.412 10.365 11.312 1.00 0.00 C ATOM 2073 CD ARG B 58 -13.677 9.366 12.188 1.00 0.00 C ATOM 2074 NE ARG B 58 -14.183 9.358 13.560 1.00 0.00 N ATOM 2075 CZ ARG B 58 -13.457 9.017 14.626 1.00 0.00 C ATOM 2076 NH1 ARG B 58 -12.154 8.781 14.507 1.00 0.00 N ATOM 2077 NH2 ARG B 58 -14.027 8.936 15.821 1.00 0.00 N ATOM 0 H ARG B 58 -13.898 12.005 9.175 1.00 0.00 H new ATOM 0 HA ARG B 58 -15.858 12.693 11.088 1.00 0.00 H new ATOM 0 HB2 ARG B 58 -12.929 11.907 11.339 1.00 0.00 H new ATOM 0 HB3 ARG B 58 -14.057 11.972 12.679 1.00 0.00 H new ATOM 0 HG2 ARG B 58 -15.486 10.270 11.472 1.00 0.00 H new ATOM 0 HG3 ARG B 58 -14.225 10.137 10.263 1.00 0.00 H new ATOM 0 HD2 ARG B 58 -13.776 8.368 11.760 1.00 0.00 H new ATOM 0 HD3 ARG B 58 -12.614 9.606 12.196 1.00 0.00 H new ATOM 0 HE ARG B 58 -15.154 9.631 13.712 1.00 0.00 H new ATOM 0 HH11 ARG B 58 -11.702 8.860 13.596 1.00 0.00 H new ATOM 0 HH12 ARG B 58 -11.606 8.521 15.327 1.00 0.00 H new ATOM 0 HH21 ARG B 58 -15.022 9.135 15.926 1.00 0.00 H new ATOM 0 HH22 ARG B 58 -13.470 8.675 16.635 1.00 0.00 H new ATOM 2091 N LYS B 59 -13.345 14.780 10.755 1.00 0.00 N ATOM 2092 CA LYS B 59 -12.890 16.129 11.081 1.00 0.00 C ATOM 2093 C LYS B 59 -13.897 17.150 10.559 1.00 0.00 C ATOM 2094 O LYS B 59 -14.189 18.152 11.219 1.00 0.00 O ATOM 2095 CB LYS B 59 -11.503 16.369 10.465 1.00 0.00 C ATOM 2096 CG LYS B 59 -10.577 17.241 11.305 1.00 0.00 C ATOM 2097 CD LYS B 59 -11.054 18.680 11.388 1.00 0.00 C ATOM 2098 CE LYS B 59 -10.054 19.546 12.136 1.00 0.00 C ATOM 2099 NZ LYS B 59 -10.506 20.956 12.244 1.00 0.00 N ATOM 0 H LYS B 59 -12.771 14.299 10.063 1.00 0.00 H new ATOM 0 HA LYS B 59 -12.813 16.239 12.163 1.00 0.00 H new ATOM 0 HB2 LYS B 59 -11.022 15.405 10.300 1.00 0.00 H new ATOM 0 HB3 LYS B 59 -11.630 16.834 9.487 1.00 0.00 H new ATOM 0 HG2 LYS B 59 -10.505 16.826 12.311 1.00 0.00 H new ATOM 0 HG3 LYS B 59 -9.574 17.218 10.878 1.00 0.00 H new ATOM 0 HD2 LYS B 59 -11.202 19.076 10.383 1.00 0.00 H new ATOM 0 HD3 LYS B 59 -12.020 18.718 11.891 1.00 0.00 H new ATOM 0 HE2 LYS B 59 -9.898 19.138 13.135 1.00 0.00 H new ATOM 0 HE3 LYS B 59 -9.092 19.512 11.624 1.00 0.00 H new ATOM 0 HZ1 LYS B 59 -9.794 21.510 12.761 1.00 0.00 H new ATOM 0 HZ2 LYS B 59 -10.630 21.355 11.292 1.00 0.00 H new ATOM 0 HZ3 LYS B 59 -11.411 20.992 12.755 1.00 0.00 H new ATOM 2113 N SER B 60 -14.438 16.875 9.382 1.00 0.00 N ATOM 2114 CA SER B 60 -15.450 17.726 8.788 1.00 0.00 C ATOM 2115 C SER B 60 -16.703 17.750 9.655 1.00 0.00 C ATOM 2116 O SER B 60 -17.160 18.816 10.071 1.00 0.00 O ATOM 2117 CB SER B 60 -15.784 17.242 7.371 1.00 0.00 C ATOM 2118 OG SER B 60 -16.717 18.101 6.733 1.00 0.00 O ATOM 0 H SER B 60 -14.189 16.062 8.818 1.00 0.00 H new ATOM 0 HA SER B 60 -15.059 18.741 8.725 1.00 0.00 H new ATOM 0 HB2 SER B 60 -14.871 17.191 6.778 1.00 0.00 H new ATOM 0 HB3 SER B 60 -16.191 16.232 7.417 1.00 0.00 H new ATOM 0 HG SER B 60 -16.907 17.766 5.832 1.00 0.00 H new ATOM 2124 N THR B 61 -17.232 16.572 9.950 1.00 0.00 N ATOM 2125 CA THR B 61 -18.475 16.457 10.702 1.00 0.00 C ATOM 2126 C THR B 61 -18.316 16.973 12.133 1.00 0.00 C ATOM 2127 O THR B 61 -19.227 17.592 12.670 1.00 0.00 O ATOM 2128 CB THR B 61 -19.012 15.003 10.709 1.00 0.00 C ATOM 2129 OG1 THR B 61 -20.280 14.950 11.364 1.00 0.00 O ATOM 2130 CG2 THR B 61 -18.050 14.047 11.397 1.00 0.00 C ATOM 0 H THR B 61 -16.819 15.679 9.680 1.00 0.00 H new ATOM 0 HA THR B 61 -19.208 17.083 10.193 1.00 0.00 H new ATOM 0 HB THR B 61 -19.117 14.691 9.670 1.00 0.00 H new ATOM 0 HG1 THR B 61 -20.161 14.628 12.282 1.00 0.00 H new ATOM 0 HG21 THR B 61 -18.464 13.039 11.380 1.00 0.00 H new ATOM 0 HG22 THR B 61 -17.093 14.055 10.875 1.00 0.00 H new ATOM 0 HG23 THR B 61 -17.902 14.361 12.430 1.00 0.00 H new