USER MOD reduce.3.24.130724 H: found=0, std=0, add=1344, rem=0, adj=42 USER MOD reduce.3.24.130724 removed 1346 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 71 TYR OH : rot 180:sc= 0 USER MOD Set 1.2: B 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.1: A 42 SER OG : rot 180:sc= 0.882 USER MOD Set 2.2: A 46 LYS NZ :NH3+ -111:sc= 2.29 (180deg=-0.769) USER MOD Single : A 6 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 7 THR OG1 : rot 180:sc= 0.00874 USER MOD Single : A 9 ASN : amide:sc= 0 X(o=0,f=-0.016) USER MOD Single : A 10 LYS NZ :NH3+ -165:sc= 1.09 (180deg=0.772) USER MOD Single : A 15 LYS NZ :NH3+ -162:sc= 1.23 (180deg=1.02) USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 SER OG : rot 83:sc= 0.799 USER MOD Single : A 25 LYS NZ :NH3+ -164:sc= -0.0448 (180deg=-0.326) USER MOD Single : A 26 LYS NZ :NH3+ -165:sc= 1.22 (180deg=1.11) USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 SER OG : rot 69:sc= 0.154 USER MOD Single : A 39 ASN : amide:sc= -0.0437 K(o=-0.044,f=-1.3!) USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 THR OG1 : rot 180:sc= 0.0578 USER MOD Single : A 50 GLN :FLIP amide:sc= -0.467 F(o=-3.1,f=-0.47) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 ASN : amide:sc= 1.06 K(o=1.1,f=-0.23) USER MOD Single : A 57 LYS NZ :NH3+ -111:sc= -0.366 (180deg=-1.09) USER MOD Single : A 62 TYR OH : rot 180:sc=-0.00926 USER MOD Single : A 63 THR OG1 : rot 180:sc= 0.166 USER MOD Single : A 64 TYR OH : rot 180:sc= 0 USER MOD Single : A 69 LYS NZ :NH3+ -171:sc= 1.2 (180deg=0.719) USER MOD Single : A 73 SER OG : rot 73:sc= 1.04 USER MOD Single : A 76 SER OG : rot -170:sc= -0.692 USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 LYS NZ :NH3+ -125:sc= 1.24 (180deg=0.268) USER MOD Single : A 84 THR OG1 : rot 68:sc= 1.27 USER MOD Single : A 86 SER OG : rot 180:sc= 0 USER MOD Single : B 15 LYS NZ :NH3+ 170:sc= 1.27 (180deg=1.07) USER MOD Single : B 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 19 SER OG : rot 87:sc= 0.234 USER MOD Single : B 25 LYS NZ :NH3+ -167:sc= -0.0226 (180deg=-0.188) USER MOD Single : B 26 LYS NZ :NH3+ -150:sc= 1.29 (180deg=1.17) USER MOD Single : B 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 37 SER OG : rot 72:sc= 0.296 USER MOD Single : B 39 ASN : amide:sc= 1.13 K(o=1.1,f=-0.29) USER MOD Single : B 42 SER OG : rot 64:sc= 1.28 USER MOD Single : B 44 LYS NZ :NH3+ -178:sc= 2.7 (180deg=2.68) USER MOD Single : B 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 47 THR OG1 : rot 75:sc= 0.501 USER MOD Single : B 50 GLN : amide:sc= -0.0038! X(o=-0.0038!,f=-0.36) USER MOD Single : B 54 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.0229) USER MOD Single : B 56 ASN : amide:sc= 1.16 K(o=1.2,f=-0.044) USER MOD Single : B 57 LYS NZ :NH3+ -159:sc= 1.24 (180deg=1.08) USER MOD Single : B 62 TYR OH : rot 180:sc= 0.437 USER MOD Single : B 63 THR OG1 : rot 89:sc= 1.21 USER MOD Single : B 64 TYR OH : rot 180:sc= 0 USER MOD Single : B 69 LYS NZ :NH3+ -177:sc= 1.24 (180deg=1.13) USER MOD Single : B 71 TYR OH : rot 180:sc= -0.015 USER MOD Single : B 73 SER OG : rot 74:sc= 0.594 USER MOD Single : B 76 SER OG : rot 180:sc= 0.00723 USER MOD Single : B 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 80 LYS NZ :NH3+ 171:sc= 1.43 (180deg=1.17) USER MOD Single : B 84 THR OG1 : rot 63:sc= 1.11 USER MOD Single : B 86 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 77 N GLN A 6 -21.646 14.327 -8.247 1.00 1.91 N ATOM 78 CA GLN A 6 -21.222 12.937 -8.237 1.00 1.87 C ATOM 79 C GLN A 6 -20.101 12.713 -9.246 1.00 1.83 C ATOM 80 O GLN A 6 -19.101 12.065 -8.944 1.00 1.77 O ATOM 81 CB GLN A 6 -22.408 12.025 -8.556 1.00 1.89 C ATOM 82 CG GLN A 6 -22.086 10.541 -8.445 1.00 1.95 C ATOM 83 CD GLN A 6 -22.590 9.744 -9.631 1.00 1.96 C ATOM 84 OE1 GLN A 6 -21.908 9.618 -10.648 1.00 2.22 O ATOM 85 NE2 GLN A 6 -23.792 9.200 -9.510 1.00 2.13 N ATOM 0 HA GLN A 6 -20.846 12.695 -7.243 1.00 1.87 H new ATOM 0 HB2 GLN A 6 -23.229 12.261 -7.879 1.00 1.89 H new ATOM 0 HB3 GLN A 6 -22.757 12.237 -9.567 1.00 1.89 H new ATOM 0 HG2 GLN A 6 -21.007 10.413 -8.358 1.00 1.95 H new ATOM 0 HG3 GLN A 6 -22.529 10.145 -7.531 1.00 1.95 H new ATOM 0 HE21 GLN A 6 -24.326 9.328 -8.650 1.00 2.13 H new ATOM 0 HE22 GLN A 6 -24.184 8.653 -10.277 1.00 2.13 H new ATOM 94 N THR A 7 -20.275 13.276 -10.436 1.00 1.86 N ATOM 95 CA THR A 7 -19.296 13.148 -11.505 1.00 1.83 C ATOM 96 C THR A 7 -17.938 13.733 -11.113 1.00 1.79 C ATOM 97 O THR A 7 -16.893 13.137 -11.394 1.00 1.71 O ATOM 98 CB THR A 7 -19.793 13.845 -12.781 1.00 1.88 C ATOM 99 OG1 THR A 7 -21.182 13.557 -12.979 1.00 2.15 O ATOM 100 CG2 THR A 7 -19.001 13.391 -14.000 1.00 1.95 C ATOM 0 H THR A 7 -21.094 13.831 -10.685 1.00 1.86 H new ATOM 0 HA THR A 7 -19.171 12.081 -11.690 1.00 1.83 H new ATOM 0 HB THR A 7 -19.651 14.919 -12.659 1.00 1.88 H new ATOM 0 HG1 THR A 7 -21.496 14.004 -13.792 1.00 2.15 H new ATOM 0 HG21 THR A 7 -19.375 13.901 -14.888 1.00 1.95 H new ATOM 0 HG22 THR A 7 -17.947 13.632 -13.860 1.00 1.95 H new ATOM 0 HG23 THR A 7 -19.113 12.314 -14.126 1.00 1.95 H new ATOM 108 N ARG A 8 -17.948 14.893 -10.459 1.00 1.84 N ATOM 109 CA ARG A 8 -16.703 15.544 -10.058 1.00 1.82 C ATOM 110 C ARG A 8 -16.082 14.868 -8.836 1.00 1.75 C ATOM 111 O ARG A 8 -14.863 14.778 -8.735 1.00 1.69 O ATOM 112 CB ARG A 8 -16.924 17.032 -9.779 1.00 1.94 C ATOM 113 CG ARG A 8 -15.631 17.826 -9.672 1.00 2.03 C ATOM 114 CD ARG A 8 -14.915 17.929 -11.012 1.00 2.06 C ATOM 115 NE ARG A 8 -15.634 18.804 -11.942 1.00 2.06 N ATOM 116 CZ ARG A 8 -15.626 18.672 -13.272 1.00 2.08 C ATOM 117 NH1 ARG A 8 -14.910 17.717 -13.853 1.00 2.10 N ATOM 118 NH2 ARG A 8 -16.325 19.514 -14.026 1.00 2.22 N ATOM 0 H ARG A 8 -18.795 15.397 -10.198 1.00 1.84 H new ATOM 0 HA ARG A 8 -16.008 15.444 -10.891 1.00 1.82 H new ATOM 0 HB2 ARG A 8 -17.537 17.456 -10.574 1.00 1.94 H new ATOM 0 HB3 ARG A 8 -17.486 17.140 -8.851 1.00 1.94 H new ATOM 0 HG2 ARG A 8 -15.849 18.827 -9.299 1.00 2.03 H new ATOM 0 HG3 ARG A 8 -14.973 17.351 -8.944 1.00 2.03 H new ATOM 0 HD2 ARG A 8 -13.906 18.312 -10.858 1.00 2.06 H new ATOM 0 HD3 ARG A 8 -14.816 16.936 -11.449 1.00 2.06 H new ATOM 0 HE ARG A 8 -16.180 19.569 -11.546 1.00 2.06 H new ATOM 0 HH11 ARG A 8 -14.359 17.075 -13.284 1.00 2.10 H new ATOM 0 HH12 ARG A 8 -14.911 17.625 -14.869 1.00 2.10 H new ATOM 0 HH21 ARG A 8 -16.867 20.260 -13.590 1.00 2.22 H new ATOM 0 HH22 ARG A 8 -16.320 19.414 -15.041 1.00 2.22 H new ATOM 132 N ASN A 9 -16.916 14.415 -7.903 1.00 1.76 N ATOM 133 CA ASN A 9 -16.423 13.734 -6.704 1.00 1.72 C ATOM 134 C ASN A 9 -15.651 12.484 -7.101 1.00 1.61 C ATOM 135 O ASN A 9 -14.568 12.211 -6.579 1.00 1.56 O ATOM 136 CB ASN A 9 -17.587 13.364 -5.771 1.00 1.78 C ATOM 137 CG ASN A 9 -17.212 12.291 -4.757 1.00 1.75 C ATOM 138 OD1 ASN A 9 -17.459 11.103 -4.969 1.00 1.75 O ATOM 139 ND2 ASN A 9 -16.626 12.702 -3.641 1.00 1.84 N ATOM 0 H ASN A 9 -17.931 14.505 -7.951 1.00 1.76 H new ATOM 0 HA ASN A 9 -15.758 14.411 -6.168 1.00 1.72 H new ATOM 0 HB2 ASN A 9 -17.921 14.257 -5.242 1.00 1.78 H new ATOM 0 HB3 ASN A 9 -18.429 13.014 -6.369 1.00 1.78 H new ATOM 0 HD21 ASN A 9 -16.364 12.026 -2.924 1.00 1.84 H new ATOM 0 HD22 ASN A 9 -16.437 13.694 -3.500 1.00 1.84 H new ATOM 146 N LYS A 10 -16.214 11.748 -8.053 1.00 1.60 N ATOM 147 CA LYS A 10 -15.606 10.530 -8.563 1.00 1.52 C ATOM 148 C LYS A 10 -14.234 10.827 -9.171 1.00 1.47 C ATOM 149 O LYS A 10 -13.283 10.060 -9.001 1.00 1.41 O ATOM 150 CB LYS A 10 -16.531 9.910 -9.615 1.00 1.53 C ATOM 151 CG LYS A 10 -15.873 8.850 -10.482 1.00 1.59 C ATOM 152 CD LYS A 10 -16.015 7.462 -9.887 1.00 1.70 C ATOM 153 CE LYS A 10 -15.354 6.418 -10.769 1.00 2.07 C ATOM 154 NZ LYS A 10 -15.897 6.438 -12.154 1.00 2.48 N ATOM 0 H LYS A 10 -17.105 11.981 -8.491 1.00 1.60 H new ATOM 0 HA LYS A 10 -15.466 9.827 -7.742 1.00 1.52 H new ATOM 0 HB2 LYS A 10 -17.390 9.468 -9.111 1.00 1.53 H new ATOM 0 HB3 LYS A 10 -16.913 10.703 -10.258 1.00 1.53 H new ATOM 0 HG2 LYS A 10 -16.320 8.866 -11.476 1.00 1.59 H new ATOM 0 HG3 LYS A 10 -14.816 9.086 -10.604 1.00 1.59 H new ATOM 0 HD2 LYS A 10 -15.565 7.441 -8.894 1.00 1.70 H new ATOM 0 HD3 LYS A 10 -17.071 7.222 -9.764 1.00 1.70 H new ATOM 0 HE2 LYS A 10 -14.279 6.595 -10.798 1.00 2.07 H new ATOM 0 HE3 LYS A 10 -15.503 5.429 -10.335 1.00 2.07 H new ATOM 0 HZ1 LYS A 10 -15.618 5.567 -12.649 1.00 2.48 H new ATOM 0 HZ2 LYS A 10 -16.935 6.499 -12.119 1.00 2.48 H new ATOM 0 HZ3 LYS A 10 -15.519 7.262 -12.663 1.00 2.48 H new ATOM 168 N GLU A 11 -14.141 11.957 -9.861 1.00 1.52 N ATOM 169 CA GLU A 11 -12.906 12.372 -10.508 1.00 1.50 C ATOM 170 C GLU A 11 -11.814 12.684 -9.482 1.00 1.45 C ATOM 171 O GLU A 11 -10.650 12.325 -9.672 1.00 1.38 O ATOM 172 CB GLU A 11 -13.172 13.606 -11.372 1.00 1.58 C ATOM 173 CG GLU A 11 -11.989 14.025 -12.230 1.00 1.63 C ATOM 174 CD GLU A 11 -12.035 15.489 -12.617 1.00 1.77 C ATOM 175 OE1 GLU A 11 -13.094 15.952 -13.090 1.00 1.96 O ATOM 176 OE2 GLU A 11 -11.009 16.180 -12.451 1.00 1.90 O ATOM 0 H GLU A 11 -14.916 12.608 -9.987 1.00 1.52 H new ATOM 0 HA GLU A 11 -12.555 11.550 -11.132 1.00 1.50 H new ATOM 0 HB2 GLU A 11 -14.025 13.406 -12.020 1.00 1.58 H new ATOM 0 HB3 GLU A 11 -13.451 14.437 -10.725 1.00 1.58 H new ATOM 0 HG2 GLU A 11 -11.064 13.826 -11.688 1.00 1.63 H new ATOM 0 HG3 GLU A 11 -11.967 13.415 -13.133 1.00 1.63 H new ATOM 183 N LEU A 12 -12.199 13.337 -8.394 1.00 1.51 N ATOM 184 CA LEU A 12 -11.257 13.714 -7.347 1.00 1.50 C ATOM 185 C LEU A 12 -10.584 12.489 -6.737 1.00 1.40 C ATOM 186 O LEU A 12 -9.356 12.413 -6.684 1.00 1.33 O ATOM 187 CB LEU A 12 -11.967 14.524 -6.259 1.00 1.62 C ATOM 188 CG LEU A 12 -11.072 15.039 -5.128 1.00 1.65 C ATOM 189 CD1 LEU A 12 -10.049 16.029 -5.661 1.00 1.69 C ATOM 190 CD2 LEU A 12 -11.917 15.683 -4.040 1.00 1.82 C ATOM 0 H LEU A 12 -13.162 13.618 -8.212 1.00 1.51 H new ATOM 0 HA LEU A 12 -10.482 14.331 -7.802 1.00 1.50 H new ATOM 0 HB2 LEU A 12 -12.457 15.377 -6.728 1.00 1.62 H new ATOM 0 HB3 LEU A 12 -12.752 13.905 -5.824 1.00 1.62 H new ATOM 0 HG LEU A 12 -10.536 14.192 -4.699 1.00 1.65 H new ATOM 0 HD11 LEU A 12 -9.423 16.383 -4.841 1.00 1.69 H new ATOM 0 HD12 LEU A 12 -9.425 15.540 -6.409 1.00 1.69 H new ATOM 0 HD13 LEU A 12 -10.564 16.875 -6.115 1.00 1.69 H new ATOM 0 HD21 LEU A 12 -11.269 16.045 -3.242 1.00 1.82 H new ATOM 0 HD22 LEU A 12 -12.476 16.519 -4.460 1.00 1.82 H new ATOM 0 HD23 LEU A 12 -12.613 14.947 -3.637 1.00 1.82 H new ATOM 202 N LEU A 13 -11.383 11.522 -6.301 1.00 1.41 N ATOM 203 CA LEU A 13 -10.835 10.316 -5.684 1.00 1.35 C ATOM 204 C LEU A 13 -10.013 9.511 -6.686 1.00 1.23 C ATOM 205 O LEU A 13 -9.049 8.843 -6.310 1.00 1.18 O ATOM 206 CB LEU A 13 -11.944 9.453 -5.063 1.00 1.43 C ATOM 207 CG LEU A 13 -13.118 9.097 -5.975 1.00 1.43 C ATOM 208 CD1 LEU A 13 -12.944 7.701 -6.553 1.00 1.81 C ATOM 209 CD2 LEU A 13 -14.430 9.195 -5.210 1.00 1.76 C ATOM 0 H LEU A 13 -12.401 11.546 -6.361 1.00 1.41 H new ATOM 0 HA LEU A 13 -10.170 10.631 -4.880 1.00 1.35 H new ATOM 0 HB2 LEU A 13 -11.496 8.526 -4.705 1.00 1.43 H new ATOM 0 HB3 LEU A 13 -12.335 9.976 -4.190 1.00 1.43 H new ATOM 0 HG LEU A 13 -13.141 9.809 -6.800 1.00 1.43 H new ATOM 0 HD11 LEU A 13 -13.790 7.467 -7.199 1.00 1.81 H new ATOM 0 HD12 LEU A 13 -12.022 7.660 -7.133 1.00 1.81 H new ATOM 0 HD13 LEU A 13 -12.895 6.975 -5.742 1.00 1.81 H new ATOM 0 HD21 LEU A 13 -15.257 8.939 -5.872 1.00 1.76 H new ATOM 0 HD22 LEU A 13 -14.412 8.504 -4.367 1.00 1.76 H new ATOM 0 HD23 LEU A 13 -14.562 10.213 -4.842 1.00 1.76 H new ATOM 221 N LEU A 14 -10.383 9.591 -7.959 1.00 1.21 N ATOM 222 CA LEU A 14 -9.651 8.890 -9.006 1.00 1.13 C ATOM 223 C LEU A 14 -8.240 9.459 -9.111 1.00 1.11 C ATOM 224 O LEU A 14 -7.265 8.713 -9.162 1.00 1.04 O ATOM 225 CB LEU A 14 -10.388 9.010 -10.349 1.00 1.16 C ATOM 226 CG LEU A 14 -9.696 8.339 -11.545 1.00 1.09 C ATOM 227 CD1 LEU A 14 -9.412 6.870 -11.265 1.00 1.11 C ATOM 228 CD2 LEU A 14 -10.545 8.482 -12.799 1.00 1.23 C ATOM 0 H LEU A 14 -11.182 10.132 -8.290 1.00 1.21 H new ATOM 0 HA LEU A 14 -9.587 7.832 -8.751 1.00 1.13 H new ATOM 0 HB2 LEU A 14 -11.383 8.578 -10.238 1.00 1.16 H new ATOM 0 HB3 LEU A 14 -10.523 10.067 -10.576 1.00 1.16 H new ATOM 0 HG LEU A 14 -8.743 8.843 -11.705 1.00 1.09 H new ATOM 0 HD11 LEU A 14 -8.922 6.423 -12.130 1.00 1.11 H new ATOM 0 HD12 LEU A 14 -8.761 6.785 -10.395 1.00 1.11 H new ATOM 0 HD13 LEU A 14 -10.349 6.349 -11.069 1.00 1.11 H new ATOM 0 HD21 LEU A 14 -10.040 8.001 -13.637 1.00 1.23 H new ATOM 0 HD22 LEU A 14 -11.514 8.008 -12.639 1.00 1.23 H new ATOM 0 HD23 LEU A 14 -10.690 9.539 -13.021 1.00 1.23 H new ATOM 240 N LYS A 15 -8.148 10.786 -9.106 1.00 1.19 N ATOM 241 CA LYS A 15 -6.862 11.472 -9.187 1.00 1.19 C ATOM 242 C LYS A 15 -6.019 11.190 -7.947 1.00 1.14 C ATOM 243 O LYS A 15 -4.828 10.882 -8.045 1.00 1.09 O ATOM 244 CB LYS A 15 -7.072 12.986 -9.301 1.00 1.32 C ATOM 245 CG LYS A 15 -7.666 13.452 -10.622 1.00 1.56 C ATOM 246 CD LYS A 15 -7.976 14.945 -10.583 1.00 1.68 C ATOM 247 CE LYS A 15 -7.574 15.644 -11.872 1.00 1.70 C ATOM 248 NZ LYS A 15 -8.543 15.402 -12.972 1.00 1.93 N ATOM 0 H LYS A 15 -8.953 11.410 -9.046 1.00 1.19 H new ATOM 0 HA LYS A 15 -6.344 11.101 -10.071 1.00 1.19 H new ATOM 0 HB2 LYS A 15 -7.726 13.310 -8.491 1.00 1.32 H new ATOM 0 HB3 LYS A 15 -6.113 13.483 -9.155 1.00 1.32 H new ATOM 0 HG2 LYS A 15 -6.969 13.242 -11.433 1.00 1.56 H new ATOM 0 HG3 LYS A 15 -8.577 12.893 -10.833 1.00 1.56 H new ATOM 0 HD2 LYS A 15 -9.042 15.089 -10.410 1.00 1.68 H new ATOM 0 HD3 LYS A 15 -7.452 15.402 -9.744 1.00 1.68 H new ATOM 0 HE2 LYS A 15 -7.494 16.716 -11.691 1.00 1.70 H new ATOM 0 HE3 LYS A 15 -6.587 15.297 -12.178 1.00 1.70 H new ATOM 0 HZ1 LYS A 15 -8.096 15.626 -13.884 1.00 1.93 H new ATOM 0 HZ2 LYS A 15 -8.834 14.404 -12.965 1.00 1.93 H new ATOM 0 HZ3 LYS A 15 -9.378 16.007 -12.838 1.00 1.93 H new ATOM 262 N LYS A 16 -6.663 11.286 -6.788 1.00 1.17 N ATOM 263 CA LYS A 16 -6.001 11.083 -5.502 1.00 1.16 C ATOM 264 C LYS A 16 -5.428 9.679 -5.344 1.00 1.04 C ATOM 265 O LYS A 16 -4.257 9.524 -5.002 1.00 1.05 O ATOM 266 CB LYS A 16 -6.978 11.350 -4.350 1.00 1.26 C ATOM 267 CG LYS A 16 -7.417 12.802 -4.237 1.00 1.32 C ATOM 268 CD LYS A 16 -6.252 13.738 -3.951 1.00 1.30 C ATOM 269 CE LYS A 16 -5.603 13.436 -2.612 1.00 1.50 C ATOM 270 NZ LYS A 16 -4.453 14.338 -2.346 1.00 1.62 N ATOM 0 H LYS A 16 -7.656 11.506 -6.713 1.00 1.17 H new ATOM 0 HA LYS A 16 -5.171 11.789 -5.472 1.00 1.16 H new ATOM 0 HB2 LYS A 16 -7.860 10.723 -4.482 1.00 1.26 H new ATOM 0 HB3 LYS A 16 -6.510 11.048 -3.413 1.00 1.26 H new ATOM 0 HG2 LYS A 16 -7.904 13.105 -5.164 1.00 1.32 H new ATOM 0 HG3 LYS A 16 -8.158 12.894 -3.443 1.00 1.32 H new ATOM 0 HD2 LYS A 16 -5.509 13.647 -4.744 1.00 1.30 H new ATOM 0 HD3 LYS A 16 -6.604 14.770 -3.960 1.00 1.30 H new ATOM 0 HE2 LYS A 16 -6.341 13.542 -1.817 1.00 1.50 H new ATOM 0 HE3 LYS A 16 -5.265 12.400 -2.596 1.00 1.50 H new ATOM 0 HZ1 LYS A 16 -4.034 14.103 -1.423 1.00 1.62 H new ATOM 0 HZ2 LYS A 16 -3.738 14.218 -3.092 1.00 1.62 H new ATOM 0 HZ3 LYS A 16 -4.781 15.325 -2.336 1.00 1.62 H new ATOM 284 N ILE A 17 -6.245 8.664 -5.593 1.00 0.96 N ATOM 285 CA ILE A 17 -5.813 7.279 -5.427 1.00 0.88 C ATOM 286 C ILE A 17 -4.822 6.847 -6.514 1.00 0.85 C ATOM 287 O ILE A 17 -3.880 6.095 -6.236 1.00 0.83 O ATOM 288 CB ILE A 17 -7.030 6.322 -5.370 1.00 0.85 C ATOM 289 CG1 ILE A 17 -7.923 6.700 -4.177 1.00 1.01 C ATOM 290 CG2 ILE A 17 -6.584 4.869 -5.265 1.00 0.89 C ATOM 291 CD1 ILE A 17 -9.147 5.824 -4.012 1.00 1.02 C ATOM 0 H ILE A 17 -7.209 8.771 -5.910 1.00 0.96 H new ATOM 0 HA ILE A 17 -5.286 7.220 -4.475 1.00 0.88 H new ATOM 0 HB ILE A 17 -7.599 6.425 -6.294 1.00 0.85 H new ATOM 0 HG12 ILE A 17 -7.330 6.650 -3.264 1.00 1.01 H new ATOM 0 HG13 ILE A 17 -8.244 7.735 -4.292 1.00 1.01 H new ATOM 0 HG21 ILE A 17 -7.460 4.221 -5.227 1.00 0.89 H new ATOM 0 HG22 ILE A 17 -5.979 4.610 -6.134 1.00 0.89 H new ATOM 0 HG23 ILE A 17 -5.993 4.734 -4.359 1.00 0.89 H new ATOM 0 HD11 ILE A 17 -9.721 6.159 -3.148 1.00 1.02 H new ATOM 0 HD12 ILE A 17 -9.766 5.891 -4.907 1.00 1.02 H new ATOM 0 HD13 ILE A 17 -8.837 4.790 -3.862 1.00 1.02 H new ATOM 303 N ASP A 18 -5.008 7.344 -7.734 1.00 0.90 N ATOM 304 CA ASP A 18 -4.111 7.000 -8.845 1.00 0.93 C ATOM 305 C ASP A 18 -2.693 7.489 -8.562 1.00 0.93 C ATOM 306 O ASP A 18 -1.719 6.768 -8.771 1.00 0.93 O ATOM 307 CB ASP A 18 -4.610 7.613 -10.160 1.00 1.04 C ATOM 308 CG ASP A 18 -3.785 7.191 -11.365 1.00 1.20 C ATOM 309 OD1 ASP A 18 -2.799 7.888 -11.701 1.00 1.62 O ATOM 310 OD2 ASP A 18 -4.127 6.166 -11.996 1.00 1.66 O ATOM 0 H ASP A 18 -5.764 7.982 -7.982 1.00 0.90 H new ATOM 0 HA ASP A 18 -4.103 5.914 -8.941 1.00 0.93 H new ATOM 0 HB2 ASP A 18 -5.649 7.322 -10.318 1.00 1.04 H new ATOM 0 HB3 ASP A 18 -4.592 8.700 -10.077 1.00 1.04 H new ATOM 315 N SER A 19 -2.590 8.716 -8.072 1.00 0.99 N ATOM 316 CA SER A 19 -1.297 9.308 -7.763 1.00 1.03 C ATOM 317 C SER A 19 -0.677 8.677 -6.519 1.00 0.96 C ATOM 318 O SER A 19 0.543 8.554 -6.421 1.00 0.96 O ATOM 319 CB SER A 19 -1.453 10.817 -7.556 1.00 1.17 C ATOM 320 OG SER A 19 -2.083 11.422 -8.670 1.00 1.28 O ATOM 0 H SER A 19 -3.388 9.322 -7.880 1.00 0.99 H new ATOM 0 HA SER A 19 -0.631 9.119 -8.605 1.00 1.03 H new ATOM 0 HB2 SER A 19 -2.039 11.005 -6.656 1.00 1.17 H new ATOM 0 HB3 SER A 19 -0.474 11.269 -7.399 1.00 1.17 H new ATOM 0 HG SER A 19 -3.055 11.328 -8.587 1.00 1.28 H new ATOM 326 N LEU A 20 -1.526 8.269 -5.581 1.00 0.92 N ATOM 327 CA LEU A 20 -1.073 7.665 -4.336 1.00 0.90 C ATOM 328 C LEU A 20 -0.229 6.422 -4.600 1.00 0.84 C ATOM 329 O LEU A 20 0.898 6.315 -4.118 1.00 0.86 O ATOM 330 CB LEU A 20 -2.281 7.307 -3.466 1.00 0.92 C ATOM 331 CG LEU A 20 -1.961 6.734 -2.084 1.00 1.01 C ATOM 332 CD1 LEU A 20 -1.193 7.746 -1.256 1.00 1.37 C ATOM 333 CD2 LEU A 20 -3.243 6.326 -1.373 1.00 1.14 C ATOM 0 H LEU A 20 -2.540 8.347 -5.663 1.00 0.92 H new ATOM 0 HA LEU A 20 -0.449 8.388 -3.811 1.00 0.90 H new ATOM 0 HB2 LEU A 20 -2.889 8.202 -3.335 1.00 0.92 H new ATOM 0 HB3 LEU A 20 -2.892 6.583 -4.006 1.00 0.92 H new ATOM 0 HG LEU A 20 -1.337 5.849 -2.210 1.00 1.01 H new ATOM 0 HD11 LEU A 20 -0.973 7.323 -0.276 1.00 1.37 H new ATOM 0 HD12 LEU A 20 -0.260 7.996 -1.761 1.00 1.37 H new ATOM 0 HD13 LEU A 20 -1.793 8.648 -1.135 1.00 1.37 H new ATOM 0 HD21 LEU A 20 -3.001 5.920 -0.391 1.00 1.14 H new ATOM 0 HD22 LEU A 20 -3.888 7.197 -1.257 1.00 1.14 H new ATOM 0 HD23 LEU A 20 -3.760 5.568 -1.962 1.00 1.14 H new ATOM 345 N ILE A 21 -0.759 5.501 -5.391 1.00 0.80 N ATOM 346 CA ILE A 21 -0.034 4.275 -5.700 1.00 0.79 C ATOM 347 C ILE A 21 1.186 4.562 -6.574 1.00 0.81 C ATOM 348 O ILE A 21 2.192 3.857 -6.500 1.00 0.83 O ATOM 349 CB ILE A 21 -0.935 3.226 -6.383 1.00 0.81 C ATOM 350 CG1 ILE A 21 -1.608 3.817 -7.627 1.00 1.06 C ATOM 351 CG2 ILE A 21 -1.974 2.716 -5.395 1.00 1.04 C ATOM 352 CD1 ILE A 21 -2.391 2.805 -8.437 1.00 1.23 C ATOM 0 H ILE A 21 -1.678 5.576 -5.827 1.00 0.80 H new ATOM 0 HA ILE A 21 0.301 3.862 -4.749 1.00 0.79 H new ATOM 0 HB ILE A 21 -0.318 2.387 -6.705 1.00 0.81 H new ATOM 0 HG12 ILE A 21 -2.279 4.619 -7.319 1.00 1.06 H new ATOM 0 HG13 ILE A 21 -0.845 4.266 -8.263 1.00 1.06 H new ATOM 0 HG21 ILE A 21 -2.608 1.975 -5.883 1.00 1.04 H new ATOM 0 HG22 ILE A 21 -1.472 2.259 -4.543 1.00 1.04 H new ATOM 0 HG23 ILE A 21 -2.588 3.548 -5.051 1.00 1.04 H new ATOM 0 HD11 ILE A 21 -2.838 3.298 -9.301 1.00 1.23 H new ATOM 0 HD12 ILE A 21 -1.722 2.014 -8.776 1.00 1.23 H new ATOM 0 HD13 ILE A 21 -3.178 2.374 -7.818 1.00 1.23 H new ATOM 364 N GLU A 22 1.092 5.608 -7.389 1.00 0.84 N ATOM 365 CA GLU A 22 2.188 6.003 -8.264 1.00 0.90 C ATOM 366 C GLU A 22 3.364 6.518 -7.440 1.00 0.90 C ATOM 367 O GLU A 22 4.526 6.262 -7.763 1.00 0.93 O ATOM 368 CB GLU A 22 1.715 7.078 -9.238 1.00 0.98 C ATOM 369 CG GLU A 22 2.698 7.364 -10.353 1.00 1.29 C ATOM 370 CD GLU A 22 2.303 8.579 -11.160 1.00 1.78 C ATOM 371 OE1 GLU A 22 1.347 8.486 -11.955 1.00 2.29 O ATOM 372 OE2 GLU A 22 2.947 9.636 -10.997 1.00 2.22 O ATOM 0 H GLU A 22 0.264 6.199 -7.461 1.00 0.84 H new ATOM 0 HA GLU A 22 2.517 5.132 -8.831 1.00 0.90 H new ATOM 0 HB2 GLU A 22 0.765 6.768 -9.674 1.00 0.98 H new ATOM 0 HB3 GLU A 22 1.527 7.999 -8.686 1.00 0.98 H new ATOM 0 HG2 GLU A 22 3.691 7.517 -9.930 1.00 1.29 H new ATOM 0 HG3 GLU A 22 2.762 6.497 -11.011 1.00 1.29 H new ATOM 379 N ALA A 23 3.052 7.242 -6.374 1.00 0.89 N ATOM 380 CA ALA A 23 4.075 7.786 -5.497 1.00 0.92 C ATOM 381 C ALA A 23 4.867 6.661 -4.842 1.00 0.88 C ATOM 382 O ALA A 23 6.098 6.705 -4.790 1.00 0.89 O ATOM 383 CB ALA A 23 3.449 8.685 -4.442 1.00 0.94 C ATOM 0 H ALA A 23 2.096 7.466 -6.097 1.00 0.89 H new ATOM 0 HA ALA A 23 4.761 8.386 -6.095 1.00 0.92 H new ATOM 0 HB1 ALA A 23 4.230 9.084 -3.794 1.00 0.94 H new ATOM 0 HB2 ALA A 23 2.926 9.508 -4.929 1.00 0.94 H new ATOM 0 HB3 ALA A 23 2.742 8.108 -3.846 1.00 0.94 H new ATOM 389 N ILE A 24 4.152 5.645 -4.364 1.00 0.86 N ATOM 390 CA ILE A 24 4.785 4.495 -3.720 1.00 0.85 C ATOM 391 C ILE A 24 5.589 3.690 -4.737 1.00 0.83 C ATOM 392 O ILE A 24 6.662 3.175 -4.426 1.00 0.83 O ATOM 393 CB ILE A 24 3.750 3.573 -3.036 1.00 0.87 C ATOM 394 CG1 ILE A 24 2.680 4.423 -2.340 1.00 1.12 C ATOM 395 CG2 ILE A 24 4.447 2.645 -2.044 1.00 1.03 C ATOM 396 CD1 ILE A 24 1.880 3.698 -1.276 1.00 1.05 C ATOM 0 H ILE A 24 3.134 5.594 -4.410 1.00 0.86 H new ATOM 0 HA ILE A 24 5.451 4.886 -2.951 1.00 0.85 H new ATOM 0 HB ILE A 24 3.262 2.954 -3.789 1.00 0.87 H new ATOM 0 HG12 ILE A 24 3.163 5.287 -1.884 1.00 1.12 H new ATOM 0 HG13 ILE A 24 1.992 4.804 -3.095 1.00 1.12 H new ATOM 0 HG21 ILE A 24 3.708 2.000 -1.568 1.00 1.03 H new ATOM 0 HG22 ILE A 24 5.178 2.032 -2.571 1.00 1.03 H new ATOM 0 HG23 ILE A 24 4.953 3.240 -1.283 1.00 1.03 H new ATOM 0 HD11 ILE A 24 1.150 4.381 -0.842 1.00 1.05 H new ATOM 0 HD12 ILE A 24 1.362 2.850 -1.725 1.00 1.05 H new ATOM 0 HD13 ILE A 24 2.552 3.341 -0.495 1.00 1.05 H new ATOM 408 N LYS A 25 5.063 3.606 -5.956 1.00 0.83 N ATOM 409 CA LYS A 25 5.721 2.886 -7.039 1.00 0.84 C ATOM 410 C LYS A 25 7.071 3.525 -7.340 1.00 0.86 C ATOM 411 O LYS A 25 8.038 2.851 -7.690 1.00 0.86 O ATOM 412 CB LYS A 25 4.837 2.901 -8.292 1.00 0.88 C ATOM 413 CG LYS A 25 5.262 1.901 -9.354 1.00 0.96 C ATOM 414 CD LYS A 25 4.648 0.530 -9.114 1.00 1.13 C ATOM 415 CE LYS A 25 5.004 -0.442 -10.230 1.00 1.39 C ATOM 416 NZ LYS A 25 4.490 0.007 -11.552 1.00 1.61 N ATOM 0 H LYS A 25 4.174 4.033 -6.219 1.00 0.83 H new ATOM 0 HA LYS A 25 5.880 1.851 -6.735 1.00 0.84 H new ATOM 0 HB2 LYS A 25 3.807 2.693 -8.001 1.00 0.88 H new ATOM 0 HB3 LYS A 25 4.850 3.902 -8.723 1.00 0.88 H new ATOM 0 HG2 LYS A 25 4.965 2.266 -10.337 1.00 0.96 H new ATOM 0 HG3 LYS A 25 6.349 1.817 -9.361 1.00 0.96 H new ATOM 0 HD2 LYS A 25 4.998 0.135 -8.160 1.00 1.13 H new ATOM 0 HD3 LYS A 25 3.564 0.623 -9.042 1.00 1.13 H new ATOM 0 HE2 LYS A 25 6.087 -0.552 -10.282 1.00 1.39 H new ATOM 0 HE3 LYS A 25 4.594 -1.425 -9.998 1.00 1.39 H new ATOM 0 HZ1 LYS A 25 4.511 -0.789 -12.221 1.00 1.61 H new ATOM 0 HZ2 LYS A 25 3.512 0.346 -11.447 1.00 1.61 H new ATOM 0 HZ3 LYS A 25 5.087 0.778 -11.913 1.00 1.61 H new ATOM 430 N LYS A 26 7.123 4.842 -7.191 1.00 0.87 N ATOM 431 CA LYS A 26 8.345 5.590 -7.431 1.00 0.91 C ATOM 432 C LYS A 26 9.334 5.415 -6.286 1.00 0.90 C ATOM 433 O LYS A 26 10.534 5.332 -6.519 1.00 0.91 O ATOM 434 CB LYS A 26 8.035 7.072 -7.641 1.00 0.97 C ATOM 435 CG LYS A 26 7.985 7.480 -9.105 1.00 1.07 C ATOM 436 CD LYS A 26 9.376 7.689 -9.687 1.00 1.21 C ATOM 437 CE LYS A 26 9.864 6.464 -10.442 1.00 1.35 C ATOM 438 NZ LYS A 26 11.211 6.678 -11.028 1.00 1.42 N ATOM 0 H LYS A 26 6.329 5.414 -6.904 1.00 0.87 H new ATOM 0 HA LYS A 26 8.804 5.195 -8.337 1.00 0.91 H new ATOM 0 HB2 LYS A 26 7.078 7.304 -7.174 1.00 0.97 H new ATOM 0 HB3 LYS A 26 8.791 7.669 -7.131 1.00 0.97 H new ATOM 0 HG2 LYS A 26 7.464 6.713 -9.678 1.00 1.07 H new ATOM 0 HG3 LYS A 26 7.408 8.399 -9.206 1.00 1.07 H new ATOM 0 HD2 LYS A 26 9.364 8.548 -10.358 1.00 1.21 H new ATOM 0 HD3 LYS A 26 10.075 7.922 -8.883 1.00 1.21 H new ATOM 0 HE2 LYS A 26 9.893 5.609 -9.767 1.00 1.35 H new ATOM 0 HE3 LYS A 26 9.157 6.220 -11.235 1.00 1.35 H new ATOM 0 HZ1 LYS A 26 11.403 5.940 -11.735 1.00 1.42 H new ATOM 0 HZ2 LYS A 26 11.247 7.612 -11.484 1.00 1.42 H new ATOM 0 HZ3 LYS A 26 11.928 6.632 -10.276 1.00 1.42 H new ATOM 452 N ILE A 27 8.829 5.343 -5.057 1.00 0.88 N ATOM 453 CA ILE A 27 9.692 5.190 -3.880 1.00 0.89 C ATOM 454 C ILE A 27 10.601 3.966 -3.999 1.00 0.87 C ATOM 455 O ILE A 27 11.822 4.071 -3.843 1.00 0.90 O ATOM 456 CB ILE A 27 8.871 5.088 -2.568 1.00 0.90 C ATOM 457 CG1 ILE A 27 8.180 6.424 -2.271 1.00 0.90 C ATOM 458 CG2 ILE A 27 9.768 4.677 -1.400 1.00 0.93 C ATOM 459 CD1 ILE A 27 7.401 6.425 -0.973 1.00 1.31 C ATOM 0 H ILE A 27 7.832 5.388 -4.847 1.00 0.88 H new ATOM 0 HA ILE A 27 10.308 6.088 -3.840 1.00 0.89 H new ATOM 0 HB ILE A 27 8.107 4.321 -2.696 1.00 0.90 H new ATOM 0 HG12 ILE A 27 8.932 7.213 -2.235 1.00 0.90 H new ATOM 0 HG13 ILE A 27 7.504 6.665 -3.091 1.00 0.90 H new ATOM 0 HG21 ILE A 27 9.172 4.611 -0.489 1.00 0.93 H new ATOM 0 HG22 ILE A 27 10.218 3.707 -1.610 1.00 0.93 H new ATOM 0 HG23 ILE A 27 10.554 5.420 -1.266 1.00 0.93 H new ATOM 0 HD11 ILE A 27 6.939 7.401 -0.827 1.00 1.31 H new ATOM 0 HD12 ILE A 27 6.627 5.659 -1.013 1.00 1.31 H new ATOM 0 HD13 ILE A 27 8.076 6.215 -0.143 1.00 1.31 H new ATOM 471 N ILE A 28 10.007 2.815 -4.297 1.00 0.83 N ATOM 472 CA ILE A 28 10.766 1.574 -4.425 1.00 0.82 C ATOM 473 C ILE A 28 11.770 1.653 -5.575 1.00 0.83 C ATOM 474 O ILE A 28 12.860 1.087 -5.495 1.00 0.84 O ATOM 475 CB ILE A 28 9.841 0.347 -4.603 1.00 0.82 C ATOM 476 CG1 ILE A 28 10.622 -0.955 -4.379 1.00 0.88 C ATOM 477 CG2 ILE A 28 9.175 0.343 -5.980 1.00 0.88 C ATOM 478 CD1 ILE A 28 11.063 -1.163 -2.942 1.00 1.05 C ATOM 0 H ILE A 28 9.004 2.715 -4.454 1.00 0.83 H new ATOM 0 HA ILE A 28 11.317 1.445 -3.493 1.00 0.82 H new ATOM 0 HB ILE A 28 9.053 0.415 -3.853 1.00 0.82 H new ATOM 0 HG12 ILE A 28 10.002 -1.797 -4.685 1.00 0.88 H new ATOM 0 HG13 ILE A 28 11.501 -0.956 -5.023 1.00 0.88 H new ATOM 0 HG21 ILE A 28 8.532 -0.533 -6.071 1.00 0.88 H new ATOM 0 HG22 ILE A 28 8.576 1.246 -6.097 1.00 0.88 H new ATOM 0 HG23 ILE A 28 9.941 0.313 -6.755 1.00 0.88 H new ATOM 0 HD11 ILE A 28 11.609 -2.103 -2.861 1.00 1.05 H new ATOM 0 HD12 ILE A 28 11.710 -0.341 -2.637 1.00 1.05 H new ATOM 0 HD13 ILE A 28 10.187 -1.195 -2.294 1.00 1.05 H new ATOM 490 N ALA A 29 11.400 2.363 -6.634 1.00 0.84 N ATOM 491 CA ALA A 29 12.269 2.511 -7.792 1.00 0.87 C ATOM 492 C ALA A 29 13.504 3.333 -7.440 1.00 0.90 C ATOM 493 O ALA A 29 14.632 2.932 -7.737 1.00 0.93 O ATOM 494 CB ALA A 29 11.510 3.149 -8.946 1.00 0.90 C ATOM 0 H ALA A 29 10.504 2.845 -6.714 1.00 0.84 H new ATOM 0 HA ALA A 29 12.600 1.520 -8.102 1.00 0.87 H new ATOM 0 HB1 ALA A 29 12.173 3.253 -9.805 1.00 0.90 H new ATOM 0 HB2 ALA A 29 10.662 2.519 -9.216 1.00 0.90 H new ATOM 0 HB3 ALA A 29 11.150 4.133 -8.645 1.00 0.90 H new ATOM 500 N GLU A 30 13.288 4.471 -6.786 1.00 0.93 N ATOM 501 CA GLU A 30 14.386 5.345 -6.388 1.00 0.99 C ATOM 502 C GLU A 30 15.290 4.632 -5.390 1.00 0.99 C ATOM 503 O GLU A 30 16.510 4.803 -5.413 1.00 1.01 O ATOM 504 CB GLU A 30 13.858 6.644 -5.770 1.00 1.06 C ATOM 505 CG GLU A 30 12.798 7.355 -6.604 1.00 1.10 C ATOM 506 CD GLU A 30 13.227 7.592 -8.038 1.00 1.18 C ATOM 507 OE1 GLU A 30 13.990 8.548 -8.289 1.00 1.46 O ATOM 508 OE2 GLU A 30 12.792 6.830 -8.928 1.00 1.25 O ATOM 0 H GLU A 30 12.363 4.809 -6.521 1.00 0.93 H new ATOM 0 HA GLU A 30 14.959 5.594 -7.281 1.00 0.99 H new ATOM 0 HB2 GLU A 30 13.441 6.421 -4.788 1.00 1.06 H new ATOM 0 HB3 GLU A 30 14.696 7.324 -5.613 1.00 1.06 H new ATOM 0 HG2 GLU A 30 11.883 6.763 -6.598 1.00 1.10 H new ATOM 0 HG3 GLU A 30 12.561 8.312 -6.139 1.00 1.10 H new ATOM 515 N PHE A 31 14.683 3.828 -4.524 1.00 0.97 N ATOM 516 CA PHE A 31 15.420 3.079 -3.513 1.00 1.00 C ATOM 517 C PHE A 31 16.471 2.189 -4.168 1.00 0.97 C ATOM 518 O PHE A 31 17.617 2.123 -3.716 1.00 1.00 O ATOM 519 CB PHE A 31 14.448 2.238 -2.675 1.00 1.02 C ATOM 520 CG PHE A 31 15.112 1.297 -1.706 1.00 1.10 C ATOM 521 CD1 PHE A 31 15.742 1.778 -0.570 1.00 1.42 C ATOM 522 CD2 PHE A 31 15.105 -0.069 -1.938 1.00 1.79 C ATOM 523 CE1 PHE A 31 16.352 0.912 0.318 1.00 1.58 C ATOM 524 CE2 PHE A 31 15.713 -0.940 -1.055 1.00 1.98 C ATOM 525 CZ PHE A 31 16.338 -0.449 0.075 1.00 1.54 C ATOM 0 H PHE A 31 13.674 3.678 -4.503 1.00 0.97 H new ATOM 0 HA PHE A 31 15.932 3.783 -2.857 1.00 1.00 H new ATOM 0 HB2 PHE A 31 13.793 2.909 -2.119 1.00 1.02 H new ATOM 0 HB3 PHE A 31 13.815 1.659 -3.348 1.00 1.02 H new ATOM 0 HD1 PHE A 31 15.757 2.840 -0.376 1.00 1.42 H new ATOM 0 HD2 PHE A 31 14.618 -0.458 -2.820 1.00 1.79 H new ATOM 0 HE1 PHE A 31 16.839 1.298 1.201 1.00 1.58 H new ATOM 0 HE2 PHE A 31 15.700 -2.003 -1.248 1.00 1.98 H new ATOM 0 HZ PHE A 31 16.815 -1.127 0.767 1.00 1.54 H new ATOM 535 N ASP A 32 16.071 1.520 -5.241 1.00 0.93 N ATOM 536 CA ASP A 32 16.968 0.636 -5.978 1.00 0.92 C ATOM 537 C ASP A 32 18.155 1.422 -6.530 1.00 0.92 C ATOM 538 O ASP A 32 19.305 0.985 -6.433 1.00 0.93 O ATOM 539 CB ASP A 32 16.216 -0.041 -7.126 1.00 0.94 C ATOM 540 CG ASP A 32 16.963 -1.233 -7.696 1.00 1.15 C ATOM 541 OD1 ASP A 32 17.958 -1.028 -8.416 1.00 1.45 O ATOM 542 OD2 ASP A 32 16.541 -2.382 -7.440 1.00 1.54 O ATOM 0 H ASP A 32 15.127 1.572 -5.623 1.00 0.93 H new ATOM 0 HA ASP A 32 17.338 -0.128 -5.295 1.00 0.92 H new ATOM 0 HB2 ASP A 32 15.238 -0.366 -6.772 1.00 0.94 H new ATOM 0 HB3 ASP A 32 16.042 0.686 -7.919 1.00 0.94 H new ATOM 547 N VAL A 33 17.863 2.590 -7.089 1.00 0.93 N ATOM 548 CA VAL A 33 18.889 3.462 -7.656 1.00 0.95 C ATOM 549 C VAL A 33 19.835 3.967 -6.566 1.00 0.96 C ATOM 550 O VAL A 33 21.048 4.042 -6.768 1.00 0.97 O ATOM 551 CB VAL A 33 18.262 4.669 -8.389 1.00 0.99 C ATOM 552 CG1 VAL A 33 19.327 5.491 -9.099 1.00 1.06 C ATOM 553 CG2 VAL A 33 17.195 4.209 -9.373 1.00 0.98 C ATOM 0 H VAL A 33 16.915 2.959 -7.163 1.00 0.93 H new ATOM 0 HA VAL A 33 19.452 2.870 -8.377 1.00 0.95 H new ATOM 0 HB VAL A 33 17.788 5.305 -7.641 1.00 0.99 H new ATOM 0 HG11 VAL A 33 18.858 6.334 -9.606 1.00 1.06 H new ATOM 0 HG12 VAL A 33 20.047 5.862 -8.369 1.00 1.06 H new ATOM 0 HG13 VAL A 33 19.840 4.867 -9.831 1.00 1.06 H new ATOM 0 HG21 VAL A 33 16.767 5.076 -9.877 1.00 0.98 H new ATOM 0 HG22 VAL A 33 17.643 3.544 -10.111 1.00 0.98 H new ATOM 0 HG23 VAL A 33 16.409 3.678 -8.836 1.00 0.98 H new ATOM 563 N VAL A 34 19.266 4.303 -5.411 1.00 0.98 N ATOM 564 CA VAL A 34 20.044 4.788 -4.272 1.00 1.02 C ATOM 565 C VAL A 34 21.066 3.738 -3.846 1.00 1.02 C ATOM 566 O VAL A 34 22.218 4.063 -3.553 1.00 1.04 O ATOM 567 CB VAL A 34 19.128 5.153 -3.076 1.00 1.07 C ATOM 568 CG1 VAL A 34 19.919 5.267 -1.780 1.00 1.14 C ATOM 569 CG2 VAL A 34 18.389 6.454 -3.359 1.00 1.08 C ATOM 0 H VAL A 34 18.262 4.248 -5.238 1.00 0.98 H new ATOM 0 HA VAL A 34 20.566 5.692 -4.585 1.00 1.02 H new ATOM 0 HB VAL A 34 18.403 4.348 -2.953 1.00 1.07 H new ATOM 0 HG11 VAL A 34 19.244 5.524 -0.963 1.00 1.14 H new ATOM 0 HG12 VAL A 34 20.403 4.315 -1.564 1.00 1.14 H new ATOM 0 HG13 VAL A 34 20.676 6.044 -1.883 1.00 1.14 H new ATOM 0 HG21 VAL A 34 17.749 6.700 -2.512 1.00 1.08 H new ATOM 0 HG22 VAL A 34 19.111 7.256 -3.514 1.00 1.08 H new ATOM 0 HG23 VAL A 34 17.778 6.338 -4.254 1.00 1.08 H new ATOM 579 N LYS A 35 20.633 2.479 -3.837 1.00 1.00 N ATOM 580 CA LYS A 35 21.496 1.366 -3.459 1.00 1.02 C ATOM 581 C LYS A 35 22.713 1.294 -4.379 1.00 1.01 C ATOM 582 O LYS A 35 23.828 1.016 -3.937 1.00 1.04 O ATOM 583 CB LYS A 35 20.713 0.047 -3.515 1.00 1.02 C ATOM 584 CG LYS A 35 21.544 -1.185 -3.193 1.00 1.06 C ATOM 585 CD LYS A 35 20.725 -2.453 -3.353 1.00 1.23 C ATOM 586 CE LYS A 35 21.579 -3.604 -3.846 1.00 1.45 C ATOM 587 NZ LYS A 35 20.759 -4.790 -4.205 1.00 1.92 N ATOM 0 H LYS A 35 19.683 2.205 -4.089 1.00 1.00 H new ATOM 0 HA LYS A 35 21.843 1.529 -2.439 1.00 1.02 H new ATOM 0 HB2 LYS A 35 19.879 0.102 -2.815 1.00 1.02 H new ATOM 0 HB3 LYS A 35 20.286 -0.067 -4.511 1.00 1.02 H new ATOM 0 HG2 LYS A 35 22.412 -1.224 -3.851 1.00 1.06 H new ATOM 0 HG3 LYS A 35 21.920 -1.117 -2.172 1.00 1.06 H new ATOM 0 HD2 LYS A 35 20.271 -2.718 -2.398 1.00 1.23 H new ATOM 0 HD3 LYS A 35 19.910 -2.276 -4.055 1.00 1.23 H new ATOM 0 HE2 LYS A 35 22.153 -3.283 -4.715 1.00 1.45 H new ATOM 0 HE3 LYS A 35 22.297 -3.880 -3.074 1.00 1.45 H new ATOM 0 HZ1 LYS A 35 21.381 -5.554 -4.537 1.00 1.92 H new ATOM 0 HZ2 LYS A 35 20.230 -5.112 -3.369 1.00 1.92 H new ATOM 0 HZ3 LYS A 35 20.091 -4.535 -4.960 1.00 1.92 H new ATOM 601 N GLU A 36 22.485 1.551 -5.660 1.00 0.99 N ATOM 602 CA GLU A 36 23.552 1.526 -6.650 1.00 1.00 C ATOM 603 C GLU A 36 24.470 2.744 -6.499 1.00 0.99 C ATOM 604 O GLU A 36 25.686 2.639 -6.652 1.00 1.01 O ATOM 605 CB GLU A 36 22.959 1.484 -8.058 1.00 1.03 C ATOM 606 CG GLU A 36 23.565 0.403 -8.942 1.00 1.31 C ATOM 607 CD GLU A 36 23.281 -0.993 -8.427 1.00 1.41 C ATOM 608 OE1 GLU A 36 22.101 -1.398 -8.421 1.00 1.71 O ATOM 609 OE2 GLU A 36 24.233 -1.691 -8.017 1.00 1.44 O ATOM 0 H GLU A 36 21.566 1.780 -6.039 1.00 0.99 H new ATOM 0 HA GLU A 36 24.149 0.629 -6.487 1.00 1.00 H new ATOM 0 HB2 GLU A 36 21.884 1.322 -7.986 1.00 1.03 H new ATOM 0 HB3 GLU A 36 23.104 2.454 -8.533 1.00 1.03 H new ATOM 0 HG2 GLU A 36 23.170 0.501 -9.953 1.00 1.31 H new ATOM 0 HG3 GLU A 36 24.643 0.551 -9.005 1.00 1.31 H new ATOM 616 N SER A 37 23.887 3.890 -6.177 1.00 0.00 N ATOM 617 CA SER A 37 24.619 5.140 -6.000 1.00 0.00 C ATOM 618 C SER A 37 25.634 5.020 -4.886 1.00 0.00 C ATOM 619 O SER A 37 26.806 5.353 -5.058 1.00 0.00 O ATOM 620 CB SER A 37 23.645 6.320 -5.758 1.00 0.00 C ATOM 621 OG SER A 37 22.833 6.615 -6.899 1.00 0.00 O ATOM 0 H SER A 37 22.882 3.981 -6.029 1.00 0.00 H new ATOM 0 HA SER A 37 25.166 5.348 -6.920 1.00 0.00 H new ATOM 0 HB2 SER A 37 23.001 6.085 -4.911 1.00 0.00 H new ATOM 0 HB3 SER A 37 24.217 7.207 -5.487 1.00 0.00 H new ATOM 0 HG SER A 37 22.193 5.887 -7.042 1.00 0.00 H new ATOM 627 N VAL A 38 25.187 4.574 -3.716 1.00 1.03 N ATOM 628 CA VAL A 38 26.070 4.446 -2.561 1.00 1.06 C ATOM 629 C VAL A 38 27.143 3.388 -2.812 1.00 1.07 C ATOM 630 O VAL A 38 28.242 3.465 -2.268 1.00 1.09 O ATOM 631 CB VAL A 38 25.292 4.121 -1.264 1.00 1.10 C ATOM 632 CG1 VAL A 38 24.378 5.279 -0.876 1.00 1.12 C ATOM 633 CG2 VAL A 38 24.496 2.834 -1.407 1.00 1.10 C ATOM 0 H VAL A 38 24.221 4.296 -3.543 1.00 1.03 H new ATOM 0 HA VAL A 38 26.552 5.414 -2.422 1.00 1.06 H new ATOM 0 HB VAL A 38 26.021 3.977 -0.467 1.00 1.10 H new ATOM 0 HG11 VAL A 38 23.841 5.028 0.039 1.00 1.12 H new ATOM 0 HG12 VAL A 38 24.976 6.175 -0.711 1.00 1.12 H new ATOM 0 HG13 VAL A 38 23.663 5.462 -1.678 1.00 1.12 H new ATOM 0 HG21 VAL A 38 23.960 2.633 -0.479 1.00 1.10 H new ATOM 0 HG22 VAL A 38 23.781 2.937 -2.224 1.00 1.10 H new ATOM 0 HG23 VAL A 38 25.175 2.008 -1.621 1.00 1.10 H new ATOM 643 N ASN A 39 26.817 2.411 -3.651 1.00 1.05 N ATOM 644 CA ASN A 39 27.746 1.341 -3.995 1.00 1.08 C ATOM 645 C ASN A 39 28.945 1.912 -4.752 1.00 1.07 C ATOM 646 O ASN A 39 30.102 1.684 -4.384 1.00 1.10 O ATOM 647 CB ASN A 39 27.021 0.292 -4.845 1.00 1.10 C ATOM 648 CG ASN A 39 27.733 -1.048 -4.867 1.00 1.41 C ATOM 649 OD1 ASN A 39 28.440 -1.407 -3.928 1.00 1.68 O ATOM 650 ND2 ASN A 39 27.531 -1.808 -5.935 1.00 1.72 N ATOM 0 H ASN A 39 25.908 2.338 -4.109 1.00 1.05 H new ATOM 0 HA ASN A 39 28.111 0.868 -3.084 1.00 1.08 H new ATOM 0 HB2 ASN A 39 26.011 0.154 -4.459 1.00 1.10 H new ATOM 0 HB3 ASN A 39 26.924 0.663 -5.865 1.00 1.10 H new ATOM 0 HD21 ASN A 39 27.970 -2.727 -5.998 1.00 1.72 H new ATOM 0 HD22 ASN A 39 26.937 -1.474 -6.694 1.00 1.72 H new ATOM 657 N GLU A 40 28.655 2.670 -5.806 1.00 1.06 N ATOM 658 CA GLU A 40 29.690 3.301 -6.621 1.00 1.08 C ATOM 659 C GLU A 40 30.459 4.345 -5.812 1.00 1.06 C ATOM 660 O GLU A 40 31.688 4.410 -5.867 1.00 1.09 O ATOM 661 CB GLU A 40 29.061 3.962 -7.849 1.00 1.11 C ATOM 662 CG GLU A 40 28.653 2.981 -8.937 1.00 1.33 C ATOM 663 CD GLU A 40 29.837 2.462 -9.724 1.00 1.77 C ATOM 664 OE1 GLU A 40 30.646 3.286 -10.204 1.00 2.13 O ATOM 665 OE2 GLU A 40 29.970 1.229 -9.867 1.00 2.31 O ATOM 0 H GLU A 40 27.703 2.863 -6.118 1.00 1.06 H new ATOM 0 HA GLU A 40 30.388 2.528 -6.943 1.00 1.08 H new ATOM 0 HB2 GLU A 40 28.183 4.527 -7.535 1.00 1.11 H new ATOM 0 HB3 GLU A 40 29.769 4.678 -8.266 1.00 1.11 H new ATOM 0 HG2 GLU A 40 28.125 2.141 -8.485 1.00 1.33 H new ATOM 0 HG3 GLU A 40 27.954 3.468 -9.617 1.00 1.33 H new ATOM 672 N LEU A 41 29.721 5.148 -5.054 1.00 1.04 N ATOM 673 CA LEU A 41 30.299 6.198 -4.224 1.00 1.05 C ATOM 674 C LEU A 41 31.310 5.617 -3.242 1.00 1.08 C ATOM 675 O LEU A 41 32.356 6.210 -2.993 1.00 1.12 O ATOM 676 CB LEU A 41 29.195 6.941 -3.470 1.00 1.04 C ATOM 677 CG LEU A 41 29.665 8.108 -2.599 1.00 1.04 C ATOM 678 CD1 LEU A 41 30.091 9.285 -3.465 1.00 1.19 C ATOM 679 CD2 LEU A 41 28.568 8.518 -1.625 1.00 1.07 C ATOM 0 H LEU A 41 28.704 5.089 -4.998 1.00 1.04 H new ATOM 0 HA LEU A 41 30.819 6.902 -4.873 1.00 1.05 H new ATOM 0 HB2 LEU A 41 28.474 7.319 -4.195 1.00 1.04 H new ATOM 0 HB3 LEU A 41 28.667 6.227 -2.837 1.00 1.04 H new ATOM 0 HG LEU A 41 30.531 7.784 -2.021 1.00 1.04 H new ATOM 0 HD11 LEU A 41 30.422 10.105 -2.827 1.00 1.19 H new ATOM 0 HD12 LEU A 41 30.909 8.980 -4.117 1.00 1.19 H new ATOM 0 HD13 LEU A 41 29.247 9.615 -4.071 1.00 1.19 H new ATOM 0 HD21 LEU A 41 28.917 9.349 -1.012 1.00 1.07 H new ATOM 0 HD22 LEU A 41 27.683 8.825 -2.182 1.00 1.07 H new ATOM 0 HD23 LEU A 41 28.318 7.674 -0.982 1.00 1.07 H new ATOM 691 N SER A 42 31.000 4.445 -2.703 1.00 1.07 N ATOM 692 CA SER A 42 31.875 3.774 -1.752 1.00 1.12 C ATOM 693 C SER A 42 33.234 3.478 -2.382 1.00 1.16 C ATOM 694 O SER A 42 34.279 3.701 -1.767 1.00 1.20 O ATOM 695 CB SER A 42 31.225 2.475 -1.264 1.00 1.13 C ATOM 696 OG SER A 42 32.117 1.720 -0.460 1.00 1.47 O ATOM 0 H SER A 42 30.141 3.936 -2.911 1.00 1.07 H new ATOM 0 HA SER A 42 32.029 4.436 -0.900 1.00 1.12 H new ATOM 0 HB2 SER A 42 30.327 2.708 -0.693 1.00 1.13 H new ATOM 0 HB3 SER A 42 30.912 1.879 -2.121 1.00 1.13 H new ATOM 0 HG SER A 42 31.674 0.898 -0.163 1.00 1.47 H new ATOM 702 N GLU A 43 33.214 2.998 -3.618 1.00 1.16 N ATOM 703 CA GLU A 43 34.441 2.662 -4.329 1.00 1.22 C ATOM 704 C GLU A 43 35.284 3.908 -4.597 1.00 1.21 C ATOM 705 O GLU A 43 36.510 3.833 -4.671 1.00 1.25 O ATOM 706 CB GLU A 43 34.110 1.965 -5.649 1.00 1.27 C ATOM 707 CG GLU A 43 34.877 0.667 -5.867 1.00 1.60 C ATOM 708 CD GLU A 43 34.452 -0.433 -4.916 1.00 1.71 C ATOM 709 OE1 GLU A 43 34.842 -0.381 -3.734 1.00 1.98 O ATOM 710 OE2 GLU A 43 33.732 -1.361 -5.342 1.00 1.94 O ATOM 0 H GLU A 43 32.360 2.832 -4.150 1.00 1.16 H new ATOM 0 HA GLU A 43 35.021 1.987 -3.699 1.00 1.22 H new ATOM 0 HB2 GLU A 43 33.041 1.754 -5.680 1.00 1.27 H new ATOM 0 HB3 GLU A 43 34.325 2.646 -6.473 1.00 1.27 H new ATOM 0 HG2 GLU A 43 34.729 0.331 -6.893 1.00 1.60 H new ATOM 0 HG3 GLU A 43 35.943 0.855 -5.744 1.00 1.60 H new ATOM 717 N LYS A 44 34.623 5.053 -4.729 1.00 1.18 N ATOM 718 CA LYS A 44 35.316 6.314 -5.003 1.00 1.20 C ATOM 719 C LYS A 44 35.829 6.959 -3.718 1.00 1.20 C ATOM 720 O LYS A 44 36.683 7.847 -3.755 1.00 1.25 O ATOM 721 CB LYS A 44 34.382 7.299 -5.717 1.00 1.22 C ATOM 722 CG LYS A 44 33.633 6.709 -6.905 1.00 1.25 C ATOM 723 CD LYS A 44 34.554 6.421 -8.081 1.00 1.46 C ATOM 724 CE LYS A 44 33.777 5.831 -9.245 1.00 1.75 C ATOM 725 NZ LYS A 44 34.588 5.772 -10.487 1.00 2.12 N ATOM 0 H LYS A 44 33.609 5.138 -4.651 1.00 1.18 H new ATOM 0 HA LYS A 44 36.166 6.082 -5.645 1.00 1.20 H new ATOM 0 HB2 LYS A 44 33.656 7.679 -4.998 1.00 1.22 H new ATOM 0 HB3 LYS A 44 34.967 8.152 -6.060 1.00 1.22 H new ATOM 0 HG2 LYS A 44 33.139 5.787 -6.599 1.00 1.25 H new ATOM 0 HG3 LYS A 44 32.851 7.401 -7.219 1.00 1.25 H new ATOM 0 HD2 LYS A 44 35.047 7.341 -8.396 1.00 1.46 H new ATOM 0 HD3 LYS A 44 35.338 5.729 -7.773 1.00 1.46 H new ATOM 0 HE2 LYS A 44 33.441 4.827 -8.984 1.00 1.75 H new ATOM 0 HE3 LYS A 44 32.884 6.429 -9.424 1.00 1.75 H new ATOM 0 HZ1 LYS A 44 34.018 5.363 -11.255 1.00 2.12 H new ATOM 0 HZ2 LYS A 44 34.888 6.732 -10.752 1.00 2.12 H new ATOM 0 HZ3 LYS A 44 35.427 5.180 -10.326 1.00 2.12 H new ATOM 739 N ALA A 45 35.299 6.524 -2.587 1.00 1.17 N ATOM 740 CA ALA A 45 35.697 7.070 -1.298 1.00 1.18 C ATOM 741 C ALA A 45 36.837 6.270 -0.678 1.00 1.18 C ATOM 742 O ALA A 45 37.648 6.806 0.074 1.00 1.19 O ATOM 743 CB ALA A 45 34.495 7.122 -0.363 1.00 1.21 C ATOM 0 H ALA A 45 34.590 5.792 -2.534 1.00 1.17 H new ATOM 0 HA ALA A 45 36.065 8.084 -1.456 1.00 1.18 H new ATOM 0 HB1 ALA A 45 34.800 7.532 0.600 1.00 1.21 H new ATOM 0 HB2 ALA A 45 33.722 7.756 -0.798 1.00 1.21 H new ATOM 0 HB3 ALA A 45 34.101 6.116 -0.221 1.00 1.21 H new ATOM 749 N LYS A 46 36.912 4.992 -1.020 1.00 1.21 N ATOM 750 CA LYS A 46 37.950 4.110 -0.484 1.00 1.24 C ATOM 751 C LYS A 46 39.348 4.500 -0.959 1.00 1.24 C ATOM 752 O LYS A 46 40.345 4.047 -0.398 1.00 1.27 O ATOM 753 CB LYS A 46 37.668 2.655 -0.864 1.00 1.32 C ATOM 754 CG LYS A 46 37.137 1.821 0.295 1.00 1.61 C ATOM 755 CD LYS A 46 35.685 1.415 0.091 1.00 2.02 C ATOM 756 CE LYS A 46 35.575 0.162 -0.765 1.00 2.38 C ATOM 757 NZ LYS A 46 34.175 -0.109 -1.193 1.00 2.75 N ATOM 0 H LYS A 46 36.267 4.538 -1.667 1.00 1.21 H new ATOM 0 HA LYS A 46 37.924 4.219 0.600 1.00 1.24 H new ATOM 0 HB2 LYS A 46 36.945 2.633 -1.679 1.00 1.32 H new ATOM 0 HB3 LYS A 46 38.585 2.201 -1.239 1.00 1.32 H new ATOM 0 HG2 LYS A 46 37.750 0.927 0.408 1.00 1.61 H new ATOM 0 HG3 LYS A 46 37.227 2.389 1.221 1.00 1.61 H new ATOM 0 HD2 LYS A 46 35.215 1.239 1.059 1.00 2.02 H new ATOM 0 HD3 LYS A 46 35.140 2.231 -0.384 1.00 2.02 H new ATOM 0 HE2 LYS A 46 36.207 0.270 -1.646 1.00 2.38 H new ATOM 0 HE3 LYS A 46 35.953 -0.693 -0.204 1.00 2.38 H new ATOM 0 HZ1 LYS A 46 33.824 -0.961 -0.712 1.00 2.75 H new ATOM 0 HZ2 LYS A 46 33.573 0.702 -0.944 1.00 2.75 H new ATOM 0 HZ3 LYS A 46 34.149 -0.257 -2.222 1.00 2.75 H new ATOM 771 N THR A 47 39.424 5.334 -1.988 1.00 1.23 N ATOM 772 CA THR A 47 40.704 5.764 -2.526 1.00 1.26 C ATOM 773 C THR A 47 41.289 6.931 -1.728 1.00 1.21 C ATOM 774 O THR A 47 42.409 7.373 -1.988 1.00 1.30 O ATOM 775 CB THR A 47 40.562 6.164 -4.003 1.00 1.39 C ATOM 776 OG1 THR A 47 39.227 6.614 -4.252 1.00 1.54 O ATOM 777 CG2 THR A 47 40.881 4.991 -4.917 1.00 1.62 C ATOM 0 H THR A 47 38.612 5.725 -2.466 1.00 1.23 H new ATOM 0 HA THR A 47 41.389 4.920 -2.445 1.00 1.26 H new ATOM 0 HB THR A 47 41.269 6.967 -4.211 1.00 1.39 H new ATOM 0 HG1 THR A 47 39.138 6.870 -5.194 1.00 1.54 H new ATOM 0 HG21 THR A 47 40.773 5.300 -5.957 1.00 1.62 H new ATOM 0 HG22 THR A 47 41.905 4.660 -4.741 1.00 1.62 H new ATOM 0 HG23 THR A 47 40.194 4.171 -4.709 1.00 1.62 H new ATOM 785 N ASP A 48 40.533 7.427 -0.758 1.00 1.15 N ATOM 786 CA ASP A 48 40.986 8.537 0.078 1.00 1.15 C ATOM 787 C ASP A 48 40.744 8.214 1.553 1.00 1.09 C ATOM 788 O ASP A 48 39.646 7.811 1.920 1.00 1.06 O ATOM 789 CB ASP A 48 40.257 9.831 -0.309 1.00 1.24 C ATOM 790 CG ASP A 48 40.611 11.003 0.595 1.00 1.32 C ATOM 791 OD1 ASP A 48 41.668 11.632 0.383 1.00 1.50 O ATOM 792 OD2 ASP A 48 39.826 11.311 1.516 1.00 1.41 O ATOM 0 H ASP A 48 39.602 7.080 -0.528 1.00 1.15 H new ATOM 0 HA ASP A 48 42.055 8.682 -0.081 1.00 1.15 H new ATOM 0 HB2 ASP A 48 40.503 10.086 -1.340 1.00 1.24 H new ATOM 0 HB3 ASP A 48 39.181 9.661 -0.271 1.00 1.24 H new ATOM 797 N PRO A 49 41.766 8.375 2.413 1.00 1.12 N ATOM 798 CA PRO A 49 41.650 8.079 3.850 1.00 1.13 C ATOM 799 C PRO A 49 40.519 8.847 4.539 1.00 1.17 C ATOM 800 O PRO A 49 39.810 8.299 5.385 1.00 1.18 O ATOM 801 CB PRO A 49 43.008 8.498 4.426 1.00 1.22 C ATOM 802 CG PRO A 49 43.657 9.330 3.371 1.00 1.25 C ATOM 803 CD PRO A 49 43.112 8.849 2.058 1.00 1.19 C ATOM 0 HA PRO A 49 41.407 7.029 4.012 1.00 1.13 H new ATOM 0 HB2 PRO A 49 42.883 9.064 5.349 1.00 1.22 H new ATOM 0 HB3 PRO A 49 43.617 7.626 4.666 1.00 1.22 H new ATOM 0 HG2 PRO A 49 43.436 10.387 3.519 1.00 1.25 H new ATOM 0 HG3 PRO A 49 44.741 9.223 3.404 1.00 1.25 H new ATOM 0 HD2 PRO A 49 43.076 9.649 1.318 1.00 1.19 H new ATOM 0 HD3 PRO A 49 43.723 8.051 1.635 1.00 1.19 H new ATOM 811 N GLN A 50 40.345 10.112 4.175 1.00 1.23 N ATOM 812 CA GLN A 50 39.297 10.934 4.770 1.00 1.30 C ATOM 813 C GLN A 50 37.931 10.496 4.258 1.00 1.21 C ATOM 814 O GLN A 50 36.974 10.386 5.026 1.00 1.22 O ATOM 815 CB GLN A 50 39.522 12.417 4.466 1.00 1.43 C ATOM 816 CG GLN A 50 40.635 13.047 5.293 1.00 1.59 C ATOM 817 CD GLN A 50 42.024 12.621 4.854 1.00 1.77 C ATOM 818 OE1 GLN A 50 42.224 12.462 3.550 1.00 2.00 O flip ATOM 819 NE2 GLN A 50 42.919 12.444 5.682 1.00 1.96 N flip ATOM 0 H GLN A 50 40.912 10.589 3.475 1.00 1.23 H new ATOM 0 HA GLN A 50 39.333 10.799 5.851 1.00 1.30 H new ATOM 0 HB2 GLN A 50 39.758 12.531 3.408 1.00 1.43 H new ATOM 0 HB3 GLN A 50 38.595 12.961 4.646 1.00 1.43 H new ATOM 0 HG2 GLN A 50 40.558 14.132 5.227 1.00 1.59 H new ATOM 0 HG3 GLN A 50 40.495 12.781 6.341 1.00 1.59 H new ATOM 0 HE21 GLN A 50 42.728 12.576 6.675 1.00 1.96 H new ATOM 0 HE22 GLN A 50 43.851 12.166 5.374 1.00 1.96 H new ATOM 828 N ALA A 51 37.848 10.243 2.958 1.00 1.16 N ATOM 829 CA ALA A 51 36.610 9.801 2.336 1.00 1.11 C ATOM 830 C ALA A 51 36.211 8.424 2.857 1.00 1.02 C ATOM 831 O ALA A 51 35.028 8.146 3.056 1.00 1.00 O ATOM 832 CB ALA A 51 36.750 9.787 0.823 1.00 1.15 C ATOM 0 H ALA A 51 38.631 10.338 2.311 1.00 1.16 H new ATOM 0 HA ALA A 51 35.820 10.505 2.598 1.00 1.11 H new ATOM 0 HB1 ALA A 51 35.814 9.454 0.374 1.00 1.15 H new ATOM 0 HB2 ALA A 51 36.984 10.791 0.470 1.00 1.15 H new ATOM 0 HB3 ALA A 51 37.552 9.106 0.538 1.00 1.15 H new ATOM 838 N ALA A 52 37.205 7.570 3.078 1.00 1.01 N ATOM 839 CA ALA A 52 36.963 6.232 3.599 1.00 1.01 C ATOM 840 C ALA A 52 36.345 6.315 4.984 1.00 1.04 C ATOM 841 O ALA A 52 35.417 5.577 5.304 1.00 1.05 O ATOM 842 CB ALA A 52 38.255 5.430 3.640 1.00 1.07 C ATOM 0 H ALA A 52 38.187 7.783 2.904 1.00 1.01 H new ATOM 0 HA ALA A 52 36.266 5.721 2.934 1.00 1.01 H new ATOM 0 HB1 ALA A 52 38.052 4.433 4.032 1.00 1.07 H new ATOM 0 HB2 ALA A 52 38.664 5.347 2.633 1.00 1.07 H new ATOM 0 HB3 ALA A 52 38.976 5.934 4.284 1.00 1.07 H new ATOM 848 N GLU A 53 36.864 7.219 5.806 1.00 1.10 N ATOM 849 CA GLU A 53 36.339 7.417 7.151 1.00 1.20 C ATOM 850 C GLU A 53 34.923 7.999 7.084 1.00 1.18 C ATOM 851 O GLU A 53 34.084 7.736 7.950 1.00 1.23 O ATOM 852 CB GLU A 53 37.272 8.331 7.951 1.00 1.32 C ATOM 853 CG GLU A 53 36.973 8.367 9.440 1.00 1.52 C ATOM 854 CD GLU A 53 36.636 6.998 10.005 1.00 1.64 C ATOM 855 OE1 GLU A 53 37.475 6.077 9.904 1.00 1.87 O ATOM 856 OE2 GLU A 53 35.526 6.840 10.553 1.00 1.65 O ATOM 0 H GLU A 53 37.647 7.826 5.565 1.00 1.10 H new ATOM 0 HA GLU A 53 36.287 6.454 7.660 1.00 1.20 H new ATOM 0 HB2 GLU A 53 38.300 8.001 7.805 1.00 1.32 H new ATOM 0 HB3 GLU A 53 37.203 9.343 7.552 1.00 1.32 H new ATOM 0 HG2 GLU A 53 37.836 8.771 9.970 1.00 1.52 H new ATOM 0 HG3 GLU A 53 36.140 9.046 9.623 1.00 1.52 H new ATOM 863 N LYS A 54 34.661 8.778 6.040 1.00 1.14 N ATOM 864 CA LYS A 54 33.347 9.379 5.833 1.00 1.15 C ATOM 865 C LYS A 54 32.318 8.289 5.540 1.00 1.06 C ATOM 866 O LYS A 54 31.216 8.289 6.084 1.00 1.08 O ATOM 867 CB LYS A 54 33.392 10.381 4.675 1.00 1.20 C ATOM 868 CG LYS A 54 33.819 11.780 5.092 1.00 1.43 C ATOM 869 CD LYS A 54 34.490 12.536 3.951 1.00 1.56 C ATOM 870 CE LYS A 54 33.669 12.491 2.666 1.00 1.86 C ATOM 871 NZ LYS A 54 34.255 13.352 1.604 1.00 2.25 N ATOM 0 H LYS A 54 35.345 9.009 5.320 1.00 1.14 H new ATOM 0 HA LYS A 54 33.059 9.910 6.740 1.00 1.15 H new ATOM 0 HB2 LYS A 54 34.080 10.013 3.914 1.00 1.20 H new ATOM 0 HB3 LYS A 54 32.406 10.434 4.214 1.00 1.20 H new ATOM 0 HG2 LYS A 54 32.947 12.338 5.434 1.00 1.43 H new ATOM 0 HG3 LYS A 54 34.506 11.713 5.936 1.00 1.43 H new ATOM 0 HD2 LYS A 54 34.643 13.574 4.246 1.00 1.56 H new ATOM 0 HD3 LYS A 54 35.476 12.109 3.765 1.00 1.56 H new ATOM 0 HE2 LYS A 54 33.610 11.463 2.309 1.00 1.86 H new ATOM 0 HE3 LYS A 54 32.649 12.815 2.875 1.00 1.86 H new ATOM 0 HZ1 LYS A 54 33.668 13.294 0.747 1.00 2.25 H new ATOM 0 HZ2 LYS A 54 34.288 14.337 1.935 1.00 2.25 H new ATOM 0 HZ3 LYS A 54 35.219 13.027 1.386 1.00 2.25 H new ATOM 885 N LEU A 55 32.704 7.349 4.688 1.00 0.98 N ATOM 886 CA LEU A 55 31.836 6.239 4.320 1.00 0.95 C ATOM 887 C LEU A 55 31.692 5.274 5.494 1.00 0.98 C ATOM 888 O LEU A 55 30.681 4.591 5.632 1.00 1.00 O ATOM 889 CB LEU A 55 32.405 5.508 3.097 1.00 0.93 C ATOM 890 CG LEU A 55 31.483 5.453 1.874 1.00 1.05 C ATOM 891 CD1 LEU A 55 30.174 4.749 2.212 1.00 1.34 C ATOM 892 CD2 LEU A 55 31.224 6.853 1.333 1.00 1.22 C ATOM 0 H LEU A 55 33.618 7.334 4.236 1.00 0.98 H new ATOM 0 HA LEU A 55 30.851 6.630 4.066 1.00 0.95 H new ATOM 0 HB2 LEU A 55 33.337 5.993 2.806 1.00 0.93 H new ATOM 0 HB3 LEU A 55 32.654 4.488 3.389 1.00 0.93 H new ATOM 0 HG LEU A 55 31.983 4.876 1.096 1.00 1.05 H new ATOM 0 HD11 LEU A 55 29.536 4.722 1.328 1.00 1.34 H new ATOM 0 HD12 LEU A 55 30.383 3.731 2.540 1.00 1.34 H new ATOM 0 HD13 LEU A 55 29.666 5.290 3.010 1.00 1.34 H new ATOM 0 HD21 LEU A 55 30.567 6.792 0.465 1.00 1.22 H new ATOM 0 HD22 LEU A 55 30.750 7.459 2.105 1.00 1.22 H new ATOM 0 HD23 LEU A 55 32.169 7.311 1.041 1.00 1.22 H new ATOM 904 N ASN A 56 32.713 5.245 6.344 1.00 1.04 N ATOM 905 CA ASN A 56 32.736 4.373 7.516 1.00 1.14 C ATOM 906 C ASN A 56 31.560 4.674 8.448 1.00 1.19 C ATOM 907 O ASN A 56 30.881 3.768 8.923 1.00 1.25 O ATOM 908 CB ASN A 56 34.063 4.547 8.264 1.00 1.25 C ATOM 909 CG ASN A 56 34.155 3.690 9.508 1.00 1.42 C ATOM 910 OD1 ASN A 56 33.733 2.536 9.516 1.00 1.48 O ATOM 911 ND2 ASN A 56 34.712 4.246 10.574 1.00 1.57 N ATOM 0 H ASN A 56 33.547 5.823 6.242 1.00 1.04 H new ATOM 0 HA ASN A 56 32.643 3.340 7.180 1.00 1.14 H new ATOM 0 HB2 ASN A 56 34.887 4.297 7.595 1.00 1.25 H new ATOM 0 HB3 ASN A 56 34.184 5.594 8.541 1.00 1.25 H new ATOM 0 HD21 ASN A 56 34.802 3.713 11.439 1.00 1.57 H new ATOM 0 HD22 ASN A 56 35.051 5.207 10.530 1.00 1.57 H new ATOM 918 N LYS A 57 31.326 5.953 8.694 1.00 1.20 N ATOM 919 CA LYS A 57 30.233 6.380 9.567 1.00 1.28 C ATOM 920 C LYS A 57 28.894 6.351 8.839 1.00 1.22 C ATOM 921 O LYS A 57 27.852 6.155 9.457 1.00 1.27 O ATOM 922 CB LYS A 57 30.499 7.763 10.167 1.00 1.39 C ATOM 923 CG LYS A 57 31.158 8.755 9.215 1.00 1.52 C ATOM 924 CD LYS A 57 31.572 10.030 9.936 1.00 1.63 C ATOM 925 CE LYS A 57 32.634 9.758 10.995 1.00 1.74 C ATOM 926 NZ LYS A 57 33.851 9.127 10.416 1.00 1.86 N ATOM 0 H LYS A 57 31.876 6.718 8.303 1.00 1.20 H new ATOM 0 HA LYS A 57 30.182 5.666 10.389 1.00 1.28 H new ATOM 0 HB2 LYS A 57 29.554 8.183 10.510 1.00 1.39 H new ATOM 0 HB3 LYS A 57 31.134 7.647 11.045 1.00 1.39 H new ATOM 0 HG2 LYS A 57 32.033 8.294 8.757 1.00 1.52 H new ATOM 0 HG3 LYS A 57 30.467 9.000 8.408 1.00 1.52 H new ATOM 0 HD2 LYS A 57 31.955 10.749 9.212 1.00 1.63 H new ATOM 0 HD3 LYS A 57 30.698 10.483 10.404 1.00 1.63 H new ATOM 0 HE2 LYS A 57 32.908 10.694 11.482 1.00 1.74 H new ATOM 0 HE3 LYS A 57 32.220 9.107 11.765 1.00 1.74 H new ATOM 0 HZ1 LYS A 57 33.923 8.144 10.747 1.00 1.86 H new ATOM 0 HZ2 LYS A 57 33.788 9.139 9.378 1.00 1.86 H new ATOM 0 HZ3 LYS A 57 34.694 9.657 10.718 1.00 1.86 H new ATOM 940 N LEU A 58 28.924 6.578 7.526 1.00 1.12 N ATOM 941 CA LEU A 58 27.702 6.572 6.714 1.00 1.10 C ATOM 942 C LEU A 58 27.053 5.188 6.730 1.00 1.08 C ATOM 943 O LEU A 58 25.862 5.060 7.000 1.00 1.11 O ATOM 944 CB LEU A 58 28.013 6.993 5.274 1.00 1.06 C ATOM 945 CG LEU A 58 27.373 8.311 4.814 1.00 1.22 C ATOM 946 CD1 LEU A 58 25.857 8.193 4.771 1.00 1.35 C ATOM 947 CD2 LEU A 58 27.792 9.470 5.710 1.00 1.39 C ATOM 0 H LEU A 58 29.777 6.768 7.001 1.00 1.12 H new ATOM 0 HA LEU A 58 27.003 7.289 7.144 1.00 1.10 H new ATOM 0 HB2 LEU A 58 29.094 7.078 5.165 1.00 1.06 H new ATOM 0 HB3 LEU A 58 27.686 6.198 4.604 1.00 1.06 H new ATOM 0 HG LEU A 58 27.731 8.517 3.805 1.00 1.22 H new ATOM 0 HD11 LEU A 58 25.428 9.139 4.442 1.00 1.35 H new ATOM 0 HD12 LEU A 58 25.573 7.404 4.074 1.00 1.35 H new ATOM 0 HD13 LEU A 58 25.483 7.951 5.766 1.00 1.35 H new ATOM 0 HD21 LEU A 58 27.323 10.389 5.359 1.00 1.39 H new ATOM 0 HD22 LEU A 58 27.477 9.270 6.734 1.00 1.39 H new ATOM 0 HD23 LEU A 58 28.876 9.581 5.678 1.00 1.39 H new ATOM 959 N ILE A 59 27.853 4.157 6.461 1.00 1.07 N ATOM 960 CA ILE A 59 27.350 2.785 6.449 1.00 1.12 C ATOM 961 C ILE A 59 26.922 2.364 7.856 1.00 1.22 C ATOM 962 O ILE A 59 25.934 1.654 8.027 1.00 1.28 O ATOM 963 CB ILE A 59 28.395 1.788 5.880 1.00 1.15 C ATOM 964 CG1 ILE A 59 27.769 0.404 5.703 1.00 1.28 C ATOM 965 CG2 ILE A 59 29.625 1.700 6.770 1.00 1.26 C ATOM 966 CD1 ILE A 59 26.957 0.265 4.436 1.00 1.39 C ATOM 0 H ILE A 59 28.847 4.245 6.250 1.00 1.07 H new ATOM 0 HA ILE A 59 26.483 2.760 5.789 1.00 1.12 H new ATOM 0 HB ILE A 59 28.714 2.161 4.907 1.00 1.15 H new ATOM 0 HG12 ILE A 59 28.560 -0.346 5.702 1.00 1.28 H new ATOM 0 HG13 ILE A 59 27.129 0.191 6.560 1.00 1.28 H new ATOM 0 HG21 ILE A 59 30.335 0.993 6.341 1.00 1.26 H new ATOM 0 HG22 ILE A 59 30.091 2.682 6.844 1.00 1.26 H new ATOM 0 HG23 ILE A 59 29.332 1.361 7.764 1.00 1.26 H new ATOM 0 HD11 ILE A 59 26.544 -0.742 4.377 1.00 1.39 H new ATOM 0 HD12 ILE A 59 26.144 0.991 4.443 1.00 1.39 H new ATOM 0 HD13 ILE A 59 27.597 0.445 3.572 1.00 1.39 H new ATOM 978 N GLU A 60 27.655 2.844 8.851 1.00 1.27 N ATOM 979 CA GLU A 60 27.372 2.542 10.250 1.00 1.41 C ATOM 980 C GLU A 60 26.016 3.117 10.652 1.00 1.39 C ATOM 981 O GLU A 60 25.289 2.538 11.460 1.00 1.49 O ATOM 982 CB GLU A 60 28.481 3.135 11.116 1.00 1.52 C ATOM 983 CG GLU A 60 28.430 2.734 12.574 1.00 1.73 C ATOM 984 CD GLU A 60 29.471 3.470 13.390 1.00 2.09 C ATOM 985 OE1 GLU A 60 29.183 4.590 13.854 1.00 2.28 O ATOM 986 OE2 GLU A 60 30.590 2.947 13.563 1.00 2.61 O ATOM 0 H GLU A 60 28.462 3.453 8.713 1.00 1.27 H new ATOM 0 HA GLU A 60 27.336 1.462 10.393 1.00 1.41 H new ATOM 0 HB2 GLU A 60 29.444 2.834 10.704 1.00 1.52 H new ATOM 0 HB3 GLU A 60 28.432 4.222 11.051 1.00 1.52 H new ATOM 0 HG2 GLU A 60 27.438 2.942 12.975 1.00 1.73 H new ATOM 0 HG3 GLU A 60 28.590 1.659 12.662 1.00 1.73 H new ATOM 993 N GLY A 61 25.682 4.255 10.059 1.00 1.30 N ATOM 994 CA GLY A 61 24.422 4.912 10.343 1.00 1.30 C ATOM 995 C GLY A 61 23.236 4.158 9.789 1.00 1.26 C ATOM 996 O GLY A 61 22.121 4.331 10.257 1.00 1.27 O ATOM 0 H GLY A 61 26.268 4.739 9.379 1.00 1.30 H new ATOM 0 HA2 GLY A 61 24.308 5.020 11.422 1.00 1.30 H new ATOM 0 HA3 GLY A 61 24.438 5.917 9.922 1.00 1.30 H new ATOM 1000 N TYR A 62 23.470 3.347 8.766 1.00 1.25 N ATOM 1001 CA TYR A 62 22.404 2.563 8.164 1.00 1.31 C ATOM 1002 C TYR A 62 21.996 1.418 9.083 1.00 1.43 C ATOM 1003 O TYR A 62 20.809 1.127 9.245 1.00 1.47 O ATOM 1004 CB TYR A 62 22.831 2.030 6.798 1.00 1.39 C ATOM 1005 CG TYR A 62 23.072 3.113 5.763 1.00 1.59 C ATOM 1006 CD1 TYR A 62 22.393 4.328 5.814 1.00 2.03 C ATOM 1007 CD2 TYR A 62 23.986 2.919 4.736 1.00 2.27 C ATOM 1008 CE1 TYR A 62 22.614 5.313 4.870 1.00 2.60 C ATOM 1009 CE2 TYR A 62 24.213 3.900 3.787 1.00 2.80 C ATOM 1010 CZ TYR A 62 23.526 5.096 3.860 1.00 2.80 C ATOM 1011 OH TYR A 62 23.748 6.073 2.916 1.00 3.54 O ATOM 0 H TYR A 62 24.386 3.216 8.338 1.00 1.25 H new ATOM 0 HA TYR A 62 21.541 3.213 8.022 1.00 1.31 H new ATOM 0 HB2 TYR A 62 23.743 1.445 6.916 1.00 1.39 H new ATOM 0 HB3 TYR A 62 22.063 1.351 6.427 1.00 1.39 H new ATOM 0 HD1 TYR A 62 21.680 4.504 6.606 1.00 2.03 H new ATOM 0 HD2 TYR A 62 24.529 1.987 4.677 1.00 2.27 H new ATOM 0 HE1 TYR A 62 22.075 6.247 4.924 1.00 2.60 H new ATOM 0 HE2 TYR A 62 24.925 3.731 2.992 1.00 2.80 H new ATOM 0 HH TYR A 62 24.421 5.762 2.275 1.00 3.54 H new ATOM 1021 N THR A 63 22.989 0.779 9.687 1.00 1.55 N ATOM 1022 CA THR A 63 22.753 -0.335 10.594 1.00 1.74 C ATOM 1023 C THR A 63 22.084 0.140 11.883 1.00 1.68 C ATOM 1024 O THR A 63 21.320 -0.594 12.504 1.00 1.81 O ATOM 1025 CB THR A 63 24.076 -1.037 10.931 1.00 1.96 C ATOM 1026 OG1 THR A 63 25.121 -0.474 10.129 1.00 2.00 O ATOM 1027 CG2 THR A 63 23.983 -2.538 10.679 1.00 2.37 C ATOM 0 H THR A 63 23.973 1.016 9.563 1.00 1.55 H new ATOM 0 HA THR A 63 22.087 -1.038 10.094 1.00 1.74 H new ATOM 0 HB THR A 63 24.292 -0.887 11.989 1.00 1.96 H new ATOM 0 HG1 THR A 63 25.970 -0.916 10.340 1.00 2.00 H new ATOM 0 HG21 THR A 63 24.935 -3.008 10.927 1.00 2.37 H new ATOM 0 HG22 THR A 63 23.195 -2.963 11.301 1.00 2.37 H new ATOM 0 HG23 THR A 63 23.752 -2.717 9.629 1.00 2.37 H new ATOM 1035 N TYR A 64 22.372 1.374 12.271 1.00 1.56 N ATOM 1036 CA TYR A 64 21.794 1.949 13.477 1.00 1.61 C ATOM 1037 C TYR A 64 20.889 3.117 13.116 1.00 1.32 C ATOM 1038 O TYR A 64 20.734 4.067 13.887 1.00 1.40 O ATOM 1039 CB TYR A 64 22.905 2.411 14.419 1.00 1.89 C ATOM 1040 CG TYR A 64 22.570 2.226 15.877 1.00 2.36 C ATOM 1041 CD1 TYR A 64 22.080 1.013 16.344 1.00 2.94 C ATOM 1042 CD2 TYR A 64 22.747 3.259 16.790 1.00 2.88 C ATOM 1043 CE1 TYR A 64 21.776 0.834 17.676 1.00 3.61 C ATOM 1044 CE2 TYR A 64 22.444 3.087 18.125 1.00 3.56 C ATOM 1045 CZ TYR A 64 21.959 1.874 18.562 1.00 3.79 C ATOM 1046 OH TYR A 64 21.656 1.695 19.892 1.00 4.61 O ATOM 0 H TYR A 64 23.003 1.997 11.767 1.00 1.56 H new ATOM 0 HA TYR A 64 21.198 1.189 13.983 1.00 1.61 H new ATOM 0 HB2 TYR A 64 23.817 1.860 14.191 1.00 1.89 H new ATOM 0 HB3 TYR A 64 23.114 3.464 14.233 1.00 1.89 H new ATOM 0 HD1 TYR A 64 21.935 0.197 15.652 1.00 2.94 H new ATOM 0 HD2 TYR A 64 23.127 4.211 16.449 1.00 2.88 H new ATOM 0 HE1 TYR A 64 21.397 -0.115 18.024 1.00 3.61 H new ATOM 0 HE2 TYR A 64 22.586 3.899 18.823 1.00 3.56 H new ATOM 0 HH TYR A 64 21.842 2.522 20.384 1.00 4.61 H new ATOM 1056 N GLY A 65 20.282 3.031 11.939 1.00 1.16 N ATOM 1057 CA GLY A 65 19.411 4.087 11.469 1.00 1.08 C ATOM 1058 C GLY A 65 18.013 3.993 12.026 1.00 1.03 C ATOM 1059 O GLY A 65 17.211 3.171 11.574 1.00 1.02 O ATOM 0 H GLY A 65 20.379 2.243 11.299 1.00 1.16 H new ATOM 0 HA2 GLY A 65 19.840 5.051 11.741 1.00 1.08 H new ATOM 0 HA3 GLY A 65 19.365 4.054 10.380 1.00 1.08 H new ATOM 1063 N GLU A 66 17.717 4.842 13.000 1.00 1.04 N ATOM 1064 CA GLU A 66 16.401 4.870 13.619 1.00 1.03 C ATOM 1065 C GLU A 66 15.354 5.278 12.590 1.00 0.98 C ATOM 1066 O GLU A 66 14.193 4.875 12.674 1.00 0.98 O ATOM 1067 CB GLU A 66 16.385 5.829 14.810 1.00 1.10 C ATOM 1068 CG GLU A 66 17.230 5.356 15.981 1.00 1.55 C ATOM 1069 CD GLU A 66 16.696 4.084 16.604 1.00 1.48 C ATOM 1070 OE1 GLU A 66 15.744 4.170 17.404 1.00 1.79 O ATOM 1071 OE2 GLU A 66 17.227 2.998 16.306 1.00 1.73 O ATOM 0 H GLU A 66 18.374 5.523 13.379 1.00 1.04 H new ATOM 0 HA GLU A 66 16.165 3.871 13.986 1.00 1.03 H new ATOM 0 HB2 GLU A 66 16.743 6.806 14.485 1.00 1.10 H new ATOM 0 HB3 GLU A 66 15.356 5.962 15.145 1.00 1.10 H new ATOM 0 HG2 GLU A 66 18.253 5.190 15.643 1.00 1.55 H new ATOM 0 HG3 GLU A 66 17.268 6.140 16.738 1.00 1.55 H new ATOM 1078 N GLU A 67 15.781 6.062 11.607 1.00 0.98 N ATOM 1079 CA GLU A 67 14.893 6.519 10.546 1.00 0.98 C ATOM 1080 C GLU A 67 14.392 5.329 9.734 1.00 0.95 C ATOM 1081 O GLU A 67 13.234 5.287 9.326 1.00 0.93 O ATOM 1082 CB GLU A 67 15.603 7.515 9.621 1.00 1.05 C ATOM 1083 CG GLU A 67 15.963 8.842 10.279 1.00 1.33 C ATOM 1084 CD GLU A 67 17.040 8.697 11.336 1.00 1.79 C ATOM 1085 OE1 GLU A 67 18.104 8.127 11.022 1.00 2.46 O ATOM 1086 OE2 GLU A 67 16.817 9.130 12.484 1.00 2.37 O ATOM 0 H GLU A 67 16.741 6.395 11.523 1.00 0.98 H new ATOM 0 HA GLU A 67 14.046 7.025 11.010 1.00 0.98 H new ATOM 0 HB2 GLU A 67 16.514 7.053 9.241 1.00 1.05 H new ATOM 0 HB3 GLU A 67 14.963 7.712 8.761 1.00 1.05 H new ATOM 0 HG2 GLU A 67 16.301 9.542 9.515 1.00 1.33 H new ATOM 0 HG3 GLU A 67 15.070 9.272 10.732 1.00 1.33 H new ATOM 1093 N ARG A 68 15.264 4.348 9.527 1.00 0.97 N ATOM 1094 CA ARG A 68 14.904 3.155 8.771 1.00 0.99 C ATOM 1095 C ARG A 68 13.855 2.367 9.541 1.00 0.96 C ATOM 1096 O ARG A 68 12.967 1.753 8.953 1.00 0.97 O ATOM 1097 CB ARG A 68 16.143 2.294 8.508 1.00 1.06 C ATOM 1098 CG ARG A 68 15.934 1.220 7.445 1.00 1.17 C ATOM 1099 CD ARG A 68 15.702 -0.152 8.065 1.00 1.27 C ATOM 1100 NE ARG A 68 14.603 -0.868 7.423 1.00 1.43 N ATOM 1101 CZ ARG A 68 13.669 -1.553 8.083 1.00 1.40 C ATOM 1102 NH1 ARG A 68 13.717 -1.656 9.411 1.00 1.41 N ATOM 1103 NH2 ARG A 68 12.693 -2.149 7.412 1.00 1.70 N ATOM 0 H ARG A 68 16.224 4.356 9.872 1.00 0.97 H new ATOM 0 HA ARG A 68 14.490 3.451 7.807 1.00 0.99 H new ATOM 0 HB2 ARG A 68 16.965 2.941 8.200 1.00 1.06 H new ATOM 0 HB3 ARG A 68 16.446 1.816 9.440 1.00 1.06 H new ATOM 0 HG2 ARG A 68 15.080 1.486 6.822 1.00 1.17 H new ATOM 0 HG3 ARG A 68 16.805 1.181 6.791 1.00 1.17 H new ATOM 0 HD2 ARG A 68 16.614 -0.744 7.986 1.00 1.27 H new ATOM 0 HD3 ARG A 68 15.487 -0.037 9.127 1.00 1.27 H new ATOM 0 HE ARG A 68 14.546 -0.842 6.405 1.00 1.43 H new ATOM 0 HH11 ARG A 68 14.472 -1.209 9.930 1.00 1.41 H new ATOM 0 HH12 ARG A 68 12.998 -2.182 9.908 1.00 1.41 H new ATOM 0 HH21 ARG A 68 12.659 -2.082 6.395 1.00 1.70 H new ATOM 0 HH22 ARG A 68 11.976 -2.674 7.913 1.00 1.70 H new ATOM 1117 N LYS A 69 13.969 2.398 10.864 1.00 0.95 N ATOM 1118 CA LYS A 69 13.025 1.712 11.737 1.00 0.97 C ATOM 1119 C LYS A 69 11.657 2.385 11.648 1.00 0.91 C ATOM 1120 O LYS A 69 10.615 1.727 11.705 1.00 0.92 O ATOM 1121 CB LYS A 69 13.542 1.734 13.180 1.00 1.04 C ATOM 1122 CG LYS A 69 12.594 1.108 14.189 1.00 1.31 C ATOM 1123 CD LYS A 69 13.071 1.340 15.616 1.00 1.43 C ATOM 1124 CE LYS A 69 12.775 2.757 16.088 1.00 1.48 C ATOM 1125 NZ LYS A 69 13.380 3.037 17.418 1.00 1.54 N ATOM 0 H LYS A 69 14.711 2.894 11.357 1.00 0.95 H new ATOM 0 HA LYS A 69 12.925 0.674 11.419 1.00 0.97 H new ATOM 0 HB2 LYS A 69 14.497 1.209 13.220 1.00 1.04 H new ATOM 0 HB3 LYS A 69 13.734 2.767 13.470 1.00 1.04 H new ATOM 0 HG2 LYS A 69 11.597 1.530 14.064 1.00 1.31 H new ATOM 0 HG3 LYS A 69 12.514 0.038 14.000 1.00 1.31 H new ATOM 0 HD2 LYS A 69 12.586 0.626 16.282 1.00 1.43 H new ATOM 0 HD3 LYS A 69 14.143 1.154 15.676 1.00 1.43 H new ATOM 0 HE2 LYS A 69 13.158 3.470 15.358 1.00 1.48 H new ATOM 0 HE3 LYS A 69 11.696 2.904 16.142 1.00 1.48 H new ATOM 0 HZ1 LYS A 69 13.032 3.951 17.772 1.00 1.54 H new ATOM 0 HZ2 LYS A 69 13.116 2.284 18.085 1.00 1.54 H new ATOM 0 HZ3 LYS A 69 14.415 3.072 17.328 1.00 1.54 H new ATOM 1139 N LEU A 70 11.671 3.703 11.498 1.00 0.90 N ATOM 1140 CA LEU A 70 10.445 4.478 11.384 1.00 0.88 C ATOM 1141 C LEU A 70 9.710 4.130 10.092 1.00 0.85 C ATOM 1142 O LEU A 70 8.491 3.965 10.086 1.00 0.85 O ATOM 1143 CB LEU A 70 10.758 5.975 11.427 1.00 0.93 C ATOM 1144 CG LEU A 70 9.556 6.903 11.232 1.00 1.01 C ATOM 1145 CD1 LEU A 70 8.686 6.918 12.479 1.00 1.14 C ATOM 1146 CD2 LEU A 70 10.022 8.306 10.887 1.00 1.15 C ATOM 0 H LEU A 70 12.524 4.260 11.452 1.00 0.90 H new ATOM 0 HA LEU A 70 9.800 4.230 12.227 1.00 0.88 H new ATOM 0 HB2 LEU A 70 11.221 6.205 12.387 1.00 0.93 H new ATOM 0 HB3 LEU A 70 11.496 6.197 10.656 1.00 0.93 H new ATOM 0 HG LEU A 70 8.957 6.526 10.403 1.00 1.01 H new ATOM 0 HD11 LEU A 70 7.837 7.583 12.322 1.00 1.14 H new ATOM 0 HD12 LEU A 70 8.325 5.910 12.683 1.00 1.14 H new ATOM 0 HD13 LEU A 70 9.272 7.272 13.327 1.00 1.14 H new ATOM 0 HD21 LEU A 70 9.156 8.954 10.751 1.00 1.15 H new ATOM 0 HD22 LEU A 70 10.642 8.693 11.696 1.00 1.15 H new ATOM 0 HD23 LEU A 70 10.603 8.280 9.965 1.00 1.15 H new ATOM 1158 N TYR A 71 10.461 4.006 9.002 1.00 0.84 N ATOM 1159 CA TYR A 71 9.875 3.665 7.706 1.00 0.86 C ATOM 1160 C TYR A 71 9.245 2.274 7.771 1.00 0.85 C ATOM 1161 O TYR A 71 8.193 2.026 7.180 1.00 0.85 O ATOM 1162 CB TYR A 71 10.938 3.716 6.601 1.00 0.91 C ATOM 1163 CG TYR A 71 11.677 5.036 6.513 1.00 0.92 C ATOM 1164 CD1 TYR A 71 11.021 6.245 6.724 1.00 0.94 C ATOM 1165 CD2 TYR A 71 13.036 5.069 6.221 1.00 0.99 C ATOM 1166 CE1 TYR A 71 11.700 7.447 6.648 1.00 1.01 C ATOM 1167 CE2 TYR A 71 13.721 6.266 6.144 1.00 1.05 C ATOM 1168 CZ TYR A 71 13.052 7.452 6.358 1.00 1.05 C ATOM 1169 OH TYR A 71 13.737 8.648 6.283 1.00 1.16 O ATOM 0 H TYR A 71 11.473 4.136 8.988 1.00 0.84 H new ATOM 0 HA TYR A 71 9.102 4.396 7.470 1.00 0.86 H new ATOM 0 HB2 TYR A 71 11.661 2.918 6.770 1.00 0.91 H new ATOM 0 HB3 TYR A 71 10.460 3.515 5.642 1.00 0.91 H new ATOM 0 HD1 TYR A 71 9.965 6.244 6.951 1.00 0.94 H new ATOM 0 HD2 TYR A 71 13.565 4.143 6.051 1.00 0.99 H new ATOM 0 HE1 TYR A 71 11.177 8.377 6.814 1.00 1.01 H new ATOM 0 HE2 TYR A 71 14.777 6.273 5.917 1.00 1.05 H new ATOM 0 HH TYR A 71 14.678 8.473 6.072 1.00 1.16 H new ATOM 1179 N ASP A 72 9.896 1.378 8.506 1.00 0.86 N ATOM 1180 CA ASP A 72 9.402 0.015 8.688 1.00 0.90 C ATOM 1181 C ASP A 72 8.068 0.044 9.422 1.00 0.87 C ATOM 1182 O ASP A 72 7.126 -0.661 9.061 1.00 0.87 O ATOM 1183 CB ASP A 72 10.414 -0.812 9.488 1.00 0.98 C ATOM 1184 CG ASP A 72 10.055 -2.286 9.561 1.00 1.21 C ATOM 1185 OD1 ASP A 72 9.164 -2.652 10.355 1.00 1.47 O ATOM 1186 OD2 ASP A 72 10.683 -3.088 8.834 1.00 1.48 O ATOM 0 H ASP A 72 10.773 1.572 8.989 1.00 0.86 H new ATOM 0 HA ASP A 72 9.266 -0.444 7.709 1.00 0.90 H new ATOM 0 HB2 ASP A 72 11.400 -0.706 9.035 1.00 0.98 H new ATOM 0 HB3 ASP A 72 10.484 -0.411 10.499 1.00 0.98 H new ATOM 1191 N SER A 73 7.997 0.897 10.438 1.00 0.85 N ATOM 1192 CA SER A 73 6.795 1.053 11.243 1.00 0.85 C ATOM 1193 C SER A 73 5.640 1.611 10.408 1.00 0.81 C ATOM 1194 O SER A 73 4.472 1.311 10.660 1.00 0.80 O ATOM 1195 CB SER A 73 7.087 1.969 12.432 1.00 0.90 C ATOM 1196 OG SER A 73 8.235 1.523 13.146 1.00 0.96 O ATOM 0 H SER A 73 8.770 1.498 10.725 1.00 0.85 H new ATOM 0 HA SER A 73 6.494 0.072 11.611 1.00 0.85 H new ATOM 0 HB2 SER A 73 7.246 2.989 12.081 1.00 0.90 H new ATOM 0 HB3 SER A 73 6.225 1.992 13.099 1.00 0.90 H new ATOM 0 HG SER A 73 9.040 1.710 12.620 1.00 0.96 H new ATOM 1202 N ALA A 74 5.969 2.419 9.406 1.00 0.80 N ATOM 1203 CA ALA A 74 4.957 2.999 8.535 1.00 0.79 C ATOM 1204 C ALA A 74 4.341 1.914 7.660 1.00 0.76 C ATOM 1205 O ALA A 74 3.152 1.955 7.341 1.00 0.75 O ATOM 1206 CB ALA A 74 5.553 4.109 7.680 1.00 0.82 C ATOM 0 H ALA A 74 6.927 2.686 9.178 1.00 0.80 H new ATOM 0 HA ALA A 74 4.173 3.437 9.152 1.00 0.79 H new ATOM 0 HB1 ALA A 74 4.779 4.528 7.037 1.00 0.82 H new ATOM 0 HB2 ALA A 74 5.951 4.892 8.326 1.00 0.82 H new ATOM 0 HB3 ALA A 74 6.356 3.703 7.064 1.00 0.82 H new ATOM 1212 N LEU A 75 5.155 0.925 7.298 1.00 0.77 N ATOM 1213 CA LEU A 75 4.694 -0.183 6.471 1.00 0.78 C ATOM 1214 C LEU A 75 3.782 -1.098 7.281 1.00 0.77 C ATOM 1215 O LEU A 75 2.829 -1.669 6.752 1.00 0.77 O ATOM 1216 CB LEU A 75 5.880 -0.977 5.917 1.00 0.83 C ATOM 1217 CG LEU A 75 5.929 -1.102 4.388 1.00 0.92 C ATOM 1218 CD1 LEU A 75 4.723 -1.871 3.866 1.00 1.13 C ATOM 1219 CD2 LEU A 75 6.009 0.274 3.741 1.00 1.15 C ATOM 0 H LEU A 75 6.138 0.870 7.566 1.00 0.77 H new ATOM 0 HA LEU A 75 4.132 0.226 5.631 1.00 0.78 H new ATOM 0 HB2 LEU A 75 6.802 -0.505 6.256 1.00 0.83 H new ATOM 0 HB3 LEU A 75 5.858 -1.979 6.346 1.00 0.83 H new ATOM 0 HG LEU A 75 6.827 -1.661 4.122 1.00 0.92 H new ATOM 0 HD11 LEU A 75 4.781 -1.946 2.780 1.00 1.13 H new ATOM 0 HD12 LEU A 75 4.714 -2.871 4.299 1.00 1.13 H new ATOM 0 HD13 LEU A 75 3.809 -1.347 4.145 1.00 1.13 H new ATOM 0 HD21 LEU A 75 6.043 0.165 2.657 1.00 1.15 H new ATOM 0 HD22 LEU A 75 5.132 0.859 4.020 1.00 1.15 H new ATOM 0 HD23 LEU A 75 6.909 0.785 4.083 1.00 1.15 H new ATOM 1231 N SER A 76 4.077 -1.234 8.574 1.00 0.78 N ATOM 1232 CA SER A 76 3.263 -2.064 9.453 1.00 0.80 C ATOM 1233 C SER A 76 1.861 -1.467 9.565 1.00 0.76 C ATOM 1234 O SER A 76 0.871 -2.188 9.724 1.00 0.77 O ATOM 1235 CB SER A 76 3.901 -2.170 10.840 1.00 0.85 C ATOM 1236 OG SER A 76 5.218 -1.644 10.845 1.00 0.88 O ATOM 0 H SER A 76 4.869 -0.782 9.031 1.00 0.78 H new ATOM 0 HA SER A 76 3.198 -3.066 9.029 1.00 0.80 H new ATOM 0 HB2 SER A 76 3.290 -1.632 11.565 1.00 0.85 H new ATOM 0 HB3 SER A 76 3.923 -3.214 11.153 1.00 0.85 H new ATOM 0 HG SER A 76 5.656 -1.866 11.693 1.00 0.88 H new ATOM 1242 N LYS A 77 1.786 -0.140 9.458 1.00 0.75 N ATOM 1243 CA LYS A 77 0.514 0.566 9.516 1.00 0.74 C ATOM 1244 C LYS A 77 -0.317 0.242 8.279 1.00 0.71 C ATOM 1245 O LYS A 77 -1.542 0.150 8.352 1.00 0.70 O ATOM 1246 CB LYS A 77 0.731 2.077 9.621 1.00 0.76 C ATOM 1247 CG LYS A 77 1.347 2.507 10.941 1.00 0.90 C ATOM 1248 CD LYS A 77 0.950 3.927 11.314 1.00 0.98 C ATOM 1249 CE LYS A 77 -0.521 4.014 11.708 1.00 1.35 C ATOM 1250 NZ LYS A 77 -0.840 5.277 12.424 1.00 1.61 N ATOM 0 H LYS A 77 2.597 0.466 9.330 1.00 0.75 H new ATOM 0 HA LYS A 77 -0.021 0.236 10.406 1.00 0.74 H new ATOM 0 HB2 LYS A 77 1.376 2.402 8.805 1.00 0.76 H new ATOM 0 HB3 LYS A 77 -0.225 2.584 9.492 1.00 0.76 H new ATOM 0 HG2 LYS A 77 1.032 1.823 11.729 1.00 0.90 H new ATOM 0 HG3 LYS A 77 2.433 2.439 10.875 1.00 0.90 H new ATOM 0 HD2 LYS A 77 1.570 4.273 12.141 1.00 0.98 H new ATOM 0 HD3 LYS A 77 1.142 4.592 10.472 1.00 0.98 H new ATOM 0 HE2 LYS A 77 -1.139 3.940 10.813 1.00 1.35 H new ATOM 0 HE3 LYS A 77 -0.776 3.165 12.343 1.00 1.35 H new ATOM 0 HZ1 LYS A 77 -1.850 5.290 12.671 1.00 1.61 H new ATOM 0 HZ2 LYS A 77 -0.270 5.337 13.292 1.00 1.61 H new ATOM 0 HZ3 LYS A 77 -0.623 6.088 11.810 1.00 1.61 H new ATOM 1264 N ILE A 78 0.367 0.058 7.150 1.00 0.71 N ATOM 1265 CA ILE A 78 -0.292 -0.286 5.896 1.00 0.71 C ATOM 1266 C ILE A 78 -0.937 -1.662 6.029 1.00 0.70 C ATOM 1267 O ILE A 78 -2.082 -1.876 5.615 1.00 0.69 O ATOM 1268 CB ILE A 78 0.706 -0.291 4.711 1.00 0.77 C ATOM 1269 CG1 ILE A 78 1.294 1.111 4.493 1.00 1.04 C ATOM 1270 CG2 ILE A 78 0.039 -0.800 3.437 1.00 0.84 C ATOM 1271 CD1 ILE A 78 0.311 2.115 3.923 1.00 1.33 C ATOM 0 H ILE A 78 1.381 0.142 7.081 1.00 0.71 H new ATOM 0 HA ILE A 78 -1.051 0.469 5.690 1.00 0.71 H new ATOM 0 HB ILE A 78 1.521 -0.971 4.959 1.00 0.77 H new ATOM 0 HG12 ILE A 78 1.670 1.487 5.444 1.00 1.04 H new ATOM 0 HG13 ILE A 78 2.149 1.034 3.821 1.00 1.04 H new ATOM 0 HG21 ILE A 78 0.761 -0.793 2.621 1.00 0.84 H new ATOM 0 HG22 ILE A 78 -0.320 -1.817 3.596 1.00 0.84 H new ATOM 0 HG23 ILE A 78 -0.801 -0.154 3.183 1.00 0.84 H new ATOM 0 HD11 ILE A 78 0.805 3.079 3.800 1.00 1.33 H new ATOM 0 HD12 ILE A 78 -0.047 1.764 2.955 1.00 1.33 H new ATOM 0 HD13 ILE A 78 -0.533 2.225 4.604 1.00 1.33 H new ATOM 1283 N GLU A 79 -0.193 -2.576 6.638 1.00 0.72 N ATOM 1284 CA GLU A 79 -0.658 -3.937 6.871 1.00 0.74 C ATOM 1285 C GLU A 79 -1.947 -3.923 7.693 1.00 0.73 C ATOM 1286 O GLU A 79 -2.894 -4.660 7.405 1.00 0.74 O ATOM 1287 CB GLU A 79 0.425 -4.737 7.604 1.00 0.79 C ATOM 1288 CG GLU A 79 -0.041 -6.094 8.118 1.00 1.00 C ATOM 1289 CD GLU A 79 0.130 -7.205 7.104 1.00 1.32 C ATOM 1290 OE1 GLU A 79 -0.506 -7.145 6.033 1.00 1.93 O ATOM 1291 OE2 GLU A 79 0.886 -8.155 7.387 1.00 1.95 O ATOM 0 H GLU A 79 0.749 -2.395 6.984 1.00 0.72 H new ATOM 0 HA GLU A 79 -0.863 -4.410 5.911 1.00 0.74 H new ATOM 0 HB2 GLU A 79 1.269 -4.886 6.931 1.00 0.79 H new ATOM 0 HB3 GLU A 79 0.789 -4.148 8.446 1.00 0.79 H new ATOM 0 HG2 GLU A 79 0.517 -6.345 9.020 1.00 1.00 H new ATOM 0 HG3 GLU A 79 -1.092 -6.027 8.401 1.00 1.00 H new ATOM 1298 N LYS A 80 -1.973 -3.067 8.712 1.00 0.72 N ATOM 1299 CA LYS A 80 -3.135 -2.940 9.578 1.00 0.73 C ATOM 1300 C LYS A 80 -4.353 -2.464 8.789 1.00 0.72 C ATOM 1301 O LYS A 80 -5.476 -2.912 9.025 1.00 0.75 O ATOM 1302 CB LYS A 80 -2.840 -1.962 10.716 1.00 0.74 C ATOM 1303 CG LYS A 80 -2.051 -2.574 11.867 1.00 0.81 C ATOM 1304 CD LYS A 80 -2.833 -2.531 13.173 1.00 0.96 C ATOM 1305 CE LYS A 80 -4.049 -3.441 13.127 1.00 1.35 C ATOM 1306 NZ LYS A 80 -3.703 -4.866 13.362 1.00 1.71 N ATOM 0 H LYS A 80 -1.198 -2.450 8.956 1.00 0.72 H new ATOM 0 HA LYS A 80 -3.356 -3.922 9.996 1.00 0.73 H new ATOM 0 HB2 LYS A 80 -2.284 -1.114 10.318 1.00 0.74 H new ATOM 0 HB3 LYS A 80 -3.783 -1.573 11.101 1.00 0.74 H new ATOM 0 HG2 LYS A 80 -1.800 -3.607 11.627 1.00 0.81 H new ATOM 0 HG3 LYS A 80 -1.110 -2.038 11.989 1.00 0.81 H new ATOM 0 HD2 LYS A 80 -2.184 -2.831 13.996 1.00 0.96 H new ATOM 0 HD3 LYS A 80 -3.151 -1.508 13.374 1.00 0.96 H new ATOM 0 HE2 LYS A 80 -4.770 -3.117 13.878 1.00 1.35 H new ATOM 0 HE3 LYS A 80 -4.535 -3.344 12.156 1.00 1.35 H new ATOM 0 HZ1 LYS A 80 -4.056 -5.444 12.573 1.00 1.71 H new ATOM 0 HZ2 LYS A 80 -2.670 -4.966 13.429 1.00 1.71 H new ATOM 0 HZ3 LYS A 80 -4.140 -5.188 14.249 1.00 1.71 H new ATOM 1320 N LEU A 81 -4.122 -1.547 7.857 1.00 0.69 N ATOM 1321 CA LEU A 81 -5.189 -1.009 7.023 1.00 0.71 C ATOM 1322 C LEU A 81 -5.786 -2.119 6.171 1.00 0.72 C ATOM 1323 O LEU A 81 -7.004 -2.233 6.044 1.00 0.76 O ATOM 1324 CB LEU A 81 -4.655 0.119 6.129 1.00 0.71 C ATOM 1325 CG LEU A 81 -5.501 1.399 6.106 1.00 0.78 C ATOM 1326 CD1 LEU A 81 -6.927 1.101 5.669 1.00 1.00 C ATOM 1327 CD2 LEU A 81 -5.485 2.078 7.466 1.00 0.94 C ATOM 0 H LEU A 81 -3.200 -1.159 7.659 1.00 0.69 H new ATOM 0 HA LEU A 81 -5.966 -0.598 7.667 1.00 0.71 H new ATOM 0 HB2 LEU A 81 -3.648 0.375 6.459 1.00 0.71 H new ATOM 0 HB3 LEU A 81 -4.570 -0.258 5.110 1.00 0.71 H new ATOM 0 HG LEU A 81 -5.062 2.081 5.378 1.00 0.78 H new ATOM 0 HD11 LEU A 81 -7.506 2.025 5.661 1.00 1.00 H new ATOM 0 HD12 LEU A 81 -6.918 0.670 4.668 1.00 1.00 H new ATOM 0 HD13 LEU A 81 -7.381 0.395 6.364 1.00 1.00 H new ATOM 0 HD21 LEU A 81 -6.091 2.983 7.428 1.00 0.94 H new ATOM 0 HD22 LEU A 81 -5.893 1.400 8.216 1.00 0.94 H new ATOM 0 HD23 LEU A 81 -4.460 2.338 7.731 1.00 0.94 H new ATOM 1339 N ILE A 82 -4.914 -2.942 5.600 1.00 0.72 N ATOM 1340 CA ILE A 82 -5.339 -4.061 4.772 1.00 0.76 C ATOM 1341 C ILE A 82 -6.187 -5.029 5.598 1.00 0.80 C ATOM 1342 O ILE A 82 -7.206 -5.536 5.128 1.00 0.84 O ATOM 1343 CB ILE A 82 -4.128 -4.812 4.161 1.00 0.75 C ATOM 1344 CG1 ILE A 82 -3.184 -3.823 3.460 1.00 0.74 C ATOM 1345 CG2 ILE A 82 -4.596 -5.886 3.181 1.00 0.80 C ATOM 1346 CD1 ILE A 82 -1.994 -4.477 2.779 1.00 0.77 C ATOM 0 H ILE A 82 -3.903 -2.853 5.697 1.00 0.72 H new ATOM 0 HA ILE A 82 -5.934 -3.661 3.951 1.00 0.76 H new ATOM 0 HB ILE A 82 -3.584 -5.300 4.970 1.00 0.75 H new ATOM 0 HG12 ILE A 82 -3.750 -3.261 2.717 1.00 0.74 H new ATOM 0 HG13 ILE A 82 -2.819 -3.104 4.193 1.00 0.74 H new ATOM 0 HG21 ILE A 82 -3.730 -6.400 2.764 1.00 0.80 H new ATOM 0 HG22 ILE A 82 -5.228 -6.604 3.703 1.00 0.80 H new ATOM 0 HG23 ILE A 82 -5.164 -5.421 2.375 1.00 0.80 H new ATOM 0 HD11 ILE A 82 -1.378 -3.711 2.308 1.00 0.77 H new ATOM 0 HD12 ILE A 82 -1.402 -5.015 3.519 1.00 0.77 H new ATOM 0 HD13 ILE A 82 -2.347 -5.175 2.020 1.00 0.77 H new ATOM 1358 N GLU A 83 -5.781 -5.243 6.850 1.00 0.80 N ATOM 1359 CA GLU A 83 -6.504 -6.136 7.750 1.00 0.86 C ATOM 1360 C GLU A 83 -7.847 -5.524 8.149 1.00 0.85 C ATOM 1361 O GLU A 83 -8.806 -6.235 8.434 1.00 0.90 O ATOM 1362 CB GLU A 83 -5.670 -6.424 8.999 1.00 0.90 C ATOM 1363 CG GLU A 83 -6.351 -7.366 9.982 1.00 1.24 C ATOM 1364 CD GLU A 83 -5.717 -7.330 11.357 1.00 1.70 C ATOM 1365 OE1 GLU A 83 -5.232 -6.256 11.765 1.00 2.18 O ATOM 1366 OE2 GLU A 83 -5.685 -8.378 12.031 1.00 2.36 O ATOM 0 H GLU A 83 -4.955 -4.809 7.262 1.00 0.80 H new ATOM 0 HA GLU A 83 -6.689 -7.073 7.225 1.00 0.86 H new ATOM 0 HB2 GLU A 83 -4.716 -6.855 8.697 1.00 0.90 H new ATOM 0 HB3 GLU A 83 -5.449 -5.483 9.503 1.00 0.90 H new ATOM 0 HG2 GLU A 83 -7.405 -7.099 10.065 1.00 1.24 H new ATOM 0 HG3 GLU A 83 -6.309 -8.383 9.593 1.00 1.24 H new ATOM 1373 N THR A 84 -7.910 -4.199 8.169 1.00 0.82 N ATOM 1374 CA THR A 84 -9.139 -3.500 8.516 1.00 0.84 C ATOM 1375 C THR A 84 -10.170 -3.680 7.402 1.00 0.89 C ATOM 1376 O THR A 84 -11.377 -3.719 7.647 1.00 0.92 O ATOM 1377 CB THR A 84 -8.881 -1.996 8.752 1.00 0.83 C ATOM 1378 OG1 THR A 84 -7.868 -1.828 9.755 1.00 0.84 O ATOM 1379 CG2 THR A 84 -10.152 -1.279 9.190 1.00 0.85 C ATOM 0 H THR A 84 -7.124 -3.587 7.949 1.00 0.82 H new ATOM 0 HA THR A 84 -9.522 -3.928 9.442 1.00 0.84 H new ATOM 0 HB THR A 84 -8.547 -1.560 7.811 1.00 0.83 H new ATOM 0 HG1 THR A 84 -7.009 -2.148 9.409 1.00 0.84 H new ATOM 0 HG21 THR A 84 -9.937 -0.222 9.348 1.00 0.85 H new ATOM 0 HG22 THR A 84 -10.913 -1.383 8.417 1.00 0.85 H new ATOM 0 HG23 THR A 84 -10.516 -1.718 10.119 1.00 0.85 H new ATOM 1387 N LEU A 85 -9.675 -3.806 6.177 1.00 0.93 N ATOM 1388 CA LEU A 85 -10.529 -3.993 5.018 1.00 1.01 C ATOM 1389 C LEU A 85 -11.016 -5.434 4.959 1.00 1.08 C ATOM 1390 O LEU A 85 -12.167 -5.704 4.617 1.00 1.17 O ATOM 1391 CB LEU A 85 -9.775 -3.643 3.732 1.00 1.04 C ATOM 1392 CG LEU A 85 -9.408 -2.167 3.570 1.00 1.05 C ATOM 1393 CD1 LEU A 85 -8.377 -1.993 2.466 1.00 1.22 C ATOM 1394 CD2 LEU A 85 -10.650 -1.339 3.274 1.00 1.13 C ATOM 0 H LEU A 85 -8.678 -3.781 5.963 1.00 0.93 H new ATOM 0 HA LEU A 85 -11.388 -3.328 5.109 1.00 1.01 H new ATOM 0 HB2 LEU A 85 -8.860 -4.234 3.695 1.00 1.04 H new ATOM 0 HB3 LEU A 85 -10.384 -3.944 2.880 1.00 1.04 H new ATOM 0 HG LEU A 85 -8.974 -1.815 4.506 1.00 1.05 H new ATOM 0 HD11 LEU A 85 -8.127 -0.937 2.364 1.00 1.22 H new ATOM 0 HD12 LEU A 85 -7.478 -2.556 2.716 1.00 1.22 H new ATOM 0 HD13 LEU A 85 -8.786 -2.361 1.525 1.00 1.22 H new ATOM 0 HD21 LEU A 85 -10.371 -0.291 3.162 1.00 1.13 H new ATOM 0 HD22 LEU A 85 -11.112 -1.692 2.352 1.00 1.13 H new ATOM 0 HD23 LEU A 85 -11.359 -1.439 4.096 1.00 1.13 H new ATOM 1406 N SER A 86 -10.128 -6.362 5.287 1.00 1.18 N ATOM 1407 CA SER A 86 -10.467 -7.771 5.275 1.00 1.31 C ATOM 1408 C SER A 86 -9.888 -8.475 6.502 1.00 1.73 C ATOM 1409 O SER A 86 -8.821 -9.084 6.432 1.00 2.31 O ATOM 1410 CB SER A 86 -9.951 -8.425 3.991 1.00 1.71 C ATOM 1411 OG SER A 86 -10.404 -7.716 2.843 1.00 1.97 O ATOM 0 H SER A 86 -9.167 -6.160 5.564 1.00 1.18 H new ATOM 0 HA SER A 86 -11.552 -7.867 5.307 1.00 1.31 H new ATOM 0 HB2 SER A 86 -8.861 -8.448 4.002 1.00 1.71 H new ATOM 0 HB3 SER A 86 -10.292 -9.459 3.943 1.00 1.71 H new ATOM 0 HG SER A 86 -10.061 -8.150 2.034 1.00 1.97 H new ATOM 1914 N LYS B 10 16.671 14.730 1.591 1.00 1.52 N ATOM 1915 CA LYS B 10 16.197 14.071 2.806 1.00 1.44 C ATOM 1916 C LYS B 10 14.829 14.598 3.229 1.00 1.38 C ATOM 1917 O LYS B 10 13.921 13.826 3.531 1.00 1.32 O ATOM 1918 CB LYS B 10 17.208 14.267 3.943 1.00 1.48 C ATOM 1919 CG LYS B 10 16.859 13.506 5.213 1.00 1.54 C ATOM 1920 CD LYS B 10 17.083 12.010 5.057 1.00 1.71 C ATOM 1921 CE LYS B 10 16.607 11.252 6.284 1.00 2.08 C ATOM 1922 NZ LYS B 10 17.014 9.824 6.258 1.00 2.41 N ATOM 0 HA LYS B 10 16.097 13.007 2.591 1.00 1.44 H new ATOM 0 HB2 LYS B 10 18.193 13.950 3.600 1.00 1.48 H new ATOM 0 HB3 LYS B 10 17.278 15.330 4.175 1.00 1.48 H new ATOM 0 HG2 LYS B 10 17.465 13.880 6.038 1.00 1.54 H new ATOM 0 HG3 LYS B 10 15.817 13.692 5.473 1.00 1.54 H new ATOM 0 HD2 LYS B 10 16.552 11.650 4.176 1.00 1.71 H new ATOM 0 HD3 LYS B 10 18.143 11.813 4.893 1.00 1.71 H new ATOM 0 HE2 LYS B 10 17.009 11.726 7.180 1.00 2.08 H new ATOM 0 HE3 LYS B 10 15.521 11.317 6.350 1.00 2.08 H new ATOM 0 HZ1 LYS B 10 16.667 9.348 7.115 1.00 2.41 H new ATOM 0 HZ2 LYS B 10 16.609 9.363 5.418 1.00 2.41 H new ATOM 0 HZ3 LYS B 10 18.051 9.759 6.222 1.00 2.41 H new ATOM 1936 N GLU B 11 14.695 15.914 3.241 1.00 1.42 N ATOM 1937 CA GLU B 11 13.448 16.557 3.626 1.00 1.39 C ATOM 1938 C GLU B 11 12.331 16.196 2.645 1.00 1.36 C ATOM 1939 O GLU B 11 11.194 15.942 3.043 1.00 1.30 O ATOM 1940 CB GLU B 11 13.657 18.069 3.661 1.00 1.47 C ATOM 1941 CG GLU B 11 12.433 18.856 4.087 1.00 1.48 C ATOM 1942 CD GLU B 11 12.240 20.102 3.255 1.00 1.62 C ATOM 1943 OE1 GLU B 11 11.667 20.004 2.149 1.00 1.90 O ATOM 1944 OE2 GLU B 11 12.666 21.189 3.694 1.00 1.72 O ATOM 0 H GLU B 11 15.440 16.563 2.987 1.00 1.42 H new ATOM 0 HA GLU B 11 13.152 16.207 4.615 1.00 1.39 H new ATOM 0 HB2 GLU B 11 14.476 18.296 4.343 1.00 1.47 H new ATOM 0 HB3 GLU B 11 13.965 18.405 2.671 1.00 1.47 H new ATOM 0 HG2 GLU B 11 11.549 18.224 4.003 1.00 1.48 H new ATOM 0 HG3 GLU B 11 12.528 19.133 5.137 1.00 1.48 H new ATOM 1951 N LEU B 12 12.675 16.144 1.366 1.00 1.43 N ATOM 1952 CA LEU B 12 11.711 15.833 0.318 1.00 1.45 C ATOM 1953 C LEU B 12 11.151 14.421 0.469 1.00 1.36 C ATOM 1954 O LEU B 12 9.936 14.226 0.445 1.00 1.32 O ATOM 1955 CB LEU B 12 12.361 15.994 -1.058 1.00 1.57 C ATOM 1956 CG LEU B 12 11.434 15.754 -2.252 1.00 1.73 C ATOM 1957 CD1 LEU B 12 10.382 16.853 -2.341 1.00 1.89 C ATOM 1958 CD2 LEU B 12 12.240 15.676 -3.543 1.00 1.89 C ATOM 0 H LEU B 12 13.622 16.314 1.027 1.00 1.43 H new ATOM 0 HA LEU B 12 10.881 16.533 0.412 1.00 1.45 H new ATOM 0 HB2 LEU B 12 12.769 17.002 -1.133 1.00 1.57 H new ATOM 0 HB3 LEU B 12 13.202 15.304 -1.127 1.00 1.57 H new ATOM 0 HG LEU B 12 10.923 14.802 -2.108 1.00 1.73 H new ATOM 0 HD11 LEU B 12 9.732 16.666 -3.196 1.00 1.89 H new ATOM 0 HD12 LEU B 12 9.787 16.862 -1.428 1.00 1.89 H new ATOM 0 HD13 LEU B 12 10.874 17.818 -2.463 1.00 1.89 H new ATOM 0 HD21 LEU B 12 11.566 15.505 -4.383 1.00 1.89 H new ATOM 0 HD22 LEU B 12 12.777 16.612 -3.694 1.00 1.89 H new ATOM 0 HD23 LEU B 12 12.954 14.855 -3.477 1.00 1.89 H new ATOM 1970 N LEU B 13 12.034 13.441 0.643 1.00 1.35 N ATOM 1971 CA LEU B 13 11.605 12.053 0.775 1.00 1.30 C ATOM 1972 C LEU B 13 10.804 11.848 2.058 1.00 1.18 C ATOM 1973 O LEU B 13 9.845 11.076 2.083 1.00 1.15 O ATOM 1974 CB LEU B 13 12.804 11.087 0.707 1.00 1.35 C ATOM 1975 CG LEU B 13 13.825 11.171 1.851 1.00 1.32 C ATOM 1976 CD1 LEU B 13 13.507 10.149 2.933 1.00 1.48 C ATOM 1977 CD2 LEU B 13 15.234 10.955 1.319 1.00 1.50 C ATOM 0 H LEU B 13 13.043 13.581 0.695 1.00 1.35 H new ATOM 0 HA LEU B 13 10.952 11.826 -0.068 1.00 1.30 H new ATOM 0 HB2 LEU B 13 12.418 10.068 0.670 1.00 1.35 H new ATOM 0 HB3 LEU B 13 13.330 11.263 -0.231 1.00 1.35 H new ATOM 0 HG LEU B 13 13.765 12.166 2.291 1.00 1.32 H new ATOM 0 HD11 LEU B 13 14.243 10.226 3.734 1.00 1.48 H new ATOM 0 HD12 LEU B 13 12.512 10.342 3.335 1.00 1.48 H new ATOM 0 HD13 LEU B 13 13.538 9.146 2.507 1.00 1.48 H new ATOM 0 HD21 LEU B 13 15.947 11.017 2.141 1.00 1.50 H new ATOM 0 HD22 LEU B 13 15.301 9.971 0.855 1.00 1.50 H new ATOM 0 HD23 LEU B 13 15.465 11.722 0.579 1.00 1.50 H new ATOM 1989 N LEU B 14 11.185 12.559 3.112 1.00 1.15 N ATOM 1990 CA LEU B 14 10.494 12.451 4.387 1.00 1.07 C ATOM 1991 C LEU B 14 9.067 12.972 4.259 1.00 1.07 C ATOM 1992 O LEU B 14 8.114 12.308 4.668 1.00 1.02 O ATOM 1993 CB LEU B 14 11.244 13.221 5.478 1.00 1.08 C ATOM 1994 CG LEU B 14 10.770 12.948 6.910 1.00 1.04 C ATOM 1995 CD1 LEU B 14 11.064 11.506 7.312 1.00 1.06 C ATOM 1996 CD2 LEU B 14 11.428 13.914 7.881 1.00 1.14 C ATOM 0 H LEU B 14 11.967 13.214 3.108 1.00 1.15 H new ATOM 0 HA LEU B 14 10.461 11.399 4.671 1.00 1.07 H new ATOM 0 HB2 LEU B 14 12.304 12.977 5.410 1.00 1.08 H new ATOM 0 HB3 LEU B 14 11.150 14.288 5.278 1.00 1.08 H new ATOM 0 HG LEU B 14 9.691 13.100 6.947 1.00 1.04 H new ATOM 0 HD11 LEU B 14 10.719 11.335 8.332 1.00 1.06 H new ATOM 0 HD12 LEU B 14 10.546 10.827 6.635 1.00 1.06 H new ATOM 0 HD13 LEU B 14 12.137 11.325 7.257 1.00 1.06 H new ATOM 0 HD21 LEU B 14 11.080 13.706 8.893 1.00 1.14 H new ATOM 0 HD22 LEU B 14 12.510 13.793 7.837 1.00 1.14 H new ATOM 0 HD23 LEU B 14 11.166 14.937 7.610 1.00 1.14 H new ATOM 2008 N LYS B 15 8.924 14.150 3.662 1.00 1.15 N ATOM 2009 CA LYS B 15 7.614 14.760 3.475 1.00 1.18 C ATOM 2010 C LYS B 15 6.767 13.943 2.501 1.00 1.13 C ATOM 2011 O LYS B 15 5.543 13.894 2.619 1.00 1.11 O ATOM 2012 CB LYS B 15 7.762 16.202 2.970 1.00 1.32 C ATOM 2013 CG LYS B 15 8.090 17.198 4.071 1.00 1.46 C ATOM 2014 CD LYS B 15 8.978 18.328 3.572 1.00 1.55 C ATOM 2015 CE LYS B 15 8.259 19.229 2.583 1.00 1.76 C ATOM 2016 NZ LYS B 15 9.028 20.476 2.310 1.00 1.80 N ATOM 0 H LYS B 15 9.701 14.702 3.299 1.00 1.15 H new ATOM 0 HA LYS B 15 7.107 14.776 4.440 1.00 1.18 H new ATOM 0 HB2 LYS B 15 8.547 16.236 2.215 1.00 1.32 H new ATOM 0 HB3 LYS B 15 6.836 16.504 2.481 1.00 1.32 H new ATOM 0 HG2 LYS B 15 7.165 17.614 4.471 1.00 1.46 H new ATOM 0 HG3 LYS B 15 8.588 16.681 4.891 1.00 1.46 H new ATOM 0 HD2 LYS B 15 9.319 18.922 4.420 1.00 1.55 H new ATOM 0 HD3 LYS B 15 9.866 17.908 3.099 1.00 1.55 H new ATOM 0 HE2 LYS B 15 8.099 18.689 1.650 1.00 1.76 H new ATOM 0 HE3 LYS B 15 7.275 19.487 2.975 1.00 1.76 H new ATOM 0 HZ1 LYS B 15 8.596 20.983 1.511 1.00 1.80 H new ATOM 0 HZ2 LYS B 15 9.015 21.084 3.154 1.00 1.80 H new ATOM 0 HZ3 LYS B 15 10.011 20.233 2.074 1.00 1.80 H new ATOM 2030 N LYS B 16 7.429 13.301 1.548 1.00 1.14 N ATOM 2031 CA LYS B 16 6.746 12.485 0.556 1.00 1.14 C ATOM 2032 C LYS B 16 6.107 11.252 1.189 1.00 1.03 C ATOM 2033 O LYS B 16 4.935 10.963 0.951 1.00 1.01 O ATOM 2034 CB LYS B 16 7.726 12.055 -0.534 1.00 1.22 C ATOM 2035 CG LYS B 16 7.567 12.821 -1.836 1.00 1.31 C ATOM 2036 CD LYS B 16 6.478 12.219 -2.711 1.00 1.30 C ATOM 2037 CE LYS B 16 6.262 13.038 -3.974 1.00 1.45 C ATOM 2038 NZ LYS B 16 5.576 12.259 -5.036 1.00 1.65 N ATOM 0 H LYS B 16 8.443 13.331 1.442 1.00 1.14 H new ATOM 0 HA LYS B 16 5.953 13.090 0.117 1.00 1.14 H new ATOM 0 HB2 LYS B 16 8.744 12.187 -0.167 1.00 1.22 H new ATOM 0 HB3 LYS B 16 7.593 10.991 -0.730 1.00 1.22 H new ATOM 0 HG2 LYS B 16 7.326 13.862 -1.619 1.00 1.31 H new ATOM 0 HG3 LYS B 16 8.513 12.819 -2.378 1.00 1.31 H new ATOM 0 HD2 LYS B 16 6.749 11.198 -2.980 1.00 1.30 H new ATOM 0 HD3 LYS B 16 5.546 12.164 -2.148 1.00 1.30 H new ATOM 0 HE2 LYS B 16 5.671 13.922 -3.735 1.00 1.45 H new ATOM 0 HE3 LYS B 16 7.224 13.389 -4.347 1.00 1.45 H new ATOM 0 HZ1 LYS B 16 5.450 12.856 -5.878 1.00 1.65 H new ATOM 0 HZ2 LYS B 16 6.151 11.429 -5.284 1.00 1.65 H new ATOM 0 HZ3 LYS B 16 4.646 11.946 -4.691 1.00 1.65 H new ATOM 2052 N ILE B 17 6.871 10.537 2.008 1.00 0.98 N ATOM 2053 CA ILE B 17 6.370 9.326 2.650 1.00 0.92 C ATOM 2054 C ILE B 17 5.409 9.657 3.786 1.00 0.89 C ATOM 2055 O ILE B 17 4.455 8.916 4.033 1.00 0.86 O ATOM 2056 CB ILE B 17 7.535 8.451 3.159 1.00 0.94 C ATOM 2057 CG1 ILE B 17 8.470 8.127 1.990 1.00 1.00 C ATOM 2058 CG2 ILE B 17 7.014 7.177 3.806 1.00 1.00 C ATOM 2059 CD1 ILE B 17 9.469 7.029 2.270 1.00 0.96 C ATOM 0 H ILE B 17 7.835 10.773 2.243 1.00 0.98 H new ATOM 0 HA ILE B 17 5.818 8.759 1.900 1.00 0.92 H new ATOM 0 HB ILE B 17 8.090 9.000 3.920 1.00 0.94 H new ATOM 0 HG12 ILE B 17 7.867 7.841 1.128 1.00 1.00 H new ATOM 0 HG13 ILE B 17 9.012 9.032 1.714 1.00 1.00 H new ATOM 0 HG21 ILE B 17 7.854 6.577 4.157 1.00 1.00 H new ATOM 0 HG22 ILE B 17 6.374 7.433 4.650 1.00 1.00 H new ATOM 0 HG23 ILE B 17 6.441 6.606 3.076 1.00 1.00 H new ATOM 0 HD11 ILE B 17 10.089 6.867 1.388 1.00 0.96 H new ATOM 0 HD12 ILE B 17 10.101 7.318 3.110 1.00 0.96 H new ATOM 0 HD13 ILE B 17 8.939 6.109 2.515 1.00 0.96 H new ATOM 2071 N ASP B 18 5.640 10.774 4.470 1.00 0.94 N ATOM 2072 CA ASP B 18 4.761 11.175 5.569 1.00 0.99 C ATOM 2073 C ASP B 18 3.353 11.444 5.050 1.00 0.96 C ATOM 2074 O ASP B 18 2.371 10.931 5.584 1.00 0.94 O ATOM 2075 CB ASP B 18 5.297 12.414 6.281 1.00 1.14 C ATOM 2076 CG ASP B 18 4.501 12.753 7.529 1.00 1.29 C ATOM 2077 OD1 ASP B 18 4.537 11.966 8.498 1.00 1.88 O ATOM 2078 OD2 ASP B 18 3.847 13.819 7.554 1.00 1.59 O ATOM 0 H ASP B 18 6.416 11.411 4.288 1.00 0.94 H new ATOM 0 HA ASP B 18 4.728 10.355 6.286 1.00 0.99 H new ATOM 0 HB2 ASP B 18 6.340 12.252 6.552 1.00 1.14 H new ATOM 0 HB3 ASP B 18 5.273 13.262 5.597 1.00 1.14 H new ATOM 2083 N SER B 19 3.262 12.242 3.995 1.00 0.98 N ATOM 2084 CA SER B 19 1.980 12.564 3.385 1.00 0.99 C ATOM 2085 C SER B 19 1.352 11.316 2.771 1.00 0.91 C ATOM 2086 O SER B 19 0.129 11.203 2.691 1.00 0.90 O ATOM 2087 CB SER B 19 2.158 13.630 2.312 1.00 1.10 C ATOM 2088 OG SER B 19 2.653 14.843 2.865 1.00 1.21 O ATOM 0 H SER B 19 4.065 12.680 3.542 1.00 0.98 H new ATOM 0 HA SER B 19 1.318 12.947 4.162 1.00 0.99 H new ATOM 0 HB2 SER B 19 2.847 13.269 1.548 1.00 1.10 H new ATOM 0 HB3 SER B 19 1.204 13.815 1.819 1.00 1.10 H new ATOM 0 HG SER B 19 3.632 14.814 2.893 1.00 1.21 H new ATOM 2094 N LEU B 20 2.201 10.394 2.340 1.00 0.87 N ATOM 2095 CA LEU B 20 1.755 9.157 1.718 1.00 0.84 C ATOM 2096 C LEU B 20 0.872 8.343 2.664 1.00 0.80 C ATOM 2097 O LEU B 20 -0.256 7.993 2.321 1.00 0.79 O ATOM 2098 CB LEU B 20 2.980 8.346 1.298 1.00 0.86 C ATOM 2099 CG LEU B 20 2.709 7.130 0.421 1.00 0.91 C ATOM 2100 CD1 LEU B 20 2.418 7.571 -1.006 1.00 1.07 C ATOM 2101 CD2 LEU B 20 3.904 6.194 0.473 1.00 1.35 C ATOM 0 H LEU B 20 3.215 10.482 2.412 1.00 0.87 H new ATOM 0 HA LEU B 20 1.153 9.399 0.842 1.00 0.84 H new ATOM 0 HB2 LEU B 20 3.664 9.007 0.766 1.00 0.86 H new ATOM 0 HB3 LEU B 20 3.496 8.012 2.198 1.00 0.86 H new ATOM 0 HG LEU B 20 1.834 6.596 0.792 1.00 0.91 H new ATOM 0 HD11 LEU B 20 2.226 6.695 -1.625 1.00 1.07 H new ATOM 0 HD12 LEU B 20 1.543 8.221 -1.015 1.00 1.07 H new ATOM 0 HD13 LEU B 20 3.277 8.113 -1.401 1.00 1.07 H new ATOM 0 HD21 LEU B 20 3.712 5.323 -0.154 1.00 1.35 H new ATOM 0 HD22 LEU B 20 4.790 6.715 0.109 1.00 1.35 H new ATOM 0 HD23 LEU B 20 4.069 5.871 1.501 1.00 1.35 H new ATOM 2113 N ILE B 21 1.366 8.083 3.869 1.00 0.81 N ATOM 2114 CA ILE B 21 0.596 7.310 4.846 1.00 0.82 C ATOM 2115 C ILE B 21 -0.596 8.113 5.356 1.00 0.81 C ATOM 2116 O ILE B 21 -1.631 7.552 5.719 1.00 0.81 O ATOM 2117 CB ILE B 21 1.457 6.843 6.039 1.00 0.88 C ATOM 2118 CG1 ILE B 21 2.307 7.991 6.587 1.00 1.19 C ATOM 2119 CG2 ILE B 21 2.343 5.678 5.624 1.00 1.21 C ATOM 2120 CD1 ILE B 21 3.031 7.656 7.874 1.00 1.38 C ATOM 0 H ILE B 21 2.283 8.390 4.193 1.00 0.81 H new ATOM 0 HA ILE B 21 0.239 6.421 4.326 1.00 0.82 H new ATOM 0 HB ILE B 21 0.787 6.512 6.833 1.00 0.88 H new ATOM 0 HG12 ILE B 21 3.040 8.280 5.834 1.00 1.19 H new ATOM 0 HG13 ILE B 21 1.666 8.856 6.756 1.00 1.19 H new ATOM 0 HG21 ILE B 21 2.945 5.358 6.474 1.00 1.21 H new ATOM 0 HG22 ILE B 21 1.720 4.849 5.288 1.00 1.21 H new ATOM 0 HG23 ILE B 21 2.999 5.991 4.812 1.00 1.21 H new ATOM 0 HD11 ILE B 21 3.612 8.519 8.200 1.00 1.38 H new ATOM 0 HD12 ILE B 21 2.304 7.397 8.644 1.00 1.38 H new ATOM 0 HD13 ILE B 21 3.699 6.811 7.706 1.00 1.38 H new ATOM 2132 N GLU B 22 -0.444 9.429 5.367 1.00 0.83 N ATOM 2133 CA GLU B 22 -1.498 10.325 5.812 1.00 0.86 C ATOM 2134 C GLU B 22 -2.695 10.242 4.867 1.00 0.83 C ATOM 2135 O GLU B 22 -3.850 10.316 5.290 1.00 0.84 O ATOM 2136 CB GLU B 22 -0.948 11.750 5.869 1.00 0.94 C ATOM 2137 CG GLU B 22 -1.890 12.758 6.488 1.00 1.11 C ATOM 2138 CD GLU B 22 -1.252 14.123 6.617 1.00 1.55 C ATOM 2139 OE1 GLU B 22 -0.555 14.368 7.621 1.00 1.98 O ATOM 2140 OE2 GLU B 22 -1.443 14.961 5.713 1.00 1.95 O ATOM 0 H GLU B 22 0.409 9.903 5.069 1.00 0.83 H new ATOM 0 HA GLU B 22 -1.836 10.032 6.806 1.00 0.86 H new ATOM 0 HB2 GLU B 22 -0.017 11.745 6.436 1.00 0.94 H new ATOM 0 HB3 GLU B 22 -0.703 12.073 4.857 1.00 0.94 H new ATOM 0 HG2 GLU B 22 -2.791 12.835 5.879 1.00 1.11 H new ATOM 0 HG3 GLU B 22 -2.200 12.408 7.473 1.00 1.11 H new ATOM 2147 N ALA B 23 -2.401 10.070 3.584 1.00 0.82 N ATOM 2148 CA ALA B 23 -3.434 9.961 2.565 1.00 0.83 C ATOM 2149 C ALA B 23 -4.220 8.665 2.736 1.00 0.79 C ATOM 2150 O ALA B 23 -5.449 8.663 2.667 1.00 0.80 O ATOM 2151 CB ALA B 23 -2.822 10.031 1.177 1.00 0.86 C ATOM 0 H ALA B 23 -1.449 10.003 3.224 1.00 0.82 H new ATOM 0 HA ALA B 23 -4.121 10.799 2.682 1.00 0.83 H new ATOM 0 HB1 ALA B 23 -3.609 9.948 0.428 1.00 0.86 H new ATOM 0 HB2 ALA B 23 -2.304 10.982 1.055 1.00 0.86 H new ATOM 0 HB3 ALA B 23 -2.113 9.213 1.050 1.00 0.86 H new ATOM 2157 N ILE B 24 -3.501 7.567 2.969 1.00 0.78 N ATOM 2158 CA ILE B 24 -4.134 6.265 3.165 1.00 0.78 C ATOM 2159 C ILE B 24 -5.047 6.300 4.393 1.00 0.74 C ATOM 2160 O ILE B 24 -6.168 5.784 4.370 1.00 0.74 O ATOM 2161 CB ILE B 24 -3.077 5.130 3.310 1.00 0.83 C ATOM 2162 CG1 ILE B 24 -2.634 4.633 1.933 1.00 0.99 C ATOM 2163 CG2 ILE B 24 -3.619 3.971 4.134 1.00 1.03 C ATOM 2164 CD1 ILE B 24 -1.337 5.243 1.445 1.00 0.89 C ATOM 0 H ILE B 24 -2.483 7.554 3.026 1.00 0.78 H new ATOM 0 HA ILE B 24 -4.733 6.049 2.280 1.00 0.78 H new ATOM 0 HB ILE B 24 -2.215 5.544 3.833 1.00 0.83 H new ATOM 0 HG12 ILE B 24 -2.523 3.549 1.968 1.00 0.99 H new ATOM 0 HG13 ILE B 24 -3.420 4.850 1.210 1.00 0.99 H new ATOM 0 HG21 ILE B 24 -2.857 3.196 4.216 1.00 1.03 H new ATOM 0 HG22 ILE B 24 -3.885 4.326 5.130 1.00 1.03 H new ATOM 0 HG23 ILE B 24 -4.503 3.560 3.647 1.00 1.03 H new ATOM 0 HD11 ILE B 24 -1.092 4.839 0.463 1.00 0.89 H new ATOM 0 HD12 ILE B 24 -1.447 6.325 1.375 1.00 0.89 H new ATOM 0 HD13 ILE B 24 -0.537 5.004 2.145 1.00 0.89 H new ATOM 2176 N LYS B 25 -4.561 6.936 5.454 1.00 0.74 N ATOM 2177 CA LYS B 25 -5.315 7.066 6.694 1.00 0.75 C ATOM 2178 C LYS B 25 -6.613 7.839 6.458 1.00 0.78 C ATOM 2179 O LYS B 25 -7.656 7.522 7.032 1.00 0.80 O ATOM 2180 CB LYS B 25 -4.457 7.775 7.748 1.00 0.79 C ATOM 2181 CG LYS B 25 -5.215 8.169 9.007 1.00 0.88 C ATOM 2182 CD LYS B 25 -5.676 6.954 9.798 1.00 1.17 C ATOM 2183 CE LYS B 25 -6.471 7.357 11.026 1.00 1.48 C ATOM 2184 NZ LYS B 25 -5.669 8.192 11.958 1.00 1.72 N ATOM 0 H LYS B 25 -3.640 7.373 5.478 1.00 0.74 H new ATOM 0 HA LYS B 25 -5.574 6.070 7.054 1.00 0.75 H new ATOM 0 HB2 LYS B 25 -3.629 7.122 8.025 1.00 0.79 H new ATOM 0 HB3 LYS B 25 -4.022 8.670 7.304 1.00 0.79 H new ATOM 0 HG2 LYS B 25 -4.576 8.790 9.635 1.00 0.88 H new ATOM 0 HG3 LYS B 25 -6.080 8.774 8.735 1.00 0.88 H new ATOM 0 HD2 LYS B 25 -6.288 6.315 9.161 1.00 1.17 H new ATOM 0 HD3 LYS B 25 -4.810 6.366 10.101 1.00 1.17 H new ATOM 0 HE2 LYS B 25 -7.359 7.908 10.718 1.00 1.48 H new ATOM 0 HE3 LYS B 25 -6.815 6.462 11.545 1.00 1.48 H new ATOM 0 HZ1 LYS B 25 -6.161 8.262 12.872 1.00 1.72 H new ATOM 0 HZ2 LYS B 25 -4.736 7.756 12.100 1.00 1.72 H new ATOM 0 HZ3 LYS B 25 -5.549 9.143 11.556 1.00 1.72 H new ATOM 2198 N LYS B 26 -6.541 8.855 5.608 1.00 0.80 N ATOM 2199 CA LYS B 26 -7.707 9.665 5.293 1.00 0.85 C ATOM 2200 C LYS B 26 -8.688 8.902 4.408 1.00 0.83 C ATOM 2201 O LYS B 26 -9.895 9.006 4.593 1.00 0.86 O ATOM 2202 CB LYS B 26 -7.286 10.967 4.610 1.00 0.91 C ATOM 2203 CG LYS B 26 -7.215 12.160 5.547 1.00 1.01 C ATOM 2204 CD LYS B 26 -8.584 12.796 5.757 1.00 1.13 C ATOM 2205 CE LYS B 26 -9.250 12.305 7.032 1.00 1.38 C ATOM 2206 NZ LYS B 26 -10.574 12.943 7.246 1.00 1.39 N ATOM 0 H LYS B 26 -5.688 9.136 5.125 1.00 0.80 H new ATOM 0 HA LYS B 26 -8.209 9.903 6.231 1.00 0.85 H new ATOM 0 HB2 LYS B 26 -6.310 10.823 4.147 1.00 0.91 H new ATOM 0 HB3 LYS B 26 -7.990 11.189 3.808 1.00 0.91 H new ATOM 0 HG2 LYS B 26 -6.810 11.844 6.508 1.00 1.01 H new ATOM 0 HG3 LYS B 26 -6.528 12.902 5.140 1.00 1.01 H new ATOM 0 HD2 LYS B 26 -8.478 13.880 5.798 1.00 1.13 H new ATOM 0 HD3 LYS B 26 -9.224 12.570 4.904 1.00 1.13 H new ATOM 0 HE2 LYS B 26 -9.372 11.223 6.984 1.00 1.38 H new ATOM 0 HE3 LYS B 26 -8.603 12.516 7.884 1.00 1.38 H new ATOM 0 HZ1 LYS B 26 -10.765 13.012 8.266 1.00 1.39 H new ATOM 0 HZ2 LYS B 26 -10.572 13.896 6.829 1.00 1.39 H new ATOM 0 HZ3 LYS B 26 -11.313 12.369 6.793 1.00 1.39 H new ATOM 2220 N ILE B 27 -8.165 8.131 3.459 1.00 0.80 N ATOM 2221 CA ILE B 27 -9.002 7.354 2.540 1.00 0.81 C ATOM 2222 C ILE B 27 -10.003 6.470 3.295 1.00 0.80 C ATOM 2223 O ILE B 27 -11.211 6.545 3.060 1.00 0.82 O ATOM 2224 CB ILE B 27 -8.135 6.480 1.595 1.00 0.81 C ATOM 2225 CG1 ILE B 27 -7.604 7.317 0.425 1.00 0.79 C ATOM 2226 CG2 ILE B 27 -8.908 5.271 1.073 1.00 0.90 C ATOM 2227 CD1 ILE B 27 -8.653 7.663 -0.618 1.00 1.04 C ATOM 0 H ILE B 27 -7.163 8.025 3.303 1.00 0.80 H new ATOM 0 HA ILE B 27 -9.563 8.071 1.940 1.00 0.81 H new ATOM 0 HB ILE B 27 -7.292 6.108 2.177 1.00 0.81 H new ATOM 0 HG12 ILE B 27 -7.179 8.241 0.817 1.00 0.79 H new ATOM 0 HG13 ILE B 27 -6.793 6.773 -0.058 1.00 0.79 H new ATOM 0 HG21 ILE B 27 -8.266 4.685 0.415 1.00 0.90 H new ATOM 0 HG22 ILE B 27 -9.228 4.654 1.912 1.00 0.90 H new ATOM 0 HG23 ILE B 27 -9.783 5.610 0.518 1.00 0.90 H new ATOM 0 HD11 ILE B 27 -8.196 8.256 -1.411 1.00 1.04 H new ATOM 0 HD12 ILE B 27 -9.062 6.745 -1.041 1.00 1.04 H new ATOM 0 HD13 ILE B 27 -9.454 8.237 -0.152 1.00 1.04 H new ATOM 2239 N ILE B 28 -9.500 5.655 4.218 1.00 0.78 N ATOM 2240 CA ILE B 28 -10.352 4.746 4.984 1.00 0.78 C ATOM 2241 C ILE B 28 -11.335 5.503 5.877 1.00 0.81 C ATOM 2242 O ILE B 28 -12.475 5.073 6.058 1.00 0.84 O ATOM 2243 CB ILE B 28 -9.513 3.759 5.836 1.00 0.77 C ATOM 2244 CG1 ILE B 28 -10.413 2.717 6.505 1.00 0.80 C ATOM 2245 CG2 ILE B 28 -8.682 4.496 6.878 1.00 0.82 C ATOM 2246 CD1 ILE B 28 -10.960 1.687 5.540 1.00 0.97 C ATOM 0 H ILE B 28 -8.509 5.604 4.454 1.00 0.78 H new ATOM 0 HA ILE B 28 -10.926 4.173 4.256 1.00 0.78 H new ATOM 0 HB ILE B 28 -8.828 3.242 5.164 1.00 0.77 H new ATOM 0 HG12 ILE B 28 -9.849 2.208 7.286 1.00 0.80 H new ATOM 0 HG13 ILE B 28 -11.245 3.225 6.992 1.00 0.80 H new ATOM 0 HG21 ILE B 28 -8.105 3.776 7.459 1.00 0.82 H new ATOM 0 HG22 ILE B 28 -8.003 5.187 6.379 1.00 0.82 H new ATOM 0 HG23 ILE B 28 -9.342 5.053 7.543 1.00 0.82 H new ATOM 0 HD11 ILE B 28 -11.589 0.980 6.081 1.00 0.97 H new ATOM 0 HD12 ILE B 28 -11.552 2.186 4.772 1.00 0.97 H new ATOM 0 HD13 ILE B 28 -10.134 1.153 5.071 1.00 0.97 H new ATOM 2258 N ALA B 29 -10.901 6.636 6.409 1.00 0.82 N ATOM 2259 CA ALA B 29 -11.737 7.440 7.288 1.00 0.87 C ATOM 2260 C ALA B 29 -12.915 8.044 6.529 1.00 0.90 C ATOM 2261 O ALA B 29 -14.048 8.037 7.014 1.00 0.93 O ATOM 2262 CB ALA B 29 -10.909 8.532 7.941 1.00 0.90 C ATOM 0 H ALA B 29 -9.970 7.021 6.246 1.00 0.82 H new ATOM 0 HA ALA B 29 -12.139 6.789 8.064 1.00 0.87 H new ATOM 0 HB1 ALA B 29 -11.544 9.128 8.597 1.00 0.90 H new ATOM 0 HB2 ALA B 29 -10.107 8.080 8.525 1.00 0.90 H new ATOM 0 HB3 ALA B 29 -10.480 9.173 7.171 1.00 0.90 H new ATOM 2268 N GLU B 30 -12.641 8.555 5.334 1.00 0.91 N ATOM 2269 CA GLU B 30 -13.674 9.162 4.505 1.00 0.95 C ATOM 2270 C GLU B 30 -14.724 8.134 4.116 1.00 0.95 C ATOM 2271 O GLU B 30 -15.914 8.439 4.094 1.00 0.96 O ATOM 2272 CB GLU B 30 -13.071 9.782 3.241 1.00 1.00 C ATOM 2273 CG GLU B 30 -12.033 10.859 3.516 1.00 1.02 C ATOM 2274 CD GLU B 30 -12.585 12.038 4.292 1.00 1.13 C ATOM 2275 OE1 GLU B 30 -13.148 12.959 3.663 1.00 1.38 O ATOM 2276 OE2 GLU B 30 -12.440 12.056 5.536 1.00 1.18 O ATOM 0 H GLU B 30 -11.710 8.561 4.918 1.00 0.91 H new ATOM 0 HA GLU B 30 -14.146 9.950 5.092 1.00 0.95 H new ATOM 0 HB2 GLU B 30 -12.612 8.993 2.645 1.00 1.00 H new ATOM 0 HB3 GLU B 30 -13.873 10.210 2.640 1.00 1.00 H new ATOM 0 HG2 GLU B 30 -11.204 10.422 4.073 1.00 1.02 H new ATOM 0 HG3 GLU B 30 -11.628 11.214 2.568 1.00 1.02 H new ATOM 2283 N PHE B 31 -14.277 6.916 3.827 1.00 0.96 N ATOM 2284 CA PHE B 31 -15.182 5.837 3.433 1.00 0.99 C ATOM 2285 C PHE B 31 -16.233 5.573 4.509 1.00 0.97 C ATOM 2286 O PHE B 31 -17.416 5.414 4.207 1.00 1.01 O ATOM 2287 CB PHE B 31 -14.399 4.555 3.159 1.00 1.01 C ATOM 2288 CG PHE B 31 -14.043 4.360 1.712 1.00 1.04 C ATOM 2289 CD1 PHE B 31 -15.023 4.061 0.778 1.00 1.50 C ATOM 2290 CD2 PHE B 31 -12.730 4.476 1.285 1.00 1.68 C ATOM 2291 CE1 PHE B 31 -14.698 3.884 -0.553 1.00 1.59 C ATOM 2292 CE2 PHE B 31 -12.401 4.301 -0.044 1.00 1.83 C ATOM 2293 CZ PHE B 31 -13.386 4.004 -0.966 1.00 1.37 C ATOM 0 H PHE B 31 -13.293 6.649 3.858 1.00 0.96 H new ATOM 0 HA PHE B 31 -15.691 6.152 2.522 1.00 0.99 H new ATOM 0 HB2 PHE B 31 -13.484 4.566 3.751 1.00 1.01 H new ATOM 0 HB3 PHE B 31 -14.987 3.702 3.497 1.00 1.01 H new ATOM 0 HD1 PHE B 31 -16.051 3.965 1.094 1.00 1.50 H new ATOM 0 HD2 PHE B 31 -11.955 4.706 2.001 1.00 1.68 H new ATOM 0 HE1 PHE B 31 -15.471 3.652 -1.271 1.00 1.59 H new ATOM 0 HE2 PHE B 31 -11.374 4.396 -0.363 1.00 1.83 H new ATOM 0 HZ PHE B 31 -13.131 3.866 -2.006 1.00 1.37 H new ATOM 2303 N ASP B 32 -15.793 5.525 5.762 1.00 0.94 N ATOM 2304 CA ASP B 32 -16.697 5.278 6.883 1.00 0.93 C ATOM 2305 C ASP B 32 -17.720 6.406 7.010 1.00 0.93 C ATOM 2306 O ASP B 32 -18.905 6.161 7.245 1.00 0.96 O ATOM 2307 CB ASP B 32 -15.902 5.127 8.183 1.00 0.94 C ATOM 2308 CG ASP B 32 -16.786 4.850 9.383 1.00 1.20 C ATOM 2309 OD1 ASP B 32 -17.270 3.707 9.524 1.00 1.64 O ATOM 2310 OD2 ASP B 32 -17.000 5.775 10.195 1.00 1.54 O ATOM 0 H ASP B 32 -14.817 5.654 6.028 1.00 0.94 H new ATOM 0 HA ASP B 32 -17.235 4.349 6.694 1.00 0.93 H new ATOM 0 HB2 ASP B 32 -15.183 4.315 8.072 1.00 0.94 H new ATOM 0 HB3 ASP B 32 -15.330 6.037 8.361 1.00 0.94 H new ATOM 2315 N VAL B 33 -17.259 7.642 6.833 1.00 0.92 N ATOM 2316 CA VAL B 33 -18.131 8.807 6.917 1.00 0.93 C ATOM 2317 C VAL B 33 -19.144 8.803 5.775 1.00 0.94 C ATOM 2318 O VAL B 33 -20.336 9.025 5.988 1.00 0.95 O ATOM 2319 CB VAL B 33 -17.323 10.123 6.895 1.00 0.94 C ATOM 2320 CG1 VAL B 33 -18.250 11.327 6.981 1.00 1.00 C ATOM 2321 CG2 VAL B 33 -16.311 10.140 8.030 1.00 0.92 C ATOM 0 H VAL B 33 -16.284 7.861 6.630 1.00 0.92 H new ATOM 0 HA VAL B 33 -18.662 8.749 7.867 1.00 0.93 H new ATOM 0 HB VAL B 33 -16.783 10.181 5.950 1.00 0.94 H new ATOM 0 HG11 VAL B 33 -17.659 12.243 6.964 1.00 1.00 H new ATOM 0 HG12 VAL B 33 -18.934 11.321 6.133 1.00 1.00 H new ATOM 0 HG13 VAL B 33 -18.821 11.281 7.908 1.00 1.00 H new ATOM 0 HG21 VAL B 33 -15.749 11.073 8.002 1.00 0.92 H new ATOM 0 HG22 VAL B 33 -16.833 10.059 8.984 1.00 0.92 H new ATOM 0 HG23 VAL B 33 -15.625 9.300 7.919 1.00 0.92 H new ATOM 2331 N VAL B 34 -18.661 8.526 4.564 1.00 0.96 N ATOM 2332 CA VAL B 34 -19.519 8.483 3.383 1.00 0.99 C ATOM 2333 C VAL B 34 -20.611 7.431 3.553 1.00 1.00 C ATOM 2334 O VAL B 34 -21.753 7.643 3.155 1.00 1.02 O ATOM 2335 CB VAL B 34 -18.708 8.201 2.093 1.00 1.02 C ATOM 2336 CG1 VAL B 34 -19.632 7.956 0.907 1.00 1.21 C ATOM 2337 CG2 VAL B 34 -17.760 9.353 1.791 1.00 1.13 C ATOM 0 H VAL B 34 -17.678 8.328 4.376 1.00 0.96 H new ATOM 0 HA VAL B 34 -19.980 9.465 3.281 1.00 0.99 H new ATOM 0 HB VAL B 34 -18.120 7.299 2.261 1.00 1.02 H new ATOM 0 HG11 VAL B 34 -19.036 7.761 0.016 1.00 1.21 H new ATOM 0 HG12 VAL B 34 -20.269 7.096 1.113 1.00 1.21 H new ATOM 0 HG13 VAL B 34 -20.254 8.836 0.742 1.00 1.21 H new ATOM 0 HG21 VAL B 34 -17.200 9.135 0.882 1.00 1.13 H new ATOM 0 HG22 VAL B 34 -18.334 10.270 1.653 1.00 1.13 H new ATOM 0 HG23 VAL B 34 -17.066 9.481 2.622 1.00 1.13 H new ATOM 2347 N LYS B 35 -20.248 6.308 4.163 1.00 1.01 N ATOM 2348 CA LYS B 35 -21.183 5.218 4.413 1.00 1.05 C ATOM 2349 C LYS B 35 -22.357 5.688 5.274 1.00 1.03 C ATOM 2350 O LYS B 35 -23.514 5.371 4.998 1.00 1.05 O ATOM 2351 CB LYS B 35 -20.449 4.064 5.104 1.00 1.08 C ATOM 2352 CG LYS B 35 -21.370 3.062 5.783 1.00 1.13 C ATOM 2353 CD LYS B 35 -20.584 2.063 6.619 1.00 1.32 C ATOM 2354 CE LYS B 35 -21.439 1.457 7.721 1.00 1.51 C ATOM 2355 NZ LYS B 35 -22.571 0.656 7.180 1.00 1.86 N ATOM 0 H LYS B 35 -19.301 6.128 4.497 1.00 1.01 H new ATOM 0 HA LYS B 35 -21.583 4.876 3.459 1.00 1.05 H new ATOM 0 HB2 LYS B 35 -19.841 3.541 4.366 1.00 1.08 H new ATOM 0 HB3 LYS B 35 -19.766 4.475 5.847 1.00 1.08 H new ATOM 0 HG2 LYS B 35 -22.080 3.591 6.418 1.00 1.13 H new ATOM 0 HG3 LYS B 35 -21.951 2.531 5.029 1.00 1.13 H new ATOM 0 HD2 LYS B 35 -20.203 1.270 5.976 1.00 1.32 H new ATOM 0 HD3 LYS B 35 -19.719 2.558 7.060 1.00 1.32 H new ATOM 0 HE2 LYS B 35 -20.817 0.823 8.353 1.00 1.51 H new ATOM 0 HE3 LYS B 35 -21.830 2.253 8.354 1.00 1.51 H new ATOM 0 HZ1 LYS B 35 -23.126 0.263 7.967 1.00 1.86 H new ATOM 0 HZ2 LYS B 35 -23.180 1.265 6.598 1.00 1.86 H new ATOM 0 HZ3 LYS B 35 -22.199 -0.121 6.597 1.00 1.86 H new ATOM 2369 N GLU B 36 -22.054 6.445 6.317 1.00 1.00 N ATOM 2370 CA GLU B 36 -23.089 6.950 7.206 1.00 1.00 C ATOM 2371 C GLU B 36 -23.889 8.067 6.538 1.00 0.96 C ATOM 2372 O GLU B 36 -25.100 8.182 6.733 1.00 0.97 O ATOM 2373 CB GLU B 36 -22.479 7.445 8.516 1.00 1.01 C ATOM 2374 CG GLU B 36 -23.489 7.540 9.647 1.00 1.15 C ATOM 2375 CD GLU B 36 -23.978 6.183 10.098 1.00 1.29 C ATOM 2376 OE1 GLU B 36 -24.913 5.636 9.472 1.00 1.40 O ATOM 2377 OE2 GLU B 36 -23.437 5.655 11.089 1.00 1.57 O ATOM 0 H GLU B 36 -21.105 6.722 6.568 1.00 1.00 H new ATOM 0 HA GLU B 36 -23.770 6.128 7.427 1.00 1.00 H new ATOM 0 HB2 GLU B 36 -21.674 6.772 8.812 1.00 1.01 H new ATOM 0 HB3 GLU B 36 -22.032 8.426 8.354 1.00 1.01 H new ATOM 0 HG2 GLU B 36 -23.037 8.059 10.492 1.00 1.15 H new ATOM 0 HG3 GLU B 36 -24.339 8.140 9.322 1.00 1.15 H new ATOM 2384 N SER B 37 -23.219 8.873 5.736 1.00 0.00 N ATOM 2385 CA SER B 37 -23.847 9.988 5.034 1.00 0.00 C ATOM 2386 C SER B 37 -24.933 9.499 4.104 1.00 0.00 C ATOM 2387 O SER B 37 -26.050 10.034 4.097 1.00 0.00 O ATOM 2388 CB SER B 37 -22.789 10.832 4.281 1.00 0.00 C ATOM 2389 OG SER B 37 -21.888 11.510 5.162 1.00 0.00 O ATOM 0 H SER B 37 -22.221 8.777 5.549 1.00 0.00 H new ATOM 0 HA SER B 37 -24.318 10.635 5.774 1.00 0.00 H new ATOM 0 HB2 SER B 37 -22.219 10.183 3.616 1.00 0.00 H new ATOM 0 HB3 SER B 37 -23.296 11.565 3.653 1.00 0.00 H new ATOM 0 HG SER B 37 -21.279 10.860 5.571 1.00 0.00 H new ATOM 2395 N VAL B 38 -24.618 8.514 3.271 1.00 0.96 N ATOM 2396 CA VAL B 38 -25.585 7.979 2.322 1.00 1.00 C ATOM 2397 C VAL B 38 -26.710 7.254 3.049 1.00 1.02 C ATOM 2398 O VAL B 38 -27.835 7.189 2.559 1.00 1.04 O ATOM 2399 CB VAL B 38 -24.934 7.037 1.283 1.00 1.05 C ATOM 2400 CG1 VAL B 38 -23.928 7.797 0.431 1.00 1.05 C ATOM 2401 CG2 VAL B 38 -24.276 5.837 1.951 1.00 1.07 C ATOM 0 H VAL B 38 -23.700 8.070 3.234 1.00 0.96 H new ATOM 0 HA VAL B 38 -25.996 8.831 1.780 1.00 1.00 H new ATOM 0 HB VAL B 38 -25.725 6.660 0.635 1.00 1.05 H new ATOM 0 HG11 VAL B 38 -23.480 7.118 -0.295 1.00 1.05 H new ATOM 0 HG12 VAL B 38 -24.434 8.607 -0.094 1.00 1.05 H new ATOM 0 HG13 VAL B 38 -23.148 8.211 1.071 1.00 1.05 H new ATOM 0 HG21 VAL B 38 -23.829 5.197 1.190 1.00 1.07 H new ATOM 0 HG22 VAL B 38 -23.502 6.181 2.636 1.00 1.07 H new ATOM 0 HG23 VAL B 38 -25.026 5.273 2.505 1.00 1.07 H new ATOM 2411 N ASN B 39 -26.400 6.724 4.226 1.00 1.03 N ATOM 2412 CA ASN B 39 -27.383 6.013 5.034 1.00 1.07 C ATOM 2413 C ASN B 39 -28.490 6.972 5.472 1.00 1.05 C ATOM 2414 O ASN B 39 -29.681 6.710 5.273 1.00 1.08 O ATOM 2415 CB ASN B 39 -26.698 5.378 6.253 1.00 1.11 C ATOM 2416 CG ASN B 39 -27.671 4.701 7.205 1.00 1.20 C ATOM 2417 OD1 ASN B 39 -28.699 4.163 6.798 1.00 1.25 O ATOM 2418 ND2 ASN B 39 -27.338 4.712 8.487 1.00 1.25 N ATOM 0 H ASN B 39 -25.471 6.774 4.644 1.00 1.03 H new ATOM 0 HA ASN B 39 -27.832 5.218 4.438 1.00 1.07 H new ATOM 0 HB2 ASN B 39 -25.967 4.646 5.910 1.00 1.11 H new ATOM 0 HB3 ASN B 39 -26.148 6.148 6.794 1.00 1.11 H new ATOM 0 HD21 ASN B 39 -27.943 4.264 9.175 1.00 1.25 H new ATOM 0 HD22 ASN B 39 -26.476 5.169 8.786 1.00 1.25 H new ATOM 2425 N GLU B 40 -28.085 8.102 6.037 1.00 1.02 N ATOM 2426 CA GLU B 40 -29.029 9.111 6.504 1.00 1.02 C ATOM 2427 C GLU B 40 -29.766 9.760 5.336 1.00 0.98 C ATOM 2428 O GLU B 40 -30.938 10.133 5.460 1.00 1.01 O ATOM 2429 CB GLU B 40 -28.309 10.185 7.322 1.00 1.04 C ATOM 2430 CG GLU B 40 -28.235 9.862 8.803 1.00 1.24 C ATOM 2431 CD GLU B 40 -29.602 9.821 9.456 1.00 1.46 C ATOM 2432 OE1 GLU B 40 -30.293 10.860 9.464 1.00 1.92 O ATOM 2433 OE2 GLU B 40 -29.994 8.748 9.960 1.00 2.04 O ATOM 0 H GLU B 40 -27.105 8.344 6.184 1.00 1.02 H new ATOM 0 HA GLU B 40 -29.760 8.610 7.138 1.00 1.02 H new ATOM 0 HB2 GLU B 40 -27.298 10.311 6.934 1.00 1.04 H new ATOM 0 HB3 GLU B 40 -28.822 11.137 7.190 1.00 1.04 H new ATOM 0 HG2 GLU B 40 -27.742 8.899 8.938 1.00 1.24 H new ATOM 0 HG3 GLU B 40 -27.618 10.608 9.304 1.00 1.24 H new ATOM 2440 N LEU B 41 -29.078 9.882 4.206 1.00 0.95 N ATOM 2441 CA LEU B 41 -29.659 10.484 3.009 1.00 0.94 C ATOM 2442 C LEU B 41 -30.772 9.606 2.445 1.00 0.95 C ATOM 2443 O LEU B 41 -31.816 10.108 2.039 1.00 0.97 O ATOM 2444 CB LEU B 41 -28.578 10.704 1.944 1.00 0.92 C ATOM 2445 CG LEU B 41 -29.036 11.458 0.693 1.00 0.97 C ATOM 2446 CD1 LEU B 41 -29.279 12.926 1.016 1.00 1.08 C ATOM 2447 CD2 LEU B 41 -28.002 11.321 -0.415 1.00 1.01 C ATOM 0 H LEU B 41 -28.113 9.571 4.093 1.00 0.95 H new ATOM 0 HA LEU B 41 -30.085 11.448 3.288 1.00 0.94 H new ATOM 0 HB2 LEU B 41 -27.752 11.252 2.396 1.00 0.92 H new ATOM 0 HB3 LEU B 41 -28.188 9.733 1.640 1.00 0.92 H new ATOM 0 HG LEU B 41 -29.973 11.021 0.348 1.00 0.97 H new ATOM 0 HD11 LEU B 41 -29.604 13.448 0.116 1.00 1.08 H new ATOM 0 HD12 LEU B 41 -30.051 13.007 1.781 1.00 1.08 H new ATOM 0 HD13 LEU B 41 -28.356 13.375 1.383 1.00 1.08 H new ATOM 0 HD21 LEU B 41 -28.341 11.862 -1.298 1.00 1.01 H new ATOM 0 HD22 LEU B 41 -27.051 11.735 -0.079 1.00 1.01 H new ATOM 0 HD23 LEU B 41 -27.872 10.268 -0.663 1.00 1.01 H new ATOM 2459 N SER B 42 -30.547 8.297 2.439 1.00 0.97 N ATOM 2460 CA SER B 42 -31.529 7.343 1.929 1.00 1.01 C ATOM 2461 C SER B 42 -32.825 7.404 2.732 1.00 1.02 C ATOM 2462 O SER B 42 -33.915 7.224 2.188 1.00 1.03 O ATOM 2463 CB SER B 42 -30.959 5.924 1.965 1.00 1.07 C ATOM 2464 OG SER B 42 -29.747 5.842 1.231 1.00 1.56 O ATOM 0 H SER B 42 -29.688 7.869 2.784 1.00 0.97 H new ATOM 0 HA SER B 42 -31.753 7.612 0.897 1.00 1.01 H new ATOM 0 HB2 SER B 42 -30.783 5.626 2.998 1.00 1.07 H new ATOM 0 HB3 SER B 42 -31.687 5.226 1.551 1.00 1.07 H new ATOM 0 HG SER B 42 -29.069 6.409 1.654 1.00 1.56 H new ATOM 2470 N GLU B 43 -32.697 7.659 4.027 1.00 1.04 N ATOM 2471 CA GLU B 43 -33.848 7.758 4.909 1.00 1.07 C ATOM 2472 C GLU B 43 -34.707 8.965 4.532 1.00 1.05 C ATOM 2473 O GLU B 43 -35.937 8.901 4.566 1.00 1.10 O ATOM 2474 CB GLU B 43 -33.374 7.862 6.361 1.00 1.12 C ATOM 2475 CG GLU B 43 -34.495 7.814 7.384 1.00 1.24 C ATOM 2476 CD GLU B 43 -34.830 9.177 7.948 1.00 1.41 C ATOM 2477 OE1 GLU B 43 -33.961 9.784 8.606 1.00 1.56 O ATOM 2478 OE2 GLU B 43 -35.964 9.652 7.731 1.00 1.92 O ATOM 0 H GLU B 43 -31.800 7.802 4.491 1.00 1.04 H new ATOM 0 HA GLU B 43 -34.460 6.863 4.801 1.00 1.07 H new ATOM 0 HB2 GLU B 43 -32.677 7.049 6.563 1.00 1.12 H new ATOM 0 HB3 GLU B 43 -32.822 8.794 6.486 1.00 1.12 H new ATOM 0 HG2 GLU B 43 -35.385 7.388 6.921 1.00 1.24 H new ATOM 0 HG3 GLU B 43 -34.210 7.148 8.199 1.00 1.24 H new ATOM 2485 N LYS B 44 -34.053 10.053 4.137 1.00 1.00 N ATOM 2486 CA LYS B 44 -34.761 11.274 3.764 1.00 1.00 C ATOM 2487 C LYS B 44 -35.369 11.151 2.374 1.00 0.98 C ATOM 2488 O LYS B 44 -36.472 11.626 2.122 1.00 1.03 O ATOM 2489 CB LYS B 44 -33.812 12.474 3.794 1.00 1.01 C ATOM 2490 CG LYS B 44 -32.922 12.526 5.022 1.00 1.06 C ATOM 2491 CD LYS B 44 -33.713 12.781 6.291 1.00 1.17 C ATOM 2492 CE LYS B 44 -32.802 12.811 7.510 1.00 1.32 C ATOM 2493 NZ LYS B 44 -32.166 11.489 7.761 1.00 1.35 N ATOM 0 H LYS B 44 -33.037 10.115 4.067 1.00 1.00 H new ATOM 0 HA LYS B 44 -35.562 11.425 4.488 1.00 1.00 H new ATOM 0 HB2 LYS B 44 -33.184 12.450 2.903 1.00 1.01 H new ATOM 0 HB3 LYS B 44 -34.400 13.391 3.745 1.00 1.01 H new ATOM 0 HG2 LYS B 44 -32.380 11.585 5.116 1.00 1.06 H new ATOM 0 HG3 LYS B 44 -32.177 13.312 4.896 1.00 1.06 H new ATOM 0 HD2 LYS B 44 -34.244 13.729 6.207 1.00 1.17 H new ATOM 0 HD3 LYS B 44 -34.466 12.003 6.416 1.00 1.17 H new ATOM 0 HE2 LYS B 44 -32.028 13.565 7.366 1.00 1.32 H new ATOM 0 HE3 LYS B 44 -33.378 13.109 8.386 1.00 1.32 H new ATOM 0 HZ1 LYS B 44 -31.580 11.543 8.619 1.00 1.35 H new ATOM 0 HZ2 LYS B 44 -32.904 10.768 7.890 1.00 1.35 H new ATOM 0 HZ3 LYS B 44 -31.569 11.232 6.950 1.00 1.35 H new ATOM 2507 N ALA B 45 -34.643 10.492 1.482 1.00 0.98 N ATOM 2508 CA ALA B 45 -35.083 10.308 0.107 1.00 0.99 C ATOM 2509 C ALA B 45 -36.163 9.237 -0.001 1.00 1.01 C ATOM 2510 O ALA B 45 -36.797 9.083 -1.043 1.00 1.03 O ATOM 2511 CB ALA B 45 -33.897 9.951 -0.774 1.00 1.01 C ATOM 0 H ALA B 45 -33.737 10.072 1.690 1.00 0.98 H new ATOM 0 HA ALA B 45 -35.517 11.248 -0.234 1.00 0.99 H new ATOM 0 HB1 ALA B 45 -34.235 9.815 -1.801 1.00 1.01 H new ATOM 0 HB2 ALA B 45 -33.162 10.755 -0.737 1.00 1.01 H new ATOM 0 HB3 ALA B 45 -33.443 9.027 -0.416 1.00 1.01 H new ATOM 2517 N LYS B 46 -36.374 8.506 1.083 1.00 1.04 N ATOM 2518 CA LYS B 46 -37.371 7.446 1.108 1.00 1.10 C ATOM 2519 C LYS B 46 -38.785 8.021 1.049 1.00 1.12 C ATOM 2520 O LYS B 46 -39.731 7.328 0.675 1.00 1.18 O ATOM 2521 CB LYS B 46 -37.199 6.598 2.371 1.00 1.18 C ATOM 2522 CG LYS B 46 -37.917 5.256 2.320 1.00 1.46 C ATOM 2523 CD LYS B 46 -36.945 4.099 2.122 1.00 1.98 C ATOM 2524 CE LYS B 46 -36.328 4.099 0.726 1.00 2.66 C ATOM 2525 NZ LYS B 46 -35.511 2.880 0.474 1.00 3.40 N ATOM 0 H LYS B 46 -35.867 8.628 1.959 1.00 1.04 H new ATOM 0 HA LYS B 46 -37.225 6.817 0.230 1.00 1.10 H new ATOM 0 HB2 LYS B 46 -36.136 6.423 2.537 1.00 1.18 H new ATOM 0 HB3 LYS B 46 -37.567 7.163 3.228 1.00 1.18 H new ATOM 0 HG2 LYS B 46 -38.475 5.107 3.245 1.00 1.46 H new ATOM 0 HG3 LYS B 46 -38.643 5.263 1.507 1.00 1.46 H new ATOM 0 HD2 LYS B 46 -36.153 4.160 2.868 1.00 1.98 H new ATOM 0 HD3 LYS B 46 -37.466 3.156 2.287 1.00 1.98 H new ATOM 0 HE2 LYS B 46 -37.120 4.164 -0.020 1.00 2.66 H new ATOM 0 HE3 LYS B 46 -35.704 4.984 0.606 1.00 2.66 H new ATOM 0 HZ1 LYS B 46 -35.111 2.922 -0.485 1.00 3.40 H new ATOM 0 HZ2 LYS B 46 -34.739 2.830 1.169 1.00 3.40 H new ATOM 0 HZ3 LYS B 46 -36.111 2.035 0.562 1.00 3.40 H new ATOM 2539 N THR B 47 -38.918 9.290 1.400 1.00 1.10 N ATOM 2540 CA THR B 47 -40.216 9.951 1.400 1.00 1.16 C ATOM 2541 C THR B 47 -40.552 10.568 0.039 1.00 1.17 C ATOM 2542 O THR B 47 -41.478 11.373 -0.078 1.00 1.27 O ATOM 2543 CB THR B 47 -40.273 11.042 2.485 1.00 1.24 C ATOM 2544 OG1 THR B 47 -39.073 11.008 3.273 1.00 1.54 O ATOM 2545 CG2 THR B 47 -41.481 10.845 3.389 1.00 1.41 C ATOM 0 H THR B 47 -38.142 9.885 1.689 1.00 1.10 H new ATOM 0 HA THR B 47 -40.958 9.182 1.615 1.00 1.16 H new ATOM 0 HB THR B 47 -40.362 12.010 1.993 1.00 1.24 H new ATOM 0 HG1 THR B 47 -38.333 11.394 2.759 1.00 1.54 H new ATOM 0 HG21 THR B 47 -41.499 11.628 4.147 1.00 1.41 H new ATOM 0 HG22 THR B 47 -42.393 10.895 2.794 1.00 1.41 H new ATOM 0 HG23 THR B 47 -41.417 9.871 3.874 1.00 1.41 H new ATOM 2553 N ASP B 48 -39.807 10.192 -0.991 1.00 1.14 N ATOM 2554 CA ASP B 48 -40.053 10.717 -2.328 1.00 1.18 C ATOM 2555 C ASP B 48 -39.754 9.660 -3.388 1.00 1.14 C ATOM 2556 O ASP B 48 -38.665 9.098 -3.410 1.00 1.10 O ATOM 2557 CB ASP B 48 -39.199 11.960 -2.580 1.00 1.23 C ATOM 2558 CG ASP B 48 -39.680 12.743 -3.781 1.00 1.28 C ATOM 2559 OD1 ASP B 48 -39.349 12.358 -4.921 1.00 1.43 O ATOM 2560 OD2 ASP B 48 -40.395 13.753 -3.587 1.00 1.39 O ATOM 0 H ASP B 48 -39.033 9.531 -0.929 1.00 1.14 H new ATOM 0 HA ASP B 48 -41.106 10.990 -2.394 1.00 1.18 H new ATOM 0 HB2 ASP B 48 -39.220 12.600 -1.698 1.00 1.23 H new ATOM 0 HB3 ASP B 48 -38.162 11.662 -2.733 1.00 1.23 H new ATOM 2565 N PRO B 49 -40.716 9.384 -4.284 1.00 1.20 N ATOM 2566 CA PRO B 49 -40.550 8.379 -5.345 1.00 1.22 C ATOM 2567 C PRO B 49 -39.402 8.709 -6.303 1.00 1.24 C ATOM 2568 O PRO B 49 -38.714 7.813 -6.795 1.00 1.24 O ATOM 2569 CB PRO B 49 -41.888 8.403 -6.091 1.00 1.33 C ATOM 2570 CG PRO B 49 -42.509 9.707 -5.730 1.00 1.36 C ATOM 2571 CD PRO B 49 -42.041 10.020 -4.338 1.00 1.29 C ATOM 0 HA PRO B 49 -40.298 7.404 -4.928 1.00 1.22 H new ATOM 0 HB2 PRO B 49 -41.741 8.321 -7.168 1.00 1.33 H new ATOM 0 HB3 PRO B 49 -42.522 7.568 -5.792 1.00 1.33 H new ATOM 0 HG2 PRO B 49 -42.208 10.489 -6.427 1.00 1.36 H new ATOM 0 HG3 PRO B 49 -43.596 9.645 -5.771 1.00 1.36 H new ATOM 0 HD2 PRO B 49 -41.980 11.094 -4.165 1.00 1.29 H new ATOM 0 HD3 PRO B 49 -42.715 9.613 -3.584 1.00 1.29 H new ATOM 2579 N GLN B 50 -39.188 9.996 -6.557 1.00 1.28 N ATOM 2580 CA GLN B 50 -38.127 10.432 -7.456 1.00 1.33 C ATOM 2581 C GLN B 50 -36.785 10.359 -6.749 1.00 1.22 C ATOM 2582 O GLN B 50 -35.783 9.935 -7.329 1.00 1.22 O ATOM 2583 CB GLN B 50 -38.382 11.858 -7.945 1.00 1.45 C ATOM 2584 CG GLN B 50 -39.664 12.003 -8.746 1.00 1.58 C ATOM 2585 CD GLN B 50 -40.460 13.232 -8.360 1.00 1.65 C ATOM 2586 OE1 GLN B 50 -41.079 13.876 -9.207 1.00 1.81 O ATOM 2587 NE2 GLN B 50 -40.468 13.561 -7.076 1.00 1.66 N ATOM 0 H GLN B 50 -39.736 10.755 -6.152 1.00 1.28 H new ATOM 0 HA GLN B 50 -38.114 9.768 -8.321 1.00 1.33 H new ATOM 0 HB2 GLN B 50 -38.422 12.527 -7.085 1.00 1.45 H new ATOM 0 HB3 GLN B 50 -37.541 12.179 -8.559 1.00 1.45 H new ATOM 0 HG2 GLN B 50 -39.421 12.052 -9.807 1.00 1.58 H new ATOM 0 HG3 GLN B 50 -40.280 11.116 -8.601 1.00 1.58 H new ATOM 0 HE21 GLN B 50 -39.943 13.003 -6.403 1.00 1.66 H new ATOM 0 HE22 GLN B 50 -41.000 14.372 -6.761 1.00 1.66 H new ATOM 2596 N ALA B 51 -36.771 10.776 -5.488 1.00 1.15 N ATOM 2597 CA ALA B 51 -35.551 10.746 -4.696 1.00 1.08 C ATOM 2598 C ALA B 51 -35.139 9.307 -4.405 1.00 1.00 C ATOM 2599 O ALA B 51 -33.951 8.983 -4.377 1.00 0.98 O ATOM 2600 CB ALA B 51 -35.732 11.527 -3.405 1.00 1.09 C ATOM 0 H ALA B 51 -37.588 11.137 -4.995 1.00 1.15 H new ATOM 0 HA ALA B 51 -34.755 11.220 -5.270 1.00 1.08 H new ATOM 0 HB1 ALA B 51 -34.809 11.493 -2.827 1.00 1.09 H new ATOM 0 HB2 ALA B 51 -35.976 12.563 -3.638 1.00 1.09 H new ATOM 0 HB3 ALA B 51 -36.541 11.086 -2.823 1.00 1.09 H new ATOM 2606 N ALA B 52 -36.135 8.448 -4.196 1.00 0.99 N ATOM 2607 CA ALA B 52 -35.890 7.036 -3.937 1.00 0.98 C ATOM 2608 C ALA B 52 -35.232 6.391 -5.146 1.00 1.02 C ATOM 2609 O ALA B 52 -34.405 5.493 -5.006 1.00 1.03 O ATOM 2610 CB ALA B 52 -37.184 6.318 -3.590 1.00 1.03 C ATOM 0 H ALA B 52 -37.121 8.709 -4.202 1.00 0.99 H new ATOM 0 HA ALA B 52 -35.218 6.952 -3.083 1.00 0.98 H new ATOM 0 HB1 ALA B 52 -36.976 5.265 -3.401 1.00 1.03 H new ATOM 0 HB2 ALA B 52 -37.622 6.767 -2.699 1.00 1.03 H new ATOM 0 HB3 ALA B 52 -37.883 6.406 -4.422 1.00 1.03 H new ATOM 2616 N GLU B 53 -35.610 6.867 -6.330 1.00 1.09 N ATOM 2617 CA GLU B 53 -35.057 6.367 -7.582 1.00 1.18 C ATOM 2618 C GLU B 53 -33.578 6.742 -7.689 1.00 1.17 C ATOM 2619 O GLU B 53 -32.771 5.995 -8.246 1.00 1.23 O ATOM 2620 CB GLU B 53 -35.842 6.937 -8.773 1.00 1.28 C ATOM 2621 CG GLU B 53 -35.154 6.767 -10.122 1.00 1.45 C ATOM 2622 CD GLU B 53 -35.098 5.325 -10.597 1.00 1.51 C ATOM 2623 OE1 GLU B 53 -35.530 4.422 -9.851 1.00 1.66 O ATOM 2624 OE2 GLU B 53 -34.628 5.094 -11.732 1.00 1.58 O ATOM 0 H GLU B 53 -36.304 7.605 -6.446 1.00 1.09 H new ATOM 0 HA GLU B 53 -35.144 5.281 -7.598 1.00 1.18 H new ATOM 0 HB2 GLU B 53 -36.818 6.454 -8.814 1.00 1.28 H new ATOM 0 HB3 GLU B 53 -36.019 7.999 -8.601 1.00 1.28 H new ATOM 0 HG2 GLU B 53 -35.678 7.366 -10.866 1.00 1.45 H new ATOM 0 HG3 GLU B 53 -34.139 7.159 -10.055 1.00 1.45 H new ATOM 2631 N LYS B 54 -33.227 7.900 -7.133 1.00 1.13 N ATOM 2632 CA LYS B 54 -31.848 8.376 -7.152 1.00 1.14 C ATOM 2633 C LYS B 54 -30.949 7.421 -6.383 1.00 1.05 C ATOM 2634 O LYS B 54 -29.900 7.006 -6.876 1.00 1.09 O ATOM 2635 CB LYS B 54 -31.749 9.780 -6.551 1.00 1.16 C ATOM 2636 CG LYS B 54 -32.194 10.880 -7.499 1.00 1.32 C ATOM 2637 CD LYS B 54 -32.255 12.232 -6.800 1.00 1.48 C ATOM 2638 CE LYS B 54 -32.263 13.388 -7.792 1.00 1.68 C ATOM 2639 NZ LYS B 54 -33.412 13.316 -8.733 1.00 2.09 N ATOM 0 H LYS B 54 -33.881 8.526 -6.663 1.00 1.13 H new ATOM 0 HA LYS B 54 -31.519 8.418 -8.190 1.00 1.14 H new ATOM 0 HB2 LYS B 54 -32.357 9.823 -5.647 1.00 1.16 H new ATOM 0 HB3 LYS B 54 -30.718 9.966 -6.251 1.00 1.16 H new ATOM 0 HG2 LYS B 54 -31.505 10.936 -8.341 1.00 1.32 H new ATOM 0 HG3 LYS B 54 -33.175 10.636 -7.906 1.00 1.32 H new ATOM 0 HD2 LYS B 54 -33.151 12.280 -6.181 1.00 1.48 H new ATOM 0 HD3 LYS B 54 -31.400 12.334 -6.132 1.00 1.48 H new ATOM 0 HE2 LYS B 54 -32.301 14.331 -7.247 1.00 1.68 H new ATOM 0 HE3 LYS B 54 -31.332 13.384 -8.358 1.00 1.68 H new ATOM 0 HZ1 LYS B 54 -33.444 14.181 -9.309 1.00 2.09 H new ATOM 0 HZ2 LYS B 54 -33.300 12.490 -9.355 1.00 2.09 H new ATOM 0 HZ3 LYS B 54 -34.297 13.227 -8.194 1.00 2.09 H new ATOM 2653 N LEU B 55 -31.375 7.058 -5.178 1.00 0.98 N ATOM 2654 CA LEU B 55 -30.606 6.137 -4.345 1.00 0.95 C ATOM 2655 C LEU B 55 -30.658 4.729 -4.929 1.00 0.99 C ATOM 2656 O LEU B 55 -29.741 3.935 -4.740 1.00 0.99 O ATOM 2657 CB LEU B 55 -31.120 6.139 -2.899 1.00 0.94 C ATOM 2658 CG LEU B 55 -30.422 7.128 -1.957 1.00 1.02 C ATOM 2659 CD1 LEU B 55 -28.923 6.866 -1.905 1.00 1.13 C ATOM 2660 CD2 LEU B 55 -30.699 8.562 -2.383 1.00 1.09 C ATOM 0 H LEU B 55 -32.244 7.385 -4.757 1.00 0.98 H new ATOM 0 HA LEU B 55 -29.570 6.474 -4.332 1.00 0.95 H new ATOM 0 HB2 LEU B 55 -32.186 6.364 -2.910 1.00 0.94 H new ATOM 0 HB3 LEU B 55 -31.011 5.134 -2.490 1.00 0.94 H new ATOM 0 HG LEU B 55 -30.827 6.982 -0.955 1.00 1.02 H new ATOM 0 HD11 LEU B 55 -28.452 7.581 -1.230 1.00 1.13 H new ATOM 0 HD12 LEU B 55 -28.743 5.853 -1.544 1.00 1.13 H new ATOM 0 HD13 LEU B 55 -28.500 6.976 -2.903 1.00 1.13 H new ATOM 0 HD21 LEU B 55 -30.195 9.248 -1.702 1.00 1.09 H new ATOM 0 HD22 LEU B 55 -30.328 8.719 -3.396 1.00 1.09 H new ATOM 0 HD23 LEU B 55 -31.773 8.748 -2.357 1.00 1.09 H new ATOM 2672 N ASN B 56 -31.737 4.439 -5.647 1.00 1.06 N ATOM 2673 CA ASN B 56 -31.922 3.141 -6.294 1.00 1.16 C ATOM 2674 C ASN B 56 -30.852 2.937 -7.358 1.00 1.20 C ATOM 2675 O ASN B 56 -30.257 1.863 -7.471 1.00 1.26 O ATOM 2676 CB ASN B 56 -33.321 3.073 -6.930 1.00 1.26 C ATOM 2677 CG ASN B 56 -33.501 1.904 -7.878 1.00 1.44 C ATOM 2678 OD1 ASN B 56 -33.072 0.783 -7.599 1.00 1.49 O ATOM 2679 ND2 ASN B 56 -34.156 2.157 -9.001 1.00 1.58 N ATOM 0 H ASN B 56 -32.506 5.092 -5.798 1.00 1.06 H new ATOM 0 HA ASN B 56 -31.833 2.351 -5.548 1.00 1.16 H new ATOM 0 HB2 ASN B 56 -34.068 3.006 -6.139 1.00 1.26 H new ATOM 0 HB3 ASN B 56 -33.511 4.001 -7.470 1.00 1.26 H new ATOM 0 HD21 ASN B 56 -34.322 1.409 -9.674 1.00 1.58 H new ATOM 0 HD22 ASN B 56 -34.494 3.100 -9.193 1.00 1.58 H new ATOM 2686 N LYS B 57 -30.603 3.988 -8.127 1.00 1.21 N ATOM 2687 CA LYS B 57 -29.603 3.947 -9.183 1.00 1.29 C ATOM 2688 C LYS B 57 -28.201 4.003 -8.596 1.00 1.21 C ATOM 2689 O LYS B 57 -27.274 3.391 -9.121 1.00 1.26 O ATOM 2690 CB LYS B 57 -29.799 5.111 -10.155 1.00 1.39 C ATOM 2691 CG LYS B 57 -30.959 4.925 -11.121 1.00 1.52 C ATOM 2692 CD LYS B 57 -30.940 5.986 -12.213 1.00 1.62 C ATOM 2693 CE LYS B 57 -31.408 5.421 -13.543 1.00 1.73 C ATOM 2694 NZ LYS B 57 -32.884 5.481 -13.687 1.00 1.81 N ATOM 0 H LYS B 57 -31.083 4.884 -8.038 1.00 1.21 H new ATOM 0 HA LYS B 57 -29.724 3.008 -9.724 1.00 1.29 H new ATOM 0 HB2 LYS B 57 -29.960 6.025 -9.583 1.00 1.39 H new ATOM 0 HB3 LYS B 57 -28.882 5.250 -10.728 1.00 1.39 H new ATOM 0 HG2 LYS B 57 -30.905 3.934 -11.572 1.00 1.52 H new ATOM 0 HG3 LYS B 57 -31.902 4.977 -10.576 1.00 1.52 H new ATOM 0 HD2 LYS B 57 -31.581 6.819 -11.924 1.00 1.62 H new ATOM 0 HD3 LYS B 57 -29.930 6.383 -12.320 1.00 1.62 H new ATOM 0 HE2 LYS B 57 -30.942 5.977 -14.357 1.00 1.73 H new ATOM 0 HE3 LYS B 57 -31.077 4.386 -13.633 1.00 1.73 H new ATOM 0 HZ1 LYS B 57 -33.191 4.794 -14.405 1.00 1.81 H new ATOM 0 HZ2 LYS B 57 -33.331 5.254 -12.776 1.00 1.81 H new ATOM 0 HZ3 LYS B 57 -33.165 6.438 -13.982 1.00 1.81 H new ATOM 2708 N LEU B 58 -28.057 4.734 -7.497 1.00 1.12 N ATOM 2709 CA LEU B 58 -26.767 4.884 -6.836 1.00 1.09 C ATOM 2710 C LEU B 58 -26.264 3.552 -6.282 1.00 1.08 C ATOM 2711 O LEU B 58 -25.121 3.166 -6.526 1.00 1.11 O ATOM 2712 CB LEU B 58 -26.860 5.915 -5.708 1.00 1.06 C ATOM 2713 CG LEU B 58 -26.126 7.236 -5.965 1.00 1.21 C ATOM 2714 CD1 LEU B 58 -24.623 7.005 -6.040 1.00 1.37 C ATOM 2715 CD2 LEU B 58 -26.633 7.892 -7.242 1.00 1.40 C ATOM 0 H LEU B 58 -28.822 5.234 -7.043 1.00 1.12 H new ATOM 0 HA LEU B 58 -26.054 5.233 -7.583 1.00 1.09 H new ATOM 0 HB2 LEU B 58 -27.912 6.133 -5.523 1.00 1.06 H new ATOM 0 HB3 LEU B 58 -26.462 5.469 -4.797 1.00 1.06 H new ATOM 0 HG LEU B 58 -26.329 7.910 -5.132 1.00 1.21 H new ATOM 0 HD11 LEU B 58 -24.118 7.953 -6.223 1.00 1.37 H new ATOM 0 HD12 LEU B 58 -24.272 6.583 -5.098 1.00 1.37 H new ATOM 0 HD13 LEU B 58 -24.401 6.313 -6.853 1.00 1.37 H new ATOM 0 HD21 LEU B 58 -26.100 8.828 -7.407 1.00 1.40 H new ATOM 0 HD22 LEU B 58 -26.463 7.224 -8.086 1.00 1.40 H new ATOM 0 HD23 LEU B 58 -27.700 8.094 -7.148 1.00 1.40 H new ATOM 2727 N ILE B 59 -27.116 2.849 -5.544 1.00 1.08 N ATOM 2728 CA ILE B 59 -26.735 1.569 -4.960 1.00 1.15 C ATOM 2729 C ILE B 59 -26.434 0.531 -6.046 1.00 1.25 C ATOM 2730 O ILE B 59 -25.522 -0.284 -5.898 1.00 1.32 O ATOM 2731 CB ILE B 59 -27.817 1.033 -3.988 1.00 1.20 C ATOM 2732 CG1 ILE B 59 -27.308 -0.200 -3.237 1.00 1.33 C ATOM 2733 CG2 ILE B 59 -29.107 0.704 -4.722 1.00 1.22 C ATOM 2734 CD1 ILE B 59 -26.220 0.108 -2.228 1.00 1.37 C ATOM 0 H ILE B 59 -28.071 3.142 -5.337 1.00 1.08 H new ATOM 0 HA ILE B 59 -25.825 1.742 -4.385 1.00 1.15 H new ATOM 0 HB ILE B 59 -28.029 1.821 -3.266 1.00 1.20 H new ATOM 0 HG12 ILE B 59 -28.145 -0.673 -2.723 1.00 1.33 H new ATOM 0 HG13 ILE B 59 -26.928 -0.923 -3.959 1.00 1.33 H new ATOM 0 HG21 ILE B 59 -29.845 0.331 -4.012 1.00 1.22 H new ATOM 0 HG22 ILE B 59 -29.490 1.603 -5.205 1.00 1.22 H new ATOM 0 HG23 ILE B 59 -28.912 -0.058 -5.477 1.00 1.22 H new ATOM 0 HD11 ILE B 59 -25.909 -0.813 -1.735 1.00 1.37 H new ATOM 0 HD12 ILE B 59 -25.366 0.553 -2.738 1.00 1.37 H new ATOM 0 HD13 ILE B 59 -26.601 0.807 -1.483 1.00 1.37 H new ATOM 2746 N GLU B 60 -27.183 0.575 -7.143 1.00 1.29 N ATOM 2747 CA GLU B 60 -26.971 -0.356 -8.239 1.00 1.44 C ATOM 2748 C GLU B 60 -25.623 -0.078 -8.890 1.00 1.40 C ATOM 2749 O GLU B 60 -24.862 -0.997 -9.197 1.00 1.51 O ATOM 2750 CB GLU B 60 -28.094 -0.244 -9.267 1.00 1.54 C ATOM 2751 CG GLU B 60 -28.200 -1.451 -10.184 1.00 1.75 C ATOM 2752 CD GLU B 60 -29.583 -1.612 -10.766 1.00 1.96 C ATOM 2753 OE1 GLU B 60 -30.485 -2.078 -10.037 1.00 2.28 O ATOM 2754 OE2 GLU B 60 -29.785 -1.266 -11.950 1.00 2.17 O ATOM 0 H GLU B 60 -27.939 1.243 -7.294 1.00 1.29 H new ATOM 0 HA GLU B 60 -26.975 -1.373 -7.846 1.00 1.44 H new ATOM 0 HB2 GLU B 60 -29.041 -0.110 -8.745 1.00 1.54 H new ATOM 0 HB3 GLU B 60 -27.934 0.649 -9.872 1.00 1.54 H new ATOM 0 HG2 GLU B 60 -27.477 -1.353 -10.994 1.00 1.75 H new ATOM 0 HG3 GLU B 60 -27.936 -2.351 -9.628 1.00 1.75 H new ATOM 2761 N GLY B 61 -25.330 1.206 -9.067 1.00 1.29 N ATOM 2762 CA GLY B 61 -24.075 1.610 -9.660 1.00 1.28 C ATOM 2763 C GLY B 61 -22.898 1.226 -8.792 1.00 1.21 C ATOM 2764 O GLY B 61 -21.815 0.938 -9.295 1.00 1.23 O ATOM 0 H GLY B 61 -25.946 1.976 -8.807 1.00 1.29 H new ATOM 0 HA2 GLY B 61 -23.970 1.147 -10.641 1.00 1.28 H new ATOM 0 HA3 GLY B 61 -24.076 2.689 -9.815 1.00 1.28 H new ATOM 2768 N TYR B 62 -23.111 1.257 -7.482 1.00 1.19 N ATOM 2769 CA TYR B 62 -22.073 0.881 -6.535 1.00 1.23 C ATOM 2770 C TYR B 62 -21.850 -0.622 -6.589 1.00 1.35 C ATOM 2771 O TYR B 62 -20.716 -1.096 -6.597 1.00 1.37 O ATOM 2772 CB TYR B 62 -22.455 1.288 -5.109 1.00 1.28 C ATOM 2773 CG TYR B 62 -21.345 1.076 -4.097 1.00 1.60 C ATOM 2774 CD1 TYR B 62 -20.344 2.022 -3.931 1.00 2.11 C ATOM 2775 CD2 TYR B 62 -21.298 -0.075 -3.314 1.00 2.25 C ATOM 2776 CE1 TYR B 62 -19.328 1.831 -3.015 1.00 2.72 C ATOM 2777 CE2 TYR B 62 -20.284 -0.271 -2.393 1.00 2.90 C ATOM 2778 CZ TYR B 62 -19.302 0.685 -2.248 1.00 2.96 C ATOM 2779 OH TYR B 62 -18.279 0.488 -1.345 1.00 3.75 O ATOM 0 H TYR B 62 -23.993 1.539 -7.053 1.00 1.19 H new ATOM 0 HA TYR B 62 -21.156 1.402 -6.810 1.00 1.23 H new ATOM 0 HB2 TYR B 62 -22.742 2.339 -5.105 1.00 1.28 H new ATOM 0 HB3 TYR B 62 -23.331 0.717 -4.800 1.00 1.28 H new ATOM 0 HD1 TYR B 62 -20.359 2.922 -4.528 1.00 2.11 H new ATOM 0 HD2 TYR B 62 -22.065 -0.827 -3.428 1.00 2.25 H new ATOM 0 HE1 TYR B 62 -18.556 2.577 -2.900 1.00 2.72 H new ATOM 0 HE2 TYR B 62 -20.262 -1.168 -1.791 1.00 2.90 H new ATOM 0 HH TYR B 62 -18.409 -0.367 -0.885 1.00 3.75 H new ATOM 2789 N THR B 63 -22.954 -1.362 -6.628 1.00 1.51 N ATOM 2790 CA THR B 63 -22.912 -2.811 -6.686 1.00 1.71 C ATOM 2791 C THR B 63 -22.152 -3.283 -7.926 1.00 1.67 C ATOM 2792 O THR B 63 -21.286 -4.152 -7.843 1.00 1.80 O ATOM 2793 CB THR B 63 -24.336 -3.400 -6.685 1.00 1.94 C ATOM 2794 OG1 THR B 63 -25.070 -2.888 -5.564 1.00 2.00 O ATOM 2795 CG2 THR B 63 -24.305 -4.918 -6.621 1.00 2.31 C ATOM 0 H THR B 63 -23.896 -0.972 -6.620 1.00 1.51 H new ATOM 0 HA THR B 63 -22.387 -3.166 -5.799 1.00 1.71 H new ATOM 0 HB THR B 63 -24.825 -3.107 -7.614 1.00 1.94 H new ATOM 0 HG1 THR B 63 -25.518 -2.054 -5.819 1.00 2.00 H new ATOM 0 HG21 THR B 63 -25.325 -5.303 -6.622 1.00 2.31 H new ATOM 0 HG22 THR B 63 -23.769 -5.308 -7.487 1.00 2.31 H new ATOM 0 HG23 THR B 63 -23.799 -5.233 -5.709 1.00 2.31 H new ATOM 2803 N TYR B 64 -22.465 -2.685 -9.073 1.00 1.57 N ATOM 2804 CA TYR B 64 -21.798 -3.027 -10.324 1.00 1.63 C ATOM 2805 C TYR B 64 -20.696 -2.016 -10.617 1.00 1.37 C ATOM 2806 O TYR B 64 -20.400 -1.706 -11.774 1.00 1.46 O ATOM 2807 CB TYR B 64 -22.808 -3.060 -11.477 1.00 1.90 C ATOM 2808 CG TYR B 64 -22.309 -3.795 -12.704 1.00 2.42 C ATOM 2809 CD1 TYR B 64 -21.872 -5.108 -12.613 1.00 3.10 C ATOM 2810 CD2 TYR B 64 -22.269 -3.175 -13.948 1.00 2.81 C ATOM 2811 CE1 TYR B 64 -21.409 -5.786 -13.722 1.00 3.76 C ATOM 2812 CE2 TYR B 64 -21.807 -3.846 -15.065 1.00 3.50 C ATOM 2813 CZ TYR B 64 -21.378 -5.154 -14.947 1.00 3.84 C ATOM 2814 OH TYR B 64 -20.915 -5.832 -16.057 1.00 4.62 O ATOM 0 H TYR B 64 -23.178 -1.960 -9.161 1.00 1.57 H new ATOM 0 HA TYR B 64 -21.354 -4.018 -10.226 1.00 1.63 H new ATOM 0 HB2 TYR B 64 -23.727 -3.533 -11.130 1.00 1.90 H new ATOM 0 HB3 TYR B 64 -23.062 -2.037 -11.755 1.00 1.90 H new ATOM 0 HD1 TYR B 64 -21.894 -5.609 -11.657 1.00 3.10 H new ATOM 0 HD2 TYR B 64 -22.604 -2.153 -14.043 1.00 2.81 H new ATOM 0 HE1 TYR B 64 -21.072 -6.808 -13.631 1.00 3.76 H new ATOM 0 HE2 TYR B 64 -21.782 -3.351 -16.024 1.00 3.50 H new ATOM 0 HH TYR B 64 -20.960 -5.245 -16.841 1.00 4.62 H new ATOM 2824 N GLY B 65 -20.113 -1.486 -9.554 1.00 1.20 N ATOM 2825 CA GLY B 65 -19.059 -0.518 -9.698 1.00 1.11 C ATOM 2826 C GLY B 65 -17.731 -1.161 -10.010 1.00 1.04 C ATOM 2827 O GLY B 65 -16.951 -1.472 -9.105 1.00 1.03 O ATOM 0 H GLY B 65 -20.356 -1.714 -8.590 1.00 1.20 H new ATOM 0 HA2 GLY B 65 -19.317 0.182 -10.493 1.00 1.11 H new ATOM 0 HA3 GLY B 65 -18.973 0.062 -8.779 1.00 1.11 H new ATOM 2831 N GLU B 66 -17.474 -1.370 -11.291 1.00 1.04 N ATOM 2832 CA GLU B 66 -16.217 -1.962 -11.729 1.00 1.02 C ATOM 2833 C GLU B 66 -15.067 -1.017 -11.409 1.00 0.98 C ATOM 2834 O GLU B 66 -13.923 -1.441 -11.224 1.00 0.95 O ATOM 2835 CB GLU B 66 -16.270 -2.280 -13.226 1.00 1.10 C ATOM 2836 CG GLU B 66 -17.345 -3.293 -13.594 1.00 1.36 C ATOM 2837 CD GLU B 66 -17.280 -4.552 -12.753 1.00 1.66 C ATOM 2838 OE1 GLU B 66 -16.451 -5.438 -13.058 1.00 2.08 O ATOM 2839 OE2 GLU B 66 -18.062 -4.671 -11.787 1.00 2.08 O ATOM 0 H GLU B 66 -18.118 -1.139 -12.047 1.00 1.04 H new ATOM 0 HA GLU B 66 -16.055 -2.899 -11.196 1.00 1.02 H new ATOM 0 HB2 GLU B 66 -16.447 -1.358 -13.779 1.00 1.10 H new ATOM 0 HB3 GLU B 66 -15.299 -2.661 -13.543 1.00 1.10 H new ATOM 0 HG2 GLU B 66 -18.326 -2.833 -13.476 1.00 1.36 H new ATOM 0 HG3 GLU B 66 -17.242 -3.559 -14.646 1.00 1.36 H new ATOM 2846 N GLU B 67 -15.391 0.267 -11.312 1.00 1.00 N ATOM 2847 CA GLU B 67 -14.416 1.288 -10.973 1.00 1.01 C ATOM 2848 C GLU B 67 -13.916 1.050 -9.553 1.00 0.97 C ATOM 2849 O GLU B 67 -12.742 1.253 -9.247 1.00 0.95 O ATOM 2850 CB GLU B 67 -15.056 2.675 -11.074 1.00 1.10 C ATOM 2851 CG GLU B 67 -15.836 2.903 -12.362 1.00 1.53 C ATOM 2852 CD GLU B 67 -14.948 3.357 -13.499 1.00 1.81 C ATOM 2853 OE1 GLU B 67 -14.269 2.506 -14.103 1.00 2.44 O ATOM 2854 OE2 GLU B 67 -14.930 4.571 -13.791 1.00 2.28 O ATOM 0 H GLU B 67 -16.334 0.625 -11.466 1.00 1.00 H new ATOM 0 HA GLU B 67 -13.578 1.237 -11.668 1.00 1.01 H new ATOM 0 HB2 GLU B 67 -15.725 2.818 -10.226 1.00 1.10 H new ATOM 0 HB3 GLU B 67 -14.275 3.431 -10.995 1.00 1.10 H new ATOM 0 HG2 GLU B 67 -16.342 1.980 -12.646 1.00 1.53 H new ATOM 0 HG3 GLU B 67 -16.610 3.651 -12.188 1.00 1.53 H new ATOM 2861 N ARG B 68 -14.826 0.586 -8.699 1.00 0.98 N ATOM 2862 CA ARG B 68 -14.509 0.291 -7.307 1.00 0.99 C ATOM 2863 C ARG B 68 -13.567 -0.907 -7.244 1.00 0.95 C ATOM 2864 O ARG B 68 -12.667 -0.971 -6.404 1.00 0.95 O ATOM 2865 CB ARG B 68 -15.802 0.017 -6.528 1.00 1.04 C ATOM 2866 CG ARG B 68 -15.592 -0.439 -5.094 1.00 1.10 C ATOM 2867 CD ARG B 68 -16.915 -0.837 -4.458 1.00 1.41 C ATOM 2868 NE ARG B 68 -16.763 -1.322 -3.082 1.00 1.59 N ATOM 2869 CZ ARG B 68 -16.418 -2.571 -2.758 1.00 1.88 C ATOM 2870 NH1 ARG B 68 -16.183 -3.472 -3.709 1.00 2.30 N ATOM 2871 NH2 ARG B 68 -16.332 -2.927 -1.483 1.00 2.17 N ATOM 0 H ARG B 68 -15.797 0.405 -8.952 1.00 0.98 H new ATOM 0 HA ARG B 68 -14.012 1.147 -6.851 1.00 0.99 H new ATOM 0 HB2 ARG B 68 -16.406 0.924 -6.522 1.00 1.04 H new ATOM 0 HB3 ARG B 68 -16.375 -0.744 -7.057 1.00 1.04 H new ATOM 0 HG2 ARG B 68 -14.904 -1.284 -5.073 1.00 1.10 H new ATOM 0 HG3 ARG B 68 -15.131 0.362 -4.516 1.00 1.10 H new ATOM 0 HD2 ARG B 68 -17.588 0.021 -4.464 1.00 1.41 H new ATOM 0 HD3 ARG B 68 -17.384 -1.614 -5.062 1.00 1.41 H new ATOM 0 HE ARG B 68 -16.932 -0.662 -2.323 1.00 1.59 H new ATOM 0 HH11 ARG B 68 -16.266 -3.210 -4.691 1.00 2.30 H new ATOM 0 HH12 ARG B 68 -15.920 -4.424 -3.455 1.00 2.30 H new ATOM 0 HH21 ARG B 68 -16.529 -2.247 -0.749 1.00 2.17 H new ATOM 0 HH22 ARG B 68 -16.068 -3.881 -1.237 1.00 2.17 H new ATOM 2885 N LYS B 69 -13.762 -1.840 -8.171 1.00 0.94 N ATOM 2886 CA LYS B 69 -12.929 -3.033 -8.247 1.00 0.94 C ATOM 2887 C LYS B 69 -11.519 -2.660 -8.680 1.00 0.89 C ATOM 2888 O LYS B 69 -10.546 -3.268 -8.243 1.00 0.88 O ATOM 2889 CB LYS B 69 -13.519 -4.039 -9.230 1.00 1.00 C ATOM 2890 CG LYS B 69 -14.715 -4.803 -8.681 1.00 1.28 C ATOM 2891 CD LYS B 69 -15.418 -5.600 -9.769 1.00 1.46 C ATOM 2892 CE LYS B 69 -14.459 -6.536 -10.488 1.00 1.55 C ATOM 2893 NZ LYS B 69 -15.124 -7.279 -11.587 1.00 1.70 N ATOM 0 H LYS B 69 -14.492 -1.791 -8.882 1.00 0.94 H new ATOM 0 HA LYS B 69 -12.893 -3.489 -7.258 1.00 0.94 H new ATOM 0 HB2 LYS B 69 -13.820 -3.514 -10.137 1.00 1.00 H new ATOM 0 HB3 LYS B 69 -12.745 -4.751 -9.516 1.00 1.00 H new ATOM 0 HG2 LYS B 69 -14.385 -5.477 -7.891 1.00 1.28 H new ATOM 0 HG3 LYS B 69 -15.418 -4.103 -8.230 1.00 1.28 H new ATOM 0 HD2 LYS B 69 -16.230 -6.179 -9.329 1.00 1.46 H new ATOM 0 HD3 LYS B 69 -15.867 -4.916 -10.489 1.00 1.46 H new ATOM 0 HE2 LYS B 69 -13.626 -5.961 -10.892 1.00 1.55 H new ATOM 0 HE3 LYS B 69 -14.040 -7.244 -9.773 1.00 1.55 H new ATOM 0 HZ1 LYS B 69 -14.448 -7.942 -12.017 1.00 1.70 H new ATOM 0 HZ2 LYS B 69 -15.934 -7.809 -11.207 1.00 1.70 H new ATOM 0 HZ3 LYS B 69 -15.457 -6.608 -12.308 1.00 1.70 H new ATOM 2907 N LEU B 70 -11.417 -1.650 -9.542 1.00 0.89 N ATOM 2908 CA LEU B 70 -10.122 -1.186 -10.022 1.00 0.87 C ATOM 2909 C LEU B 70 -9.283 -0.676 -8.858 1.00 0.83 C ATOM 2910 O LEU B 70 -8.073 -0.898 -8.802 1.00 0.82 O ATOM 2911 CB LEU B 70 -10.301 -0.077 -11.061 1.00 0.91 C ATOM 2912 CG LEU B 70 -9.022 0.355 -11.783 1.00 0.96 C ATOM 2913 CD1 LEU B 70 -8.571 -0.728 -12.759 1.00 1.04 C ATOM 2914 CD2 LEU B 70 -9.239 1.679 -12.508 1.00 1.04 C ATOM 0 H LEU B 70 -12.215 -1.140 -9.920 1.00 0.89 H new ATOM 0 HA LEU B 70 -9.607 -2.024 -10.491 1.00 0.87 H new ATOM 0 HB2 LEU B 70 -11.023 -0.412 -11.805 1.00 0.91 H new ATOM 0 HB3 LEU B 70 -10.732 0.794 -10.568 1.00 0.91 H new ATOM 0 HG LEU B 70 -8.236 0.498 -11.042 1.00 0.96 H new ATOM 0 HD11 LEU B 70 -7.661 -0.406 -13.265 1.00 1.04 H new ATOM 0 HD12 LEU B 70 -8.376 -1.651 -12.213 1.00 1.04 H new ATOM 0 HD13 LEU B 70 -9.354 -0.901 -13.497 1.00 1.04 H new ATOM 0 HD21 LEU B 70 -8.320 1.971 -13.016 1.00 1.04 H new ATOM 0 HD22 LEU B 70 -10.038 1.566 -13.241 1.00 1.04 H new ATOM 0 HD23 LEU B 70 -9.515 2.448 -11.786 1.00 1.04 H new ATOM 2926 N TYR B 71 -9.945 -0.009 -7.917 1.00 0.84 N ATOM 2927 CA TYR B 71 -9.273 0.531 -6.742 1.00 0.84 C ATOM 2928 C TYR B 71 -8.833 -0.600 -5.825 1.00 0.83 C ATOM 2929 O TYR B 71 -7.767 -0.538 -5.210 1.00 0.82 O ATOM 2930 CB TYR B 71 -10.184 1.510 -5.995 1.00 0.91 C ATOM 2931 CG TYR B 71 -10.651 2.672 -6.847 1.00 0.92 C ATOM 2932 CD1 TYR B 71 -9.787 3.316 -7.723 1.00 0.93 C ATOM 2933 CD2 TYR B 71 -11.969 3.110 -6.787 1.00 1.01 C ATOM 2934 CE1 TYR B 71 -10.223 4.362 -8.512 1.00 1.00 C ATOM 2935 CE2 TYR B 71 -12.408 4.156 -7.571 1.00 1.09 C ATOM 2936 CZ TYR B 71 -11.534 4.777 -8.432 1.00 1.07 C ATOM 2937 OH TYR B 71 -11.973 5.816 -9.215 1.00 1.19 O ATOM 0 H TYR B 71 -10.949 0.170 -7.947 1.00 0.84 H new ATOM 0 HA TYR B 71 -8.389 1.079 -7.070 1.00 0.84 H new ATOM 0 HB2 TYR B 71 -11.055 0.971 -5.622 1.00 0.91 H new ATOM 0 HB3 TYR B 71 -9.652 1.898 -5.126 1.00 0.91 H new ATOM 0 HD1 TYR B 71 -8.758 2.994 -7.788 1.00 0.93 H new ATOM 0 HD2 TYR B 71 -12.660 2.623 -6.115 1.00 1.01 H new ATOM 0 HE1 TYR B 71 -9.539 4.853 -9.189 1.00 1.00 H new ATOM 0 HE2 TYR B 71 -13.434 4.486 -7.509 1.00 1.09 H new ATOM 0 HH TYR B 71 -12.922 5.981 -9.037 1.00 1.19 H new ATOM 2947 N ASP B 72 -9.652 -1.644 -5.764 1.00 0.86 N ATOM 2948 CA ASP B 72 -9.353 -2.805 -4.937 1.00 0.88 C ATOM 2949 C ASP B 72 -8.110 -3.510 -5.468 1.00 0.85 C ATOM 2950 O ASP B 72 -7.250 -3.936 -4.698 1.00 0.85 O ATOM 2951 CB ASP B 72 -10.542 -3.772 -4.923 1.00 0.95 C ATOM 2952 CG ASP B 72 -10.313 -4.965 -4.009 1.00 1.07 C ATOM 2953 OD1 ASP B 72 -9.698 -5.951 -4.462 1.00 1.32 O ATOM 2954 OD2 ASP B 72 -10.755 -4.926 -2.840 1.00 1.31 O ATOM 0 H ASP B 72 -10.530 -1.709 -6.279 1.00 0.86 H new ATOM 0 HA ASP B 72 -9.166 -2.472 -3.916 1.00 0.88 H new ATOM 0 HB2 ASP B 72 -11.436 -3.238 -4.601 1.00 0.95 H new ATOM 0 HB3 ASP B 72 -10.730 -4.126 -5.937 1.00 0.95 H new ATOM 2959 N SER B 73 -8.012 -3.607 -6.795 1.00 0.84 N ATOM 2960 CA SER B 73 -6.867 -4.244 -7.434 1.00 0.83 C ATOM 2961 C SER B 73 -5.598 -3.439 -7.171 1.00 0.79 C ATOM 2962 O SER B 73 -4.494 -3.983 -7.155 1.00 0.78 O ATOM 2963 CB SER B 73 -7.107 -4.371 -8.938 1.00 0.86 C ATOM 2964 OG SER B 73 -8.365 -4.967 -9.210 1.00 0.91 O ATOM 0 H SER B 73 -8.713 -3.252 -7.445 1.00 0.84 H new ATOM 0 HA SER B 73 -6.742 -5.241 -7.012 1.00 0.83 H new ATOM 0 HB2 SER B 73 -7.062 -3.385 -9.400 1.00 0.86 H new ATOM 0 HB3 SER B 73 -6.314 -4.970 -9.386 1.00 0.86 H new ATOM 0 HG SER B 73 -9.079 -4.322 -9.026 1.00 0.91 H new ATOM 2970 N ALA B 74 -5.765 -2.138 -6.955 1.00 0.79 N ATOM 2971 CA ALA B 74 -4.642 -1.262 -6.669 1.00 0.78 C ATOM 2972 C ALA B 74 -4.022 -1.639 -5.329 1.00 0.74 C ATOM 2973 O ALA B 74 -2.805 -1.595 -5.159 1.00 0.72 O ATOM 2974 CB ALA B 74 -5.082 0.193 -6.667 1.00 0.81 C ATOM 0 H ALA B 74 -6.671 -1.669 -6.973 1.00 0.79 H new ATOM 0 HA ALA B 74 -3.892 -1.384 -7.451 1.00 0.78 H new ATOM 0 HB1 ALA B 74 -4.226 0.832 -6.451 1.00 0.81 H new ATOM 0 HB2 ALA B 74 -5.490 0.451 -7.644 1.00 0.81 H new ATOM 0 HB3 ALA B 74 -5.847 0.341 -5.904 1.00 0.81 H new ATOM 2980 N LEU B 75 -4.875 -2.035 -4.388 1.00 0.76 N ATOM 2981 CA LEU B 75 -4.426 -2.440 -3.065 1.00 0.76 C ATOM 2982 C LEU B 75 -3.664 -3.765 -3.154 1.00 0.73 C ATOM 2983 O LEU B 75 -2.699 -3.992 -2.425 1.00 0.71 O ATOM 2984 CB LEU B 75 -5.624 -2.571 -2.114 1.00 0.81 C ATOM 2985 CG LEU B 75 -5.396 -2.080 -0.678 1.00 0.89 C ATOM 2986 CD1 LEU B 75 -4.436 -2.996 0.065 1.00 1.13 C ATOM 2987 CD2 LEU B 75 -4.875 -0.650 -0.673 1.00 1.14 C ATOM 0 H LEU B 75 -5.885 -2.083 -4.521 1.00 0.76 H new ATOM 0 HA LEU B 75 -3.755 -1.677 -2.670 1.00 0.76 H new ATOM 0 HB2 LEU B 75 -6.462 -2.018 -2.538 1.00 0.81 H new ATOM 0 HB3 LEU B 75 -5.921 -3.619 -2.076 1.00 0.81 H new ATOM 0 HG LEU B 75 -6.356 -2.100 -0.162 1.00 0.89 H new ATOM 0 HD11 LEU B 75 -4.292 -2.626 1.080 1.00 1.13 H new ATOM 0 HD12 LEU B 75 -4.850 -4.004 0.102 1.00 1.13 H new ATOM 0 HD13 LEU B 75 -3.477 -3.016 -0.454 1.00 1.13 H new ATOM 0 HD21 LEU B 75 -4.721 -0.323 0.355 1.00 1.14 H new ATOM 0 HD22 LEU B 75 -3.930 -0.605 -1.214 1.00 1.14 H new ATOM 0 HD23 LEU B 75 -5.601 0.003 -1.157 1.00 1.14 H new ATOM 2999 N SER B 76 -4.099 -4.630 -4.064 1.00 0.75 N ATOM 3000 CA SER B 76 -3.456 -5.921 -4.264 1.00 0.75 C ATOM 3001 C SER B 76 -2.003 -5.733 -4.706 1.00 0.72 C ATOM 3002 O SER B 76 -1.110 -6.481 -4.296 1.00 0.72 O ATOM 3003 CB SER B 76 -4.244 -6.732 -5.294 1.00 0.81 C ATOM 3004 OG SER B 76 -5.639 -6.642 -5.047 1.00 0.91 O ATOM 0 H SER B 76 -4.897 -4.458 -4.676 1.00 0.75 H new ATOM 0 HA SER B 76 -3.448 -6.469 -3.322 1.00 0.75 H new ATOM 0 HB2 SER B 76 -4.024 -6.367 -6.297 1.00 0.81 H new ATOM 0 HB3 SER B 76 -3.931 -7.775 -5.259 1.00 0.81 H new ATOM 0 HG SER B 76 -6.124 -7.166 -5.718 1.00 0.91 H new ATOM 3010 N LYS B 77 -1.773 -4.720 -5.541 1.00 0.72 N ATOM 3011 CA LYS B 77 -0.437 -4.407 -6.019 1.00 0.71 C ATOM 3012 C LYS B 77 0.403 -3.841 -4.882 1.00 0.67 C ATOM 3013 O LYS B 77 1.609 -4.062 -4.820 1.00 0.66 O ATOM 3014 CB LYS B 77 -0.494 -3.419 -7.185 1.00 0.75 C ATOM 3015 CG LYS B 77 -0.653 -4.093 -8.542 1.00 0.93 C ATOM 3016 CD LYS B 77 -1.934 -3.667 -9.249 1.00 1.09 C ATOM 3017 CE LYS B 77 -1.871 -2.210 -9.680 1.00 1.34 C ATOM 3018 NZ LYS B 77 -2.756 -1.930 -10.843 1.00 1.68 N ATOM 0 H LYS B 77 -2.502 -4.103 -5.899 1.00 0.72 H new ATOM 0 HA LYS B 77 0.027 -5.326 -6.378 1.00 0.71 H new ATOM 0 HB2 LYS B 77 -1.326 -2.732 -7.029 1.00 0.75 H new ATOM 0 HB3 LYS B 77 0.417 -2.821 -7.189 1.00 0.75 H new ATOM 0 HG2 LYS B 77 0.204 -3.850 -9.169 1.00 0.93 H new ATOM 0 HG3 LYS B 77 -0.655 -5.175 -8.410 1.00 0.93 H new ATOM 0 HD2 LYS B 77 -2.097 -4.299 -10.122 1.00 1.09 H new ATOM 0 HD3 LYS B 77 -2.785 -3.815 -8.584 1.00 1.09 H new ATOM 0 HE2 LYS B 77 -2.159 -1.573 -8.844 1.00 1.34 H new ATOM 0 HE3 LYS B 77 -0.843 -1.953 -9.937 1.00 1.34 H new ATOM 0 HZ1 LYS B 77 -2.681 -0.926 -11.102 1.00 1.68 H new ATOM 0 HZ2 LYS B 77 -2.466 -2.518 -11.650 1.00 1.68 H new ATOM 0 HZ3 LYS B 77 -3.741 -2.150 -10.591 1.00 1.68 H new ATOM 3032 N ILE B 78 -0.253 -3.112 -3.979 1.00 0.66 N ATOM 3033 CA ILE B 78 0.415 -2.538 -2.813 1.00 0.64 C ATOM 3034 C ILE B 78 0.996 -3.663 -1.961 1.00 0.63 C ATOM 3035 O ILE B 78 2.110 -3.576 -1.445 1.00 0.64 O ATOM 3036 CB ILE B 78 -0.574 -1.700 -1.963 1.00 0.67 C ATOM 3037 CG1 ILE B 78 -0.900 -0.376 -2.662 1.00 0.90 C ATOM 3038 CG2 ILE B 78 -0.024 -1.449 -0.565 1.00 0.79 C ATOM 3039 CD1 ILE B 78 0.182 0.675 -2.530 1.00 1.15 C ATOM 0 H ILE B 78 -1.250 -2.905 -4.034 1.00 0.66 H new ATOM 0 HA ILE B 78 1.213 -1.880 -3.158 1.00 0.64 H new ATOM 0 HB ILE B 78 -1.496 -2.272 -1.861 1.00 0.67 H new ATOM 0 HG12 ILE B 78 -1.076 -0.570 -3.720 1.00 0.90 H new ATOM 0 HG13 ILE B 78 -1.829 0.020 -2.251 1.00 0.90 H new ATOM 0 HG21 ILE B 78 -0.740 -0.859 0.007 1.00 0.79 H new ATOM 0 HG22 ILE B 78 0.144 -2.402 -0.063 1.00 0.79 H new ATOM 0 HG23 ILE B 78 0.918 -0.906 -0.637 1.00 0.79 H new ATOM 0 HD11 ILE B 78 -0.126 1.581 -3.052 1.00 1.15 H new ATOM 0 HD12 ILE B 78 0.344 0.900 -1.476 1.00 1.15 H new ATOM 0 HD13 ILE B 78 1.108 0.301 -2.967 1.00 1.15 H new ATOM 3051 N GLU B 79 0.218 -4.729 -1.848 1.00 0.65 N ATOM 3052 CA GLU B 79 0.609 -5.905 -1.089 1.00 0.67 C ATOM 3053 C GLU B 79 1.867 -6.524 -1.691 1.00 0.67 C ATOM 3054 O GLU B 79 2.728 -7.032 -0.974 1.00 0.70 O ATOM 3055 CB GLU B 79 -0.538 -6.914 -1.087 1.00 0.71 C ATOM 3056 CG GLU B 79 -0.313 -8.099 -0.163 1.00 0.77 C ATOM 3057 CD GLU B 79 -0.443 -9.423 -0.883 1.00 1.10 C ATOM 3058 OE1 GLU B 79 -1.297 -9.534 -1.787 1.00 1.74 O ATOM 3059 OE2 GLU B 79 0.314 -10.358 -0.561 1.00 1.59 O ATOM 0 H GLU B 79 -0.703 -4.802 -2.281 1.00 0.65 H new ATOM 0 HA GLU B 79 0.828 -5.616 -0.061 1.00 0.67 H new ATOM 0 HB2 GLU B 79 -1.456 -6.405 -0.793 1.00 0.71 H new ATOM 0 HB3 GLU B 79 -0.688 -7.281 -2.102 1.00 0.71 H new ATOM 0 HG2 GLU B 79 0.679 -8.026 0.282 1.00 0.77 H new ATOM 0 HG3 GLU B 79 -1.033 -8.061 0.655 1.00 0.77 H new ATOM 3066 N LYS B 80 1.974 -6.457 -3.017 1.00 0.67 N ATOM 3067 CA LYS B 80 3.133 -7.000 -3.719 1.00 0.69 C ATOM 3068 C LYS B 80 4.375 -6.199 -3.354 1.00 0.68 C ATOM 3069 O LYS B 80 5.467 -6.753 -3.225 1.00 0.72 O ATOM 3070 CB LYS B 80 2.921 -6.981 -5.238 1.00 0.72 C ATOM 3071 CG LYS B 80 1.664 -7.704 -5.701 1.00 0.79 C ATOM 3072 CD LYS B 80 1.763 -9.209 -5.501 1.00 1.18 C ATOM 3073 CE LYS B 80 1.049 -9.662 -4.232 1.00 1.78 C ATOM 3074 NZ LYS B 80 -0.412 -9.371 -4.271 1.00 2.05 N ATOM 0 H LYS B 80 1.273 -6.033 -3.625 1.00 0.67 H new ATOM 0 HA LYS B 80 3.266 -8.037 -3.412 1.00 0.69 H new ATOM 0 HB2 LYS B 80 2.876 -5.945 -5.574 1.00 0.72 H new ATOM 0 HB3 LYS B 80 3.787 -7.435 -5.720 1.00 0.72 H new ATOM 0 HG2 LYS B 80 0.803 -7.322 -5.152 1.00 0.79 H new ATOM 0 HG3 LYS B 80 1.491 -7.489 -6.756 1.00 0.79 H new ATOM 0 HD2 LYS B 80 1.331 -9.719 -6.362 1.00 1.18 H new ATOM 0 HD3 LYS B 80 2.812 -9.500 -5.451 1.00 1.18 H new ATOM 0 HE2 LYS B 80 1.200 -10.733 -4.095 1.00 1.78 H new ATOM 0 HE3 LYS B 80 1.494 -9.164 -3.370 1.00 1.78 H new ATOM 0 HZ1 LYS B 80 -0.879 -9.829 -3.462 1.00 2.05 H new ATOM 0 HZ2 LYS B 80 -0.563 -8.343 -4.221 1.00 2.05 H new ATOM 0 HZ3 LYS B 80 -0.815 -9.738 -5.157 1.00 2.05 H new ATOM 3088 N LEU B 81 4.187 -4.892 -3.174 1.00 0.65 N ATOM 3089 CA LEU B 81 5.274 -3.995 -2.801 1.00 0.67 C ATOM 3090 C LEU B 81 5.802 -4.378 -1.425 1.00 0.68 C ATOM 3091 O LEU B 81 7.006 -4.331 -1.171 1.00 0.72 O ATOM 3092 CB LEU B 81 4.788 -2.541 -2.800 1.00 0.67 C ATOM 3093 CG LEU B 81 5.601 -1.572 -3.665 1.00 0.78 C ATOM 3094 CD1 LEU B 81 7.016 -1.427 -3.129 1.00 1.02 C ATOM 3095 CD2 LEU B 81 5.627 -2.028 -5.118 1.00 0.97 C ATOM 0 H LEU B 81 3.284 -4.431 -3.282 1.00 0.65 H new ATOM 0 HA LEU B 81 6.079 -4.087 -3.530 1.00 0.67 H new ATOM 0 HB2 LEU B 81 3.753 -2.522 -3.140 1.00 0.67 H new ATOM 0 HB3 LEU B 81 4.793 -2.175 -1.773 1.00 0.67 H new ATOM 0 HG LEU B 81 5.115 -0.597 -3.622 1.00 0.78 H new ATOM 0 HD11 LEU B 81 7.574 -0.735 -3.759 1.00 1.02 H new ATOM 0 HD12 LEU B 81 6.981 -1.043 -2.109 1.00 1.02 H new ATOM 0 HD13 LEU B 81 7.508 -2.399 -3.134 1.00 1.02 H new ATOM 0 HD21 LEU B 81 6.210 -1.323 -5.710 1.00 0.97 H new ATOM 0 HD22 LEU B 81 6.081 -3.017 -5.181 1.00 0.97 H new ATOM 0 HD23 LEU B 81 4.609 -2.071 -5.504 1.00 0.97 H new ATOM 3107 N ILE B 82 4.887 -4.776 -0.546 1.00 0.68 N ATOM 3108 CA ILE B 82 5.245 -5.201 0.798 1.00 0.72 C ATOM 3109 C ILE B 82 6.087 -6.473 0.724 1.00 0.77 C ATOM 3110 O ILE B 82 7.056 -6.649 1.470 1.00 0.81 O ATOM 3111 CB ILE B 82 3.984 -5.451 1.661 1.00 0.72 C ATOM 3112 CG1 ILE B 82 3.106 -4.192 1.683 1.00 0.70 C ATOM 3113 CG2 ILE B 82 4.371 -5.871 3.073 1.00 0.78 C ATOM 3114 CD1 ILE B 82 1.900 -4.281 2.601 1.00 0.72 C ATOM 0 H ILE B 82 3.887 -4.812 -0.745 1.00 0.68 H new ATOM 0 HA ILE B 82 5.822 -4.405 1.269 1.00 0.72 H new ATOM 0 HB ILE B 82 3.411 -6.266 1.218 1.00 0.72 H new ATOM 0 HG12 ILE B 82 3.718 -3.343 1.989 1.00 0.70 H new ATOM 0 HG13 ILE B 82 2.761 -3.987 0.670 1.00 0.70 H new ATOM 0 HG21 ILE B 82 3.470 -6.041 3.662 1.00 0.78 H new ATOM 0 HG22 ILE B 82 4.957 -6.789 3.032 1.00 0.78 H new ATOM 0 HG23 ILE B 82 4.964 -5.083 3.537 1.00 0.78 H new ATOM 0 HD11 ILE B 82 1.337 -3.349 2.554 1.00 0.72 H new ATOM 0 HD12 ILE B 82 1.262 -5.106 2.285 1.00 0.72 H new ATOM 0 HD13 ILE B 82 2.234 -4.452 3.624 1.00 0.72 H new ATOM 3126 N GLU B 83 5.723 -7.348 -0.201 1.00 0.78 N ATOM 3127 CA GLU B 83 6.436 -8.598 -0.398 1.00 0.85 C ATOM 3128 C GLU B 83 7.804 -8.344 -1.029 1.00 0.87 C ATOM 3129 O GLU B 83 8.719 -9.153 -0.896 1.00 0.94 O ATOM 3130 CB GLU B 83 5.618 -9.546 -1.273 1.00 0.88 C ATOM 3131 CG GLU B 83 5.740 -11.001 -0.861 1.00 1.11 C ATOM 3132 CD GLU B 83 5.001 -11.299 0.427 1.00 1.73 C ATOM 3133 OE1 GLU B 83 5.523 -10.972 1.514 1.00 2.41 O ATOM 3134 OE2 GLU B 83 3.889 -11.864 0.356 1.00 2.25 O ATOM 0 H GLU B 83 4.932 -7.213 -0.831 1.00 0.78 H new ATOM 0 HA GLU B 83 6.586 -9.063 0.576 1.00 0.85 H new ATOM 0 HB2 GLU B 83 4.569 -9.251 -1.233 1.00 0.88 H new ATOM 0 HB3 GLU B 83 5.940 -9.441 -2.309 1.00 0.88 H new ATOM 0 HG2 GLU B 83 5.349 -11.635 -1.656 1.00 1.11 H new ATOM 0 HG3 GLU B 83 6.793 -11.255 -0.740 1.00 1.11 H new ATOM 3141 N THR B 84 7.930 -7.223 -1.737 1.00 0.83 N ATOM 3142 CA THR B 84 9.183 -6.864 -2.386 1.00 0.87 C ATOM 3143 C THR B 84 10.207 -6.380 -1.357 1.00 0.91 C ATOM 3144 O THR B 84 11.411 -6.585 -1.513 1.00 0.98 O ATOM 3145 CB THR B 84 8.971 -5.762 -3.454 1.00 0.84 C ATOM 3146 OG1 THR B 84 7.872 -6.105 -4.313 1.00 0.84 O ATOM 3147 CG2 THR B 84 10.221 -5.565 -4.300 1.00 0.87 C ATOM 0 H THR B 84 7.177 -6.549 -1.874 1.00 0.83 H new ATOM 0 HA THR B 84 9.560 -7.761 -2.878 1.00 0.87 H new ATOM 0 HB THR B 84 8.752 -4.833 -2.928 1.00 0.84 H new ATOM 0 HG1 THR B 84 7.048 -6.157 -3.785 1.00 0.84 H new ATOM 0 HG21 THR B 84 10.040 -4.785 -5.040 1.00 0.87 H new ATOM 0 HG22 THR B 84 11.052 -5.271 -3.659 1.00 0.87 H new ATOM 0 HG23 THR B 84 10.467 -6.497 -4.808 1.00 0.87 H new ATOM 3155 N LEU B 85 9.719 -5.734 -0.299 1.00 0.90 N ATOM 3156 CA LEU B 85 10.590 -5.219 0.752 1.00 0.98 C ATOM 3157 C LEU B 85 11.137 -6.355 1.610 1.00 1.07 C ATOM 3158 O LEU B 85 12.250 -6.272 2.132 1.00 1.22 O ATOM 3159 CB LEU B 85 9.837 -4.221 1.632 1.00 0.97 C ATOM 3160 CG LEU B 85 9.506 -2.886 0.959 1.00 0.91 C ATOM 3161 CD1 LEU B 85 8.572 -2.063 1.833 1.00 1.03 C ATOM 3162 CD2 LEU B 85 10.783 -2.112 0.662 1.00 1.01 C ATOM 0 H LEU B 85 8.726 -5.556 -0.149 1.00 0.90 H new ATOM 0 HA LEU B 85 11.427 -4.710 0.274 1.00 0.98 H new ATOM 0 HB2 LEU B 85 8.908 -4.683 1.966 1.00 0.97 H new ATOM 0 HB3 LEU B 85 10.433 -4.024 2.523 1.00 0.97 H new ATOM 0 HG LEU B 85 8.999 -3.090 0.016 1.00 0.91 H new ATOM 0 HD11 LEU B 85 8.349 -1.118 1.338 1.00 1.03 H new ATOM 0 HD12 LEU B 85 7.646 -2.615 1.997 1.00 1.03 H new ATOM 0 HD13 LEU B 85 9.051 -1.865 2.792 1.00 1.03 H new ATOM 0 HD21 LEU B 85 10.532 -1.165 0.184 1.00 1.01 H new ATOM 0 HD22 LEU B 85 11.316 -1.918 1.593 1.00 1.01 H new ATOM 0 HD23 LEU B 85 11.417 -2.698 -0.004 1.00 1.01 H new ATOM 3174 N SER B 86 10.344 -7.408 1.758 1.00 1.08 N ATOM 3175 CA SER B 86 10.748 -8.568 2.537 1.00 1.20 C ATOM 3176 C SER B 86 10.344 -9.848 1.809 1.00 1.59 C ATOM 3177 O SER B 86 9.337 -10.472 2.147 1.00 2.11 O ATOM 3178 CB SER B 86 10.121 -8.521 3.935 1.00 1.48 C ATOM 3179 OG SER B 86 9.646 -7.220 4.244 1.00 1.78 O ATOM 0 H SER B 86 9.414 -7.481 1.346 1.00 1.08 H new ATOM 0 HA SER B 86 11.832 -8.556 2.651 1.00 1.20 H new ATOM 0 HB2 SER B 86 9.298 -9.234 3.991 1.00 1.48 H new ATOM 0 HB3 SER B 86 10.858 -8.827 4.677 1.00 1.48 H new ATOM 0 HG SER B 86 9.250 -7.221 5.140 1.00 1.78 H new