USER MOD reduce.3.24.130724 H: found=0, std=0, add=1344, rem=0, adj=43 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: B 42 SER OG : rot 180:sc= 1.07 USER MOD Set 1.2: B 46 LYS NZ :NH3+ -127:sc= 1.2 (180deg=0) USER MOD Set 2.1: B 35 LYS NZ :NH3+ -159:sc= 1.05 (180deg=-0.00996) USER MOD Set 2.2: B 62 TYR OH : rot -1:sc= 1.66 USER MOD Single : A 6 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 7 THR OG1 : rot 180:sc= 0.102 USER MOD Single : A 9 ASN : amide:sc= 0 X(o=0,f=-0.46) USER MOD Single : A 10 LYS NZ :NH3+ -160:sc= 1.15 (180deg=0.524) USER MOD Single : A 15 LYS NZ :NH3+ 153:sc= 1.23 (180deg=1.15) USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 SER OG : rot 80:sc= 0.904 USER MOD Single : A 25 LYS NZ :NH3+ 170:sc= 0 (180deg=-0.0628) USER MOD Single : A 26 LYS NZ :NH3+ 144:sc= 1.27 (180deg=1.06) USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 SER OG : rot 75:sc= 0.96 USER MOD Single : A 39 ASN : amide:sc= -0.0398 K(o=-0.04,f=-0.59) USER MOD Single : A 42 SER OG : rot 75:sc= 1.25 USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 LYS NZ :NH3+ 178:sc= 1.24 (180deg=1.2) USER MOD Single : A 47 THR OG1 : rot 180:sc= 0.0529 USER MOD Single : A 50 GLN : amide:sc= -0.0149 X(o=-0.015,f=-0.015) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 ASN : amide:sc= 1.04 K(o=1,f=-0.037) USER MOD Single : A 57 LYS NZ :NH3+ 144:sc= -0.703 (180deg=-1.21) USER MOD Single : A 62 TYR OH : rot 180:sc= 0 USER MOD Single : A 63 THR OG1 : rot 78:sc= 1.24 USER MOD Single : A 64 TYR OH : rot 180:sc= 0 USER MOD Single : A 69 LYS NZ :NH3+ -171:sc= 1.15 (180deg=1.09) USER MOD Single : A 71 TYR OH : rot 180:sc= -0.0979 USER MOD Single : A 73 SER OG : rot 76:sc= 0.635 USER MOD Single : A 76 SER OG : rot -170:sc= -0.588 USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 LYS NZ :NH3+ 159:sc= -0.208 (180deg=-0.732) USER MOD Single : A 84 THR OG1 : rot 77:sc= 1.25 USER MOD Single : A 86 SER OG : rot 180:sc= 0 USER MOD Single : B 10 LYS NZ :NH3+ -169:sc= 1.28 (180deg=1) USER MOD Single : B 15 LYS NZ :NH3+ -111:sc= 1.27 (180deg=-0.243) USER MOD Single : B 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 19 SER OG : rot 88:sc= 1.27 USER MOD Single : B 25 LYS NZ :NH3+ -169:sc=-0.00855 (180deg=-0.169) USER MOD Single : B 26 LYS NZ :NH3+ 174:sc= 1.29 (180deg=1.13) USER MOD Single : B 37 SER OG : rot 71:sc= 0.22 USER MOD Single : B 39 ASN : amide:sc= 1.09 K(o=1.1,f=-0.45) USER MOD Single : B 44 LYS NZ :NH3+ -113:sc= 1.95 (180deg=0.423) USER MOD Single : B 47 THR OG1 : rot -87:sc= 1.09 USER MOD Single : B 50 GLN : amide:sc= -0.259! X(o=-0.26!,f=-0.23) USER MOD Single : B 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 56 ASN : amide:sc= 0.203 X(o=0.2,f=-0.057) USER MOD Single : B 57 LYS NZ :NH3+ 151:sc= 0.948 (180deg=0.0209!) USER MOD Single : B 63 THR OG1 : rot 75:sc= 0.707 USER MOD Single : B 64 TYR OH : rot 180:sc= 0 USER MOD Single : B 69 LYS NZ :NH3+ -141:sc= 1.28 (180deg=-0.302) USER MOD Single : B 71 TYR OH : rot 180:sc= 0 USER MOD Single : B 73 SER OG : rot 74:sc= 1.11 USER MOD Single : B 76 SER OG : rot 180:sc= 0 USER MOD Single : B 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 80 LYS NZ :NH3+ 162:sc= -0.0582 (180deg=-0.354) USER MOD Single : B 84 THR OG1 : rot 64:sc= 1.13 USER MOD Single : B 86 SER OG : rot 173:sc= 1.11 USER MOD ----------------------------------------------------------------- ATOM 77 N GLN A 6 -20.971 14.710 -10.019 1.00 1.91 N ATOM 78 CA GLN A 6 -20.588 13.305 -10.046 1.00 1.87 C ATOM 79 C GLN A 6 -19.367 13.058 -10.930 1.00 1.83 C ATOM 80 O GLN A 6 -18.482 12.300 -10.552 1.00 1.77 O ATOM 81 CB GLN A 6 -21.756 12.426 -10.504 1.00 1.89 C ATOM 82 CG GLN A 6 -22.326 12.815 -11.855 1.00 1.95 C ATOM 83 CD GLN A 6 -23.198 11.737 -12.453 1.00 1.96 C ATOM 84 OE1 GLN A 6 -24.408 11.709 -12.234 1.00 2.22 O ATOM 85 NE2 GLN A 6 -22.592 10.845 -13.215 1.00 2.13 N ATOM 0 HA GLN A 6 -20.319 13.033 -9.025 1.00 1.87 H new ATOM 0 HB2 GLN A 6 -21.423 11.389 -10.546 1.00 1.89 H new ATOM 0 HB3 GLN A 6 -22.549 12.476 -9.758 1.00 1.89 H new ATOM 0 HG2 GLN A 6 -22.908 13.730 -11.749 1.00 1.95 H new ATOM 0 HG3 GLN A 6 -21.507 13.036 -12.540 1.00 1.95 H new ATOM 0 HE21 GLN A 6 -21.586 10.906 -13.370 1.00 2.13 H new ATOM 0 HE22 GLN A 6 -23.130 10.095 -13.649 1.00 2.13 H new ATOM 94 N THR A 7 -19.306 13.706 -12.090 1.00 1.86 N ATOM 95 CA THR A 7 -18.182 13.507 -13.001 1.00 1.83 C ATOM 96 C THR A 7 -16.892 14.121 -12.460 1.00 1.79 C ATOM 97 O THR A 7 -15.840 13.474 -12.442 1.00 1.71 O ATOM 98 CB THR A 7 -18.478 14.095 -14.397 1.00 1.88 C ATOM 99 OG1 THR A 7 -19.502 15.095 -14.299 1.00 2.15 O ATOM 100 CG2 THR A 7 -18.910 12.996 -15.363 1.00 1.95 C ATOM 0 H THR A 7 -20.011 14.365 -12.419 1.00 1.86 H new ATOM 0 HA THR A 7 -18.045 12.429 -13.087 1.00 1.83 H new ATOM 0 HB THR A 7 -17.567 14.553 -14.781 1.00 1.88 H new ATOM 0 HG1 THR A 7 -19.684 15.465 -15.188 1.00 2.15 H new ATOM 0 HG21 THR A 7 -19.114 13.431 -16.341 1.00 1.95 H new ATOM 0 HG22 THR A 7 -18.114 12.257 -15.453 1.00 1.95 H new ATOM 0 HG23 THR A 7 -19.811 12.513 -14.985 1.00 1.95 H new ATOM 108 N ARG A 8 -16.985 15.362 -12.004 1.00 1.84 N ATOM 109 CA ARG A 8 -15.829 16.077 -11.479 1.00 1.82 C ATOM 110 C ARG A 8 -15.262 15.387 -10.238 1.00 1.75 C ATOM 111 O ARG A 8 -14.044 15.231 -10.116 1.00 1.69 O ATOM 112 CB ARG A 8 -16.214 17.533 -11.174 1.00 1.94 C ATOM 113 CG ARG A 8 -15.118 18.372 -10.521 1.00 2.03 C ATOM 114 CD ARG A 8 -13.769 18.230 -11.217 1.00 2.06 C ATOM 115 NE ARG A 8 -13.857 18.309 -12.675 1.00 2.06 N ATOM 116 CZ ARG A 8 -13.362 17.378 -13.497 1.00 2.08 C ATOM 117 NH1 ARG A 8 -12.821 16.269 -13.005 1.00 2.10 N ATOM 118 NH2 ARG A 8 -13.420 17.548 -14.809 1.00 2.22 N ATOM 0 H ARG A 8 -17.853 15.897 -11.987 1.00 1.84 H new ATOM 0 HA ARG A 8 -15.045 16.071 -12.236 1.00 1.82 H new ATOM 0 HB2 ARG A 8 -16.513 18.016 -12.105 1.00 1.94 H new ATOM 0 HB3 ARG A 8 -17.087 17.532 -10.521 1.00 1.94 H new ATOM 0 HG2 ARG A 8 -15.417 19.420 -10.529 1.00 2.03 H new ATOM 0 HG3 ARG A 8 -15.015 18.077 -9.477 1.00 2.03 H new ATOM 0 HD2 ARG A 8 -13.099 19.011 -10.858 1.00 2.06 H new ATOM 0 HD3 ARG A 8 -13.323 17.275 -10.938 1.00 2.06 H new ATOM 0 HE ARG A 8 -14.321 19.118 -13.087 1.00 2.06 H new ATOM 0 HH11 ARG A 8 -12.782 16.125 -11.996 1.00 2.10 H new ATOM 0 HH12 ARG A 8 -12.445 15.562 -13.636 1.00 2.10 H new ATOM 0 HH21 ARG A 8 -13.843 18.392 -15.196 1.00 2.22 H new ATOM 0 HH22 ARG A 8 -13.041 16.835 -15.433 1.00 2.22 H new ATOM 132 N ASN A 9 -16.139 14.961 -9.341 1.00 1.76 N ATOM 133 CA ASN A 9 -15.711 14.294 -8.114 1.00 1.72 C ATOM 134 C ASN A 9 -15.153 12.902 -8.410 1.00 1.61 C ATOM 135 O ASN A 9 -14.150 12.488 -7.824 1.00 1.56 O ATOM 136 CB ASN A 9 -16.876 14.192 -7.125 1.00 1.78 C ATOM 137 CG ASN A 9 -16.431 13.712 -5.758 1.00 1.75 C ATOM 138 OD1 ASN A 9 -15.382 14.113 -5.255 1.00 1.75 O ATOM 139 ND2 ASN A 9 -17.229 12.855 -5.143 1.00 1.84 N ATOM 0 H ASN A 9 -17.149 15.064 -9.437 1.00 1.76 H new ATOM 0 HA ASN A 9 -14.918 14.894 -7.667 1.00 1.72 H new ATOM 0 HB2 ASN A 9 -17.353 15.167 -7.027 1.00 1.78 H new ATOM 0 HB3 ASN A 9 -17.627 13.508 -7.521 1.00 1.78 H new ATOM 0 HD21 ASN A 9 -16.983 12.503 -4.218 1.00 1.84 H new ATOM 0 HD22 ASN A 9 -18.090 12.547 -5.594 1.00 1.84 H new ATOM 146 N LYS A 10 -15.796 12.195 -9.332 1.00 1.60 N ATOM 147 CA LYS A 10 -15.379 10.847 -9.716 1.00 1.52 C ATOM 148 C LYS A 10 -13.935 10.837 -10.212 1.00 1.47 C ATOM 149 O LYS A 10 -13.122 10.021 -9.779 1.00 1.41 O ATOM 150 CB LYS A 10 -16.298 10.315 -10.816 1.00 1.53 C ATOM 151 CG LYS A 10 -15.889 8.960 -11.367 1.00 1.59 C ATOM 152 CD LYS A 10 -16.355 7.831 -10.461 1.00 1.70 C ATOM 153 CE LYS A 10 -15.919 6.473 -10.980 1.00 2.07 C ATOM 154 NZ LYS A 10 -16.355 6.240 -12.380 1.00 2.48 N ATOM 0 H LYS A 10 -16.617 12.535 -9.833 1.00 1.60 H new ATOM 0 HA LYS A 10 -15.446 10.208 -8.835 1.00 1.52 H new ATOM 0 HB2 LYS A 10 -17.313 10.244 -10.424 1.00 1.53 H new ATOM 0 HB3 LYS A 10 -16.322 11.035 -11.634 1.00 1.53 H new ATOM 0 HG2 LYS A 10 -16.311 8.828 -12.363 1.00 1.59 H new ATOM 0 HG3 LYS A 10 -14.805 8.920 -11.473 1.00 1.59 H new ATOM 0 HD2 LYS A 10 -15.956 7.982 -9.458 1.00 1.70 H new ATOM 0 HD3 LYS A 10 -17.442 7.857 -10.379 1.00 1.70 H new ATOM 0 HE2 LYS A 10 -14.833 6.395 -10.922 1.00 2.07 H new ATOM 0 HE3 LYS A 10 -16.329 5.692 -10.339 1.00 2.07 H new ATOM 0 HZ1 LYS A 10 -16.347 5.220 -12.581 1.00 2.48 H new ATOM 0 HZ2 LYS A 10 -17.318 6.611 -12.510 1.00 2.48 H new ATOM 0 HZ3 LYS A 10 -15.706 6.726 -13.031 1.00 2.48 H new ATOM 168 N GLU A 11 -13.621 11.758 -11.110 1.00 1.52 N ATOM 169 CA GLU A 11 -12.281 11.851 -11.663 1.00 1.50 C ATOM 170 C GLU A 11 -11.291 12.306 -10.600 1.00 1.45 C ATOM 171 O GLU A 11 -10.124 11.920 -10.625 1.00 1.38 O ATOM 172 CB GLU A 11 -12.261 12.818 -12.846 1.00 1.58 C ATOM 173 CG GLU A 11 -11.095 12.589 -13.792 1.00 1.63 C ATOM 174 CD GLU A 11 -10.770 13.805 -14.632 1.00 1.77 C ATOM 175 OE1 GLU A 11 -11.623 14.710 -14.736 1.00 1.96 O ATOM 176 OE2 GLU A 11 -9.658 13.868 -15.193 1.00 1.90 O ATOM 0 H GLU A 11 -14.277 12.451 -11.471 1.00 1.52 H new ATOM 0 HA GLU A 11 -11.986 10.861 -12.011 1.00 1.50 H new ATOM 0 HB2 GLU A 11 -13.194 12.721 -13.401 1.00 1.58 H new ATOM 0 HB3 GLU A 11 -12.219 13.840 -12.470 1.00 1.58 H new ATOM 0 HG2 GLU A 11 -10.215 12.307 -13.214 1.00 1.63 H new ATOM 0 HG3 GLU A 11 -11.326 11.751 -14.449 1.00 1.63 H new ATOM 183 N LEU A 12 -11.766 13.114 -9.657 1.00 1.51 N ATOM 184 CA LEU A 12 -10.921 13.621 -8.583 1.00 1.50 C ATOM 185 C LEU A 12 -10.366 12.476 -7.739 1.00 1.40 C ATOM 186 O LEU A 12 -9.154 12.325 -7.614 1.00 1.33 O ATOM 187 CB LEU A 12 -11.705 14.592 -7.693 1.00 1.62 C ATOM 188 CG LEU A 12 -10.912 15.205 -6.531 1.00 1.65 C ATOM 189 CD1 LEU A 12 -9.788 16.088 -7.052 1.00 1.69 C ATOM 190 CD2 LEU A 12 -11.838 15.998 -5.622 1.00 1.82 C ATOM 0 H LEU A 12 -12.734 13.432 -9.616 1.00 1.51 H new ATOM 0 HA LEU A 12 -10.086 14.154 -9.038 1.00 1.50 H new ATOM 0 HB2 LEU A 12 -12.088 15.400 -8.316 1.00 1.62 H new ATOM 0 HB3 LEU A 12 -12.569 14.067 -7.285 1.00 1.62 H new ATOM 0 HG LEU A 12 -10.466 14.396 -5.953 1.00 1.65 H new ATOM 0 HD11 LEU A 12 -9.239 16.512 -6.211 1.00 1.69 H new ATOM 0 HD12 LEU A 12 -9.111 15.492 -7.664 1.00 1.69 H new ATOM 0 HD13 LEU A 12 -10.208 16.893 -7.655 1.00 1.69 H new ATOM 0 HD21 LEU A 12 -11.263 16.427 -4.802 1.00 1.82 H new ATOM 0 HD22 LEU A 12 -12.310 16.798 -6.192 1.00 1.82 H new ATOM 0 HD23 LEU A 12 -12.606 15.338 -5.220 1.00 1.82 H new ATOM 202 N LEU A 13 -11.257 11.661 -7.186 1.00 1.41 N ATOM 203 CA LEU A 13 -10.841 10.541 -6.346 1.00 1.35 C ATOM 204 C LEU A 13 -10.046 9.506 -7.143 1.00 1.23 C ATOM 205 O LEU A 13 -9.130 8.872 -6.616 1.00 1.18 O ATOM 206 CB LEU A 13 -12.054 9.889 -5.663 1.00 1.43 C ATOM 207 CG LEU A 13 -13.271 9.625 -6.557 1.00 1.43 C ATOM 208 CD1 LEU A 13 -13.227 8.215 -7.124 1.00 1.81 C ATOM 209 CD2 LEU A 13 -14.564 9.842 -5.779 1.00 1.76 C ATOM 0 H LEU A 13 -12.266 11.753 -7.302 1.00 1.41 H new ATOM 0 HA LEU A 13 -10.184 10.937 -5.572 1.00 1.35 H new ATOM 0 HB2 LEU A 13 -11.735 8.941 -5.229 1.00 1.43 H new ATOM 0 HB3 LEU A 13 -12.367 10.528 -4.837 1.00 1.43 H new ATOM 0 HG LEU A 13 -13.242 10.331 -7.387 1.00 1.43 H new ATOM 0 HD11 LEU A 13 -14.100 8.049 -7.755 1.00 1.81 H new ATOM 0 HD12 LEU A 13 -12.321 8.089 -7.717 1.00 1.81 H new ATOM 0 HD13 LEU A 13 -13.228 7.494 -6.307 1.00 1.81 H new ATOM 0 HD21 LEU A 13 -15.417 9.650 -6.430 1.00 1.76 H new ATOM 0 HD22 LEU A 13 -14.596 9.161 -4.929 1.00 1.76 H new ATOM 0 HD23 LEU A 13 -14.605 10.871 -5.421 1.00 1.76 H new ATOM 221 N LEU A 14 -10.382 9.355 -8.418 1.00 1.21 N ATOM 222 CA LEU A 14 -9.700 8.399 -9.278 1.00 1.13 C ATOM 223 C LEU A 14 -8.244 8.809 -9.488 1.00 1.11 C ATOM 224 O LEU A 14 -7.326 8.016 -9.266 1.00 1.04 O ATOM 225 CB LEU A 14 -10.421 8.295 -10.625 1.00 1.16 C ATOM 226 CG LEU A 14 -10.064 7.068 -11.467 1.00 1.09 C ATOM 227 CD1 LEU A 14 -10.605 5.802 -10.823 1.00 1.11 C ATOM 228 CD2 LEU A 14 -10.612 7.220 -12.875 1.00 1.23 C ATOM 0 H LEU A 14 -11.123 9.883 -8.879 1.00 1.21 H new ATOM 0 HA LEU A 14 -9.716 7.423 -8.793 1.00 1.13 H new ATOM 0 HB2 LEU A 14 -11.496 8.290 -10.443 1.00 1.16 H new ATOM 0 HB3 LEU A 14 -10.200 9.190 -11.206 1.00 1.16 H new ATOM 0 HG LEU A 14 -8.978 6.989 -11.520 1.00 1.09 H new ATOM 0 HD11 LEU A 14 -10.341 4.940 -11.436 1.00 1.11 H new ATOM 0 HD12 LEU A 14 -10.173 5.686 -9.829 1.00 1.11 H new ATOM 0 HD13 LEU A 14 -11.690 5.870 -10.741 1.00 1.11 H new ATOM 0 HD21 LEU A 14 -10.351 6.341 -13.464 1.00 1.23 H new ATOM 0 HD22 LEU A 14 -11.697 7.321 -12.834 1.00 1.23 H new ATOM 0 HD23 LEU A 14 -10.182 8.108 -13.339 1.00 1.23 H new ATOM 240 N LYS A 15 -8.040 10.055 -9.899 1.00 1.19 N ATOM 241 CA LYS A 15 -6.698 10.576 -10.138 1.00 1.19 C ATOM 242 C LYS A 15 -5.885 10.586 -8.850 1.00 1.14 C ATOM 243 O LYS A 15 -4.701 10.260 -8.852 1.00 1.09 O ATOM 244 CB LYS A 15 -6.762 11.996 -10.704 1.00 1.32 C ATOM 245 CG LYS A 15 -7.342 12.083 -12.107 1.00 1.56 C ATOM 246 CD LYS A 15 -7.691 13.520 -12.472 1.00 1.68 C ATOM 247 CE LYS A 15 -6.709 14.111 -13.470 1.00 1.70 C ATOM 248 NZ LYS A 15 -7.037 13.730 -14.868 1.00 1.93 N ATOM 0 H LYS A 15 -8.788 10.725 -10.074 1.00 1.19 H new ATOM 0 HA LYS A 15 -6.213 9.922 -10.863 1.00 1.19 H new ATOM 0 HB2 LYS A 15 -7.362 12.614 -10.036 1.00 1.32 H new ATOM 0 HB3 LYS A 15 -5.757 12.417 -10.712 1.00 1.32 H new ATOM 0 HG2 LYS A 15 -6.624 11.687 -12.825 1.00 1.56 H new ATOM 0 HG3 LYS A 15 -8.235 11.461 -12.173 1.00 1.56 H new ATOM 0 HD2 LYS A 15 -8.697 13.553 -12.891 1.00 1.68 H new ATOM 0 HD3 LYS A 15 -7.701 14.131 -11.569 1.00 1.68 H new ATOM 0 HE2 LYS A 15 -6.711 15.197 -13.381 1.00 1.70 H new ATOM 0 HE3 LYS A 15 -5.701 13.773 -13.230 1.00 1.70 H new ATOM 0 HZ1 LYS A 15 -6.683 14.460 -15.519 1.00 1.93 H new ATOM 0 HZ2 LYS A 15 -6.590 12.819 -15.094 1.00 1.93 H new ATOM 0 HZ3 LYS A 15 -8.068 13.644 -14.972 1.00 1.93 H new ATOM 262 N LYS A 16 -6.540 10.943 -7.751 1.00 1.17 N ATOM 263 CA LYS A 16 -5.885 11.022 -6.450 1.00 1.16 C ATOM 264 C LYS A 16 -5.304 9.678 -6.007 1.00 1.04 C ATOM 265 O LYS A 16 -4.150 9.610 -5.574 1.00 1.05 O ATOM 266 CB LYS A 16 -6.871 11.530 -5.394 1.00 1.26 C ATOM 267 CG LYS A 16 -7.024 13.042 -5.377 1.00 1.32 C ATOM 268 CD LYS A 16 -5.846 13.717 -4.694 1.00 1.30 C ATOM 269 CE LYS A 16 -5.883 13.505 -3.191 1.00 1.50 C ATOM 270 NZ LYS A 16 -4.627 13.945 -2.535 1.00 1.62 N ATOM 0 H LYS A 16 -7.531 11.184 -7.736 1.00 1.17 H new ATOM 0 HA LYS A 16 -5.055 11.721 -6.552 1.00 1.16 H new ATOM 0 HB2 LYS A 16 -7.846 11.077 -5.573 1.00 1.26 H new ATOM 0 HB3 LYS A 16 -6.540 11.196 -4.411 1.00 1.26 H new ATOM 0 HG2 LYS A 16 -7.113 13.411 -6.399 1.00 1.32 H new ATOM 0 HG3 LYS A 16 -7.946 13.309 -4.861 1.00 1.32 H new ATOM 0 HD2 LYS A 16 -4.914 13.320 -5.096 1.00 1.30 H new ATOM 0 HD3 LYS A 16 -5.859 14.785 -4.913 1.00 1.30 H new ATOM 0 HE2 LYS A 16 -6.724 14.054 -2.768 1.00 1.50 H new ATOM 0 HE3 LYS A 16 -6.052 12.449 -2.978 1.00 1.50 H new ATOM 0 HZ1 LYS A 16 -4.695 13.782 -1.510 1.00 1.62 H new ATOM 0 HZ2 LYS A 16 -3.827 13.403 -2.919 1.00 1.62 H new ATOM 0 HZ3 LYS A 16 -4.478 14.958 -2.716 1.00 1.62 H new ATOM 284 N ILE A 17 -6.087 8.614 -6.127 1.00 0.96 N ATOM 285 CA ILE A 17 -5.636 7.288 -5.709 1.00 0.88 C ATOM 286 C ILE A 17 -4.627 6.697 -6.699 1.00 0.85 C ATOM 287 O ILE A 17 -3.647 6.066 -6.293 1.00 0.83 O ATOM 288 CB ILE A 17 -6.830 6.320 -5.520 1.00 0.85 C ATOM 289 CG1 ILE A 17 -7.760 6.859 -4.428 1.00 1.01 C ATOM 290 CG2 ILE A 17 -6.345 4.917 -5.167 1.00 0.89 C ATOM 291 CD1 ILE A 17 -8.939 5.966 -4.120 1.00 1.02 C ATOM 0 H ILE A 17 -7.033 8.640 -6.508 1.00 0.96 H new ATOM 0 HA ILE A 17 -5.137 7.411 -4.748 1.00 0.88 H new ATOM 0 HB ILE A 17 -7.380 6.255 -6.459 1.00 0.85 H new ATOM 0 HG12 ILE A 17 -7.183 7.007 -3.515 1.00 1.01 H new ATOM 0 HG13 ILE A 17 -8.130 7.838 -4.733 1.00 1.01 H new ATOM 0 HG21 ILE A 17 -7.203 4.257 -5.040 1.00 0.89 H new ATOM 0 HG22 ILE A 17 -5.712 4.538 -5.969 1.00 0.89 H new ATOM 0 HG23 ILE A 17 -5.773 4.952 -4.240 1.00 0.89 H new ATOM 0 HD11 ILE A 17 -9.545 6.421 -3.337 1.00 1.02 H new ATOM 0 HD12 ILE A 17 -9.543 5.838 -5.018 1.00 1.02 H new ATOM 0 HD13 ILE A 17 -8.580 4.994 -3.782 1.00 1.02 H new ATOM 303 N ASP A 18 -4.845 6.926 -7.989 1.00 0.90 N ATOM 304 CA ASP A 18 -3.948 6.402 -9.019 1.00 0.93 C ATOM 305 C ASP A 18 -2.540 6.974 -8.866 1.00 0.93 C ATOM 306 O ASP A 18 -1.542 6.288 -9.084 1.00 0.93 O ATOM 307 CB ASP A 18 -4.502 6.715 -10.410 1.00 1.04 C ATOM 308 CG ASP A 18 -3.963 5.777 -11.468 1.00 1.20 C ATOM 309 OD1 ASP A 18 -4.146 4.551 -11.327 1.00 1.66 O ATOM 310 OD2 ASP A 18 -3.376 6.257 -12.460 1.00 1.62 O ATOM 0 H ASP A 18 -5.631 7.468 -8.348 1.00 0.90 H new ATOM 0 HA ASP A 18 -3.886 5.321 -8.898 1.00 0.93 H new ATOM 0 HB2 ASP A 18 -5.590 6.648 -10.389 1.00 1.04 H new ATOM 0 HB3 ASP A 18 -4.251 7.742 -10.676 1.00 1.04 H new ATOM 315 N SER A 19 -2.467 8.240 -8.492 1.00 0.99 N ATOM 316 CA SER A 19 -1.191 8.910 -8.294 1.00 1.03 C ATOM 317 C SER A 19 -0.543 8.466 -6.986 1.00 0.96 C ATOM 318 O SER A 19 0.681 8.444 -6.861 1.00 0.96 O ATOM 319 CB SER A 19 -1.376 10.426 -8.308 1.00 1.17 C ATOM 320 OG SER A 19 -2.008 10.853 -9.508 1.00 1.28 O ATOM 0 H SER A 19 -3.282 8.829 -8.318 1.00 0.99 H new ATOM 0 HA SER A 19 -0.530 8.632 -9.115 1.00 1.03 H new ATOM 0 HB2 SER A 19 -1.975 10.730 -7.450 1.00 1.17 H new ATOM 0 HB3 SER A 19 -0.407 10.915 -8.210 1.00 1.17 H new ATOM 0 HG SER A 19 -2.975 10.708 -9.438 1.00 1.28 H new ATOM 326 N LEU A 20 -1.379 8.119 -6.017 1.00 0.92 N ATOM 327 CA LEU A 20 -0.917 7.680 -4.709 1.00 0.90 C ATOM 328 C LEU A 20 0.014 6.476 -4.829 1.00 0.84 C ATOM 329 O LEU A 20 1.119 6.473 -4.284 1.00 0.86 O ATOM 330 CB LEU A 20 -2.125 7.340 -3.837 1.00 0.92 C ATOM 331 CG LEU A 20 -1.819 6.596 -2.542 1.00 1.01 C ATOM 332 CD1 LEU A 20 -1.451 7.587 -1.451 1.00 1.37 C ATOM 333 CD2 LEU A 20 -3.017 5.750 -2.149 1.00 1.14 C ATOM 0 H LEU A 20 -2.394 8.134 -6.116 1.00 0.92 H new ATOM 0 HA LEU A 20 -0.350 8.487 -4.246 1.00 0.90 H new ATOM 0 HB2 LEU A 20 -2.642 8.267 -3.588 1.00 0.92 H new ATOM 0 HB3 LEU A 20 -2.816 6.737 -4.426 1.00 0.92 H new ATOM 0 HG LEU A 20 -0.967 5.932 -2.687 1.00 1.01 H new ATOM 0 HD11 LEU A 20 -1.234 7.049 -0.529 1.00 1.37 H new ATOM 0 HD12 LEU A 20 -0.571 8.154 -1.756 1.00 1.37 H new ATOM 0 HD13 LEU A 20 -2.284 8.271 -1.284 1.00 1.37 H new ATOM 0 HD21 LEU A 20 -2.799 5.218 -1.223 1.00 1.14 H new ATOM 0 HD22 LEU A 20 -3.884 6.394 -2.002 1.00 1.14 H new ATOM 0 HD23 LEU A 20 -3.229 5.030 -2.940 1.00 1.14 H new ATOM 345 N ILE A 21 -0.422 5.462 -5.572 1.00 0.80 N ATOM 346 CA ILE A 21 0.385 4.266 -5.760 1.00 0.79 C ATOM 347 C ILE A 21 1.617 4.573 -6.606 1.00 0.81 C ATOM 348 O ILE A 21 2.665 3.947 -6.440 1.00 0.83 O ATOM 349 CB ILE A 21 -0.422 3.115 -6.404 1.00 0.81 C ATOM 350 CG1 ILE A 21 -1.164 3.583 -7.661 1.00 1.06 C ATOM 351 CG2 ILE A 21 -1.401 2.530 -5.399 1.00 1.04 C ATOM 352 CD1 ILE A 21 -0.533 3.099 -8.949 1.00 1.23 C ATOM 0 H ILE A 21 -1.323 5.447 -6.049 1.00 0.80 H new ATOM 0 HA ILE A 21 0.701 3.938 -4.770 1.00 0.79 H new ATOM 0 HB ILE A 21 0.284 2.341 -6.704 1.00 0.81 H new ATOM 0 HG12 ILE A 21 -2.195 3.232 -7.616 1.00 1.06 H new ATOM 0 HG13 ILE A 21 -1.198 4.672 -7.669 1.00 1.06 H new ATOM 0 HG21 ILE A 21 -1.962 1.721 -5.866 1.00 1.04 H new ATOM 0 HG22 ILE A 21 -0.853 2.143 -4.540 1.00 1.04 H new ATOM 0 HG23 ILE A 21 -2.091 3.307 -5.069 1.00 1.04 H new ATOM 0 HD11 ILE A 21 -1.110 3.467 -9.798 1.00 1.23 H new ATOM 0 HD12 ILE A 21 0.489 3.471 -9.016 1.00 1.23 H new ATOM 0 HD13 ILE A 21 -0.524 2.009 -8.962 1.00 1.23 H new ATOM 364 N GLU A 22 1.489 5.551 -7.497 1.00 0.84 N ATOM 365 CA GLU A 22 2.596 5.956 -8.356 1.00 0.90 C ATOM 366 C GLU A 22 3.712 6.591 -7.534 1.00 0.90 C ATOM 367 O GLU A 22 4.891 6.401 -7.820 1.00 0.93 O ATOM 368 CB GLU A 22 2.108 6.929 -9.430 1.00 0.98 C ATOM 369 CG GLU A 22 1.741 6.243 -10.733 1.00 1.29 C ATOM 370 CD GLU A 22 2.957 5.930 -11.581 1.00 1.78 C ATOM 371 OE1 GLU A 22 3.523 6.867 -12.185 1.00 2.29 O ATOM 372 OE2 GLU A 22 3.351 4.750 -11.647 1.00 2.22 O ATOM 0 H GLU A 22 0.628 6.078 -7.643 1.00 0.84 H new ATOM 0 HA GLU A 22 2.993 5.066 -8.845 1.00 0.90 H new ATOM 0 HB2 GLU A 22 1.240 7.470 -9.054 1.00 0.98 H new ATOM 0 HB3 GLU A 22 2.885 7.668 -9.622 1.00 0.98 H new ATOM 0 HG2 GLU A 22 1.205 5.319 -10.516 1.00 1.29 H new ATOM 0 HG3 GLU A 22 1.061 6.881 -11.298 1.00 1.29 H new ATOM 379 N ALA A 23 3.330 7.341 -6.505 1.00 0.89 N ATOM 380 CA ALA A 23 4.297 7.995 -5.634 1.00 0.92 C ATOM 381 C ALA A 23 5.112 6.959 -4.871 1.00 0.88 C ATOM 382 O ALA A 23 6.333 7.076 -4.745 1.00 0.89 O ATOM 383 CB ALA A 23 3.597 8.943 -4.667 1.00 0.94 C ATOM 0 H ALA A 23 2.356 7.510 -6.255 1.00 0.89 H new ATOM 0 HA ALA A 23 4.976 8.581 -6.254 1.00 0.92 H new ATOM 0 HB1 ALA A 23 4.338 9.421 -4.026 1.00 0.94 H new ATOM 0 HB2 ALA A 23 3.059 9.705 -5.230 1.00 0.94 H new ATOM 0 HB3 ALA A 23 2.893 8.382 -4.052 1.00 0.94 H new ATOM 389 N ILE A 24 4.426 5.934 -4.383 1.00 0.86 N ATOM 390 CA ILE A 24 5.072 4.856 -3.641 1.00 0.85 C ATOM 391 C ILE A 24 5.945 4.023 -4.572 1.00 0.83 C ATOM 392 O ILE A 24 7.015 3.548 -4.188 1.00 0.83 O ATOM 393 CB ILE A 24 4.031 3.958 -2.938 1.00 0.87 C ATOM 394 CG1 ILE A 24 3.025 4.833 -2.182 1.00 1.12 C ATOM 395 CG2 ILE A 24 4.717 2.978 -1.995 1.00 1.03 C ATOM 396 CD1 ILE A 24 2.039 4.063 -1.328 1.00 1.05 C ATOM 0 H ILE A 24 3.417 5.825 -4.488 1.00 0.86 H new ATOM 0 HA ILE A 24 5.701 5.306 -2.873 1.00 0.85 H new ATOM 0 HB ILE A 24 3.496 3.376 -3.689 1.00 0.87 H new ATOM 0 HG12 ILE A 24 3.573 5.527 -1.545 1.00 1.12 H new ATOM 0 HG13 ILE A 24 2.470 5.433 -2.904 1.00 1.12 H new ATOM 0 HG21 ILE A 24 3.966 2.354 -1.509 1.00 1.03 H new ATOM 0 HG22 ILE A 24 5.402 2.347 -2.561 1.00 1.03 H new ATOM 0 HG23 ILE A 24 5.274 3.530 -1.238 1.00 1.03 H new ATOM 0 HD11 ILE A 24 1.366 4.761 -0.830 1.00 1.05 H new ATOM 0 HD12 ILE A 24 1.460 3.389 -1.959 1.00 1.05 H new ATOM 0 HD13 ILE A 24 2.580 3.484 -0.579 1.00 1.05 H new ATOM 408 N LYS A 25 5.475 3.866 -5.802 1.00 0.83 N ATOM 409 CA LYS A 25 6.204 3.123 -6.823 1.00 0.84 C ATOM 410 C LYS A 25 7.543 3.801 -7.102 1.00 0.86 C ATOM 411 O LYS A 25 8.550 3.138 -7.359 1.00 0.86 O ATOM 412 CB LYS A 25 5.364 3.038 -8.104 1.00 0.88 C ATOM 413 CG LYS A 25 6.102 2.467 -9.310 1.00 0.96 C ATOM 414 CD LYS A 25 6.477 1.007 -9.111 1.00 1.13 C ATOM 415 CE LYS A 25 6.953 0.373 -10.412 1.00 1.39 C ATOM 416 NZ LYS A 25 8.090 1.119 -11.018 1.00 1.61 N ATOM 0 H LYS A 25 4.584 4.247 -6.120 1.00 0.83 H new ATOM 0 HA LYS A 25 6.396 2.111 -6.465 1.00 0.84 H new ATOM 0 HB2 LYS A 25 4.486 2.423 -7.907 1.00 0.88 H new ATOM 0 HB3 LYS A 25 5.004 4.036 -8.354 1.00 0.88 H new ATOM 0 HG2 LYS A 25 5.475 2.562 -10.197 1.00 0.96 H new ATOM 0 HG3 LYS A 25 7.004 3.051 -9.493 1.00 0.96 H new ATOM 0 HD2 LYS A 25 7.262 0.931 -8.359 1.00 1.13 H new ATOM 0 HD3 LYS A 25 5.616 0.457 -8.730 1.00 1.13 H new ATOM 0 HE2 LYS A 25 7.256 -0.657 -10.223 1.00 1.39 H new ATOM 0 HE3 LYS A 25 6.126 0.337 -11.121 1.00 1.39 H new ATOM 0 HZ1 LYS A 25 8.490 0.565 -11.802 1.00 1.61 H new ATOM 0 HZ2 LYS A 25 7.752 2.035 -11.378 1.00 1.61 H new ATOM 0 HZ3 LYS A 25 8.823 1.279 -10.298 1.00 1.61 H new ATOM 430 N LYS A 26 7.545 5.126 -7.032 1.00 0.87 N ATOM 431 CA LYS A 26 8.752 5.905 -7.256 1.00 0.91 C ATOM 432 C LYS A 26 9.738 5.720 -6.105 1.00 0.90 C ATOM 433 O LYS A 26 10.945 5.657 -6.323 1.00 0.91 O ATOM 434 CB LYS A 26 8.404 7.389 -7.418 1.00 0.97 C ATOM 435 CG LYS A 26 8.144 7.798 -8.858 1.00 1.07 C ATOM 436 CD LYS A 26 9.255 8.687 -9.401 1.00 1.21 C ATOM 437 CE LYS A 26 10.622 8.031 -9.266 1.00 1.35 C ATOM 438 NZ LYS A 26 11.699 8.851 -9.875 1.00 1.42 N ATOM 0 H LYS A 26 6.718 5.685 -6.820 1.00 0.87 H new ATOM 0 HA LYS A 26 9.222 5.549 -8.173 1.00 0.91 H new ATOM 0 HB2 LYS A 26 7.521 7.614 -6.820 1.00 0.97 H new ATOM 0 HB3 LYS A 26 9.221 7.991 -7.020 1.00 0.97 H new ATOM 0 HG2 LYS A 26 8.055 6.907 -9.479 1.00 1.07 H new ATOM 0 HG3 LYS A 26 7.192 8.326 -8.920 1.00 1.07 H new ATOM 0 HD2 LYS A 26 9.061 8.911 -10.450 1.00 1.21 H new ATOM 0 HD3 LYS A 26 9.254 9.637 -8.867 1.00 1.21 H new ATOM 0 HE2 LYS A 26 10.843 7.869 -8.211 1.00 1.35 H new ATOM 0 HE3 LYS A 26 10.601 7.050 -9.741 1.00 1.35 H new ATOM 0 HZ1 LYS A 26 12.565 8.765 -9.306 1.00 1.42 H new ATOM 0 HZ2 LYS A 26 11.885 8.516 -10.842 1.00 1.42 H new ATOM 0 HZ3 LYS A 26 11.402 9.847 -9.905 1.00 1.42 H new ATOM 452 N ILE A 27 9.215 5.619 -4.884 1.00 0.88 N ATOM 453 CA ILE A 27 10.054 5.457 -3.697 1.00 0.89 C ATOM 454 C ILE A 27 10.935 4.208 -3.786 1.00 0.87 C ATOM 455 O ILE A 27 12.159 4.286 -3.644 1.00 0.90 O ATOM 456 CB ILE A 27 9.202 5.393 -2.406 1.00 0.90 C ATOM 457 CG1 ILE A 27 8.524 6.744 -2.143 1.00 0.90 C ATOM 458 CG2 ILE A 27 10.063 4.983 -1.219 1.00 0.93 C ATOM 459 CD1 ILE A 27 7.784 6.809 -0.820 1.00 1.31 C ATOM 0 H ILE A 27 8.214 5.646 -4.690 1.00 0.88 H new ATOM 0 HA ILE A 27 10.699 6.335 -3.655 1.00 0.89 H new ATOM 0 HB ILE A 27 8.425 4.641 -2.541 1.00 0.90 H new ATOM 0 HG12 ILE A 27 9.279 7.530 -2.166 1.00 0.90 H new ATOM 0 HG13 ILE A 27 7.823 6.952 -2.952 1.00 0.90 H new ATOM 0 HG21 ILE A 27 9.448 4.943 -0.320 1.00 0.93 H new ATOM 0 HG22 ILE A 27 10.496 4.001 -1.406 1.00 0.93 H new ATOM 0 HG23 ILE A 27 10.862 5.711 -1.080 1.00 0.93 H new ATOM 0 HD11 ILE A 27 7.331 7.794 -0.704 1.00 1.31 H new ATOM 0 HD12 ILE A 27 7.005 6.047 -0.801 1.00 1.31 H new ATOM 0 HD13 ILE A 27 8.484 6.633 -0.003 1.00 1.31 H new ATOM 471 N ILE A 28 10.309 3.062 -4.034 1.00 0.83 N ATOM 472 CA ILE A 28 11.033 1.798 -4.135 1.00 0.82 C ATOM 473 C ILE A 28 12.036 1.823 -5.295 1.00 0.83 C ATOM 474 O ILE A 28 13.114 1.233 -5.208 1.00 0.84 O ATOM 475 CB ILE A 28 10.064 0.594 -4.280 1.00 0.82 C ATOM 476 CG1 ILE A 28 10.819 -0.728 -4.114 1.00 0.88 C ATOM 477 CG2 ILE A 28 9.336 0.622 -5.621 1.00 0.88 C ATOM 478 CD1 ILE A 28 11.203 -1.045 -2.683 1.00 1.05 C ATOM 0 H ILE A 28 9.301 2.982 -4.169 1.00 0.83 H new ATOM 0 HA ILE A 28 11.588 1.671 -3.205 1.00 0.82 H new ATOM 0 HB ILE A 28 9.317 0.675 -3.490 1.00 0.82 H new ATOM 0 HG12 ILE A 28 10.201 -1.538 -4.501 1.00 0.88 H new ATOM 0 HG13 ILE A 28 11.722 -0.697 -4.723 1.00 0.88 H new ATOM 0 HG21 ILE A 28 8.666 -0.235 -5.689 1.00 0.88 H new ATOM 0 HG22 ILE A 28 8.758 1.542 -5.702 1.00 0.88 H new ATOM 0 HG23 ILE A 28 10.064 0.579 -6.431 1.00 0.88 H new ATOM 0 HD11 ILE A 28 11.734 -1.997 -2.651 1.00 1.05 H new ATOM 0 HD12 ILE A 28 11.848 -0.256 -2.296 1.00 1.05 H new ATOM 0 HD13 ILE A 28 10.303 -1.110 -2.071 1.00 1.05 H new ATOM 490 N ALA A 29 11.677 2.513 -6.374 1.00 0.84 N ATOM 491 CA ALA A 29 12.550 2.616 -7.535 1.00 0.87 C ATOM 492 C ALA A 29 13.811 3.407 -7.197 1.00 0.90 C ATOM 493 O ALA A 29 14.916 3.044 -7.611 1.00 0.93 O ATOM 494 CB ALA A 29 11.809 3.253 -8.700 1.00 0.90 C ATOM 0 H ALA A 29 10.790 3.007 -6.467 1.00 0.84 H new ATOM 0 HA ALA A 29 12.853 1.611 -7.828 1.00 0.87 H new ATOM 0 HB1 ALA A 29 12.475 3.323 -9.560 1.00 0.90 H new ATOM 0 HB2 ALA A 29 10.944 2.642 -8.959 1.00 0.90 H new ATOM 0 HB3 ALA A 29 11.476 4.251 -8.417 1.00 0.90 H new ATOM 500 N GLU A 30 13.638 4.485 -6.436 1.00 0.93 N ATOM 501 CA GLU A 30 14.755 5.331 -6.022 1.00 0.99 C ATOM 502 C GLU A 30 15.692 4.558 -5.100 1.00 0.99 C ATOM 503 O GLU A 30 16.912 4.664 -5.218 1.00 1.01 O ATOM 504 CB GLU A 30 14.247 6.584 -5.300 1.00 1.06 C ATOM 505 CG GLU A 30 13.365 7.484 -6.153 1.00 1.10 C ATOM 506 CD GLU A 30 14.109 8.124 -7.304 1.00 1.18 C ATOM 507 OE1 GLU A 30 15.034 8.920 -7.049 1.00 1.46 O ATOM 508 OE2 GLU A 30 13.765 7.846 -8.469 1.00 1.25 O ATOM 0 H GLU A 30 12.729 4.795 -6.092 1.00 0.93 H new ATOM 0 HA GLU A 30 15.299 5.634 -6.917 1.00 0.99 H new ATOM 0 HB2 GLU A 30 13.687 6.278 -4.416 1.00 1.06 H new ATOM 0 HB3 GLU A 30 15.104 7.160 -4.951 1.00 1.06 H new ATOM 0 HG2 GLU A 30 12.532 6.900 -6.546 1.00 1.10 H new ATOM 0 HG3 GLU A 30 12.938 8.266 -5.525 1.00 1.10 H new ATOM 515 N PHE A 31 15.108 3.776 -4.186 1.00 0.97 N ATOM 516 CA PHE A 31 15.885 2.976 -3.236 1.00 1.00 C ATOM 517 C PHE A 31 16.862 2.064 -3.967 1.00 0.97 C ATOM 518 O PHE A 31 18.029 1.948 -3.586 1.00 1.00 O ATOM 519 CB PHE A 31 14.958 2.137 -2.346 1.00 1.02 C ATOM 520 CG PHE A 31 14.613 2.794 -1.042 1.00 1.10 C ATOM 521 CD1 PHE A 31 15.596 3.071 -0.107 1.00 1.42 C ATOM 522 CD2 PHE A 31 13.305 3.133 -0.755 1.00 1.79 C ATOM 523 CE1 PHE A 31 15.275 3.672 1.097 1.00 1.58 C ATOM 524 CE2 PHE A 31 12.977 3.731 0.445 1.00 1.98 C ATOM 525 CZ PHE A 31 13.963 4.002 1.372 1.00 1.54 C ATOM 0 H PHE A 31 14.098 3.681 -4.085 1.00 0.97 H new ATOM 0 HA PHE A 31 16.451 3.663 -2.607 1.00 1.00 H new ATOM 0 HB2 PHE A 31 14.038 1.928 -2.891 1.00 1.02 H new ATOM 0 HB3 PHE A 31 15.434 1.178 -2.144 1.00 1.02 H new ATOM 0 HD1 PHE A 31 16.624 2.815 -0.320 1.00 1.42 H new ATOM 0 HD2 PHE A 31 12.530 2.928 -1.478 1.00 1.79 H new ATOM 0 HE1 PHE A 31 16.049 3.883 1.820 1.00 1.58 H new ATOM 0 HE2 PHE A 31 11.950 3.987 0.658 1.00 1.98 H new ATOM 0 HZ PHE A 31 13.709 4.471 2.311 1.00 1.54 H new ATOM 535 N ASP A 32 16.378 1.434 -5.027 1.00 0.93 N ATOM 536 CA ASP A 32 17.195 0.536 -5.827 1.00 0.92 C ATOM 537 C ASP A 32 18.353 1.292 -6.463 1.00 0.92 C ATOM 538 O ASP A 32 19.488 0.811 -6.472 1.00 0.93 O ATOM 539 CB ASP A 32 16.341 -0.141 -6.899 1.00 0.94 C ATOM 540 CG ASP A 32 17.166 -0.849 -7.948 1.00 1.15 C ATOM 541 OD1 ASP A 32 17.582 -1.999 -7.712 1.00 1.54 O ATOM 542 OD2 ASP A 32 17.376 -0.265 -9.029 1.00 1.45 O ATOM 0 H ASP A 32 15.417 1.530 -5.354 1.00 0.93 H new ATOM 0 HA ASP A 32 17.608 -0.234 -5.175 1.00 0.92 H new ATOM 0 HB2 ASP A 32 15.673 -0.859 -6.424 1.00 0.94 H new ATOM 0 HB3 ASP A 32 15.713 0.607 -7.382 1.00 0.94 H new ATOM 547 N VAL A 33 18.061 2.485 -6.968 1.00 0.93 N ATOM 548 CA VAL A 33 19.075 3.322 -7.600 1.00 0.95 C ATOM 549 C VAL A 33 20.162 3.695 -6.594 1.00 0.96 C ATOM 550 O VAL A 33 21.354 3.613 -6.892 1.00 0.97 O ATOM 551 CB VAL A 33 18.468 4.619 -8.191 1.00 0.99 C ATOM 552 CG1 VAL A 33 19.555 5.499 -8.796 1.00 1.06 C ATOM 553 CG2 VAL A 33 17.402 4.301 -9.231 1.00 0.98 C ATOM 0 H VAL A 33 17.127 2.896 -6.952 1.00 0.93 H new ATOM 0 HA VAL A 33 19.505 2.740 -8.415 1.00 0.95 H new ATOM 0 HB VAL A 33 17.995 5.166 -7.375 1.00 0.99 H new ATOM 0 HG11 VAL A 33 19.105 6.404 -9.205 1.00 1.06 H new ATOM 0 HG12 VAL A 33 20.276 5.769 -8.024 1.00 1.06 H new ATOM 0 HG13 VAL A 33 20.063 4.955 -9.592 1.00 1.06 H new ATOM 0 HG21 VAL A 33 16.993 5.230 -9.629 1.00 0.98 H new ATOM 0 HG22 VAL A 33 17.846 3.723 -10.042 1.00 0.98 H new ATOM 0 HG23 VAL A 33 16.603 3.722 -8.768 1.00 0.98 H new ATOM 563 N VAL A 34 19.734 4.088 -5.398 1.00 0.98 N ATOM 564 CA VAL A 34 20.654 4.474 -4.331 1.00 1.02 C ATOM 565 C VAL A 34 21.585 3.316 -3.968 1.00 1.02 C ATOM 566 O VAL A 34 22.768 3.520 -3.718 1.00 1.04 O ATOM 567 CB VAL A 34 19.895 4.950 -3.069 1.00 1.07 C ATOM 568 CG1 VAL A 34 20.860 5.233 -1.925 1.00 1.14 C ATOM 569 CG2 VAL A 34 19.071 6.197 -3.379 1.00 1.08 C ATOM 0 H VAL A 34 18.749 4.148 -5.142 1.00 0.98 H new ATOM 0 HA VAL A 34 21.250 5.306 -4.707 1.00 1.02 H new ATOM 0 HB VAL A 34 19.222 4.150 -2.761 1.00 1.07 H new ATOM 0 HG11 VAL A 34 20.300 5.566 -1.051 1.00 1.14 H new ATOM 0 HG12 VAL A 34 21.410 4.324 -1.680 1.00 1.14 H new ATOM 0 HG13 VAL A 34 21.561 6.012 -2.225 1.00 1.14 H new ATOM 0 HG21 VAL A 34 18.544 6.518 -2.480 1.00 1.08 H new ATOM 0 HG22 VAL A 34 19.732 6.995 -3.716 1.00 1.08 H new ATOM 0 HG23 VAL A 34 18.348 5.970 -4.162 1.00 1.08 H new ATOM 579 N LYS A 35 21.046 2.107 -3.963 1.00 1.00 N ATOM 580 CA LYS A 35 21.823 0.915 -3.645 1.00 1.02 C ATOM 581 C LYS A 35 22.993 0.751 -4.613 1.00 1.01 C ATOM 582 O LYS A 35 24.126 0.496 -4.208 1.00 1.04 O ATOM 583 CB LYS A 35 20.914 -0.314 -3.709 1.00 1.02 C ATOM 584 CG LYS A 35 21.640 -1.638 -3.535 1.00 1.06 C ATOM 585 CD LYS A 35 20.785 -2.792 -4.027 1.00 1.23 C ATOM 586 CE LYS A 35 21.574 -4.085 -4.102 1.00 1.45 C ATOM 587 NZ LYS A 35 21.000 -5.026 -5.100 1.00 1.92 N ATOM 0 H LYS A 35 20.066 1.923 -4.177 1.00 1.00 H new ATOM 0 HA LYS A 35 22.229 1.020 -2.639 1.00 1.02 H new ATOM 0 HB2 LYS A 35 20.150 -0.227 -2.936 1.00 1.02 H new ATOM 0 HB3 LYS A 35 20.397 -0.320 -4.669 1.00 1.02 H new ATOM 0 HG2 LYS A 35 22.581 -1.617 -4.085 1.00 1.06 H new ATOM 0 HG3 LYS A 35 21.888 -1.786 -2.484 1.00 1.06 H new ATOM 0 HD2 LYS A 35 19.933 -2.924 -3.359 1.00 1.23 H new ATOM 0 HD3 LYS A 35 20.384 -2.553 -5.012 1.00 1.23 H new ATOM 0 HE2 LYS A 35 22.609 -3.864 -4.364 1.00 1.45 H new ATOM 0 HE3 LYS A 35 21.588 -4.560 -3.121 1.00 1.45 H new ATOM 0 HZ1 LYS A 35 21.567 -5.898 -5.122 1.00 1.92 H new ATOM 0 HZ2 LYS A 35 20.021 -5.257 -4.837 1.00 1.92 H new ATOM 0 HZ3 LYS A 35 21.010 -4.583 -6.041 1.00 1.92 H new ATOM 601 N GLU A 36 22.711 0.908 -5.892 1.00 0.99 N ATOM 602 CA GLU A 36 23.734 0.777 -6.915 1.00 1.00 C ATOM 603 C GLU A 36 24.673 1.982 -6.907 1.00 0.99 C ATOM 604 O GLU A 36 25.885 1.842 -7.092 1.00 1.01 O ATOM 605 CB GLU A 36 23.086 0.624 -8.292 1.00 1.03 C ATOM 606 CG GLU A 36 21.994 -0.433 -8.352 1.00 1.31 C ATOM 607 CD GLU A 36 22.508 -1.835 -8.096 1.00 1.41 C ATOM 608 OE1 GLU A 36 23.686 -1.990 -7.714 1.00 1.44 O ATOM 609 OE2 GLU A 36 21.736 -2.798 -8.280 1.00 1.71 O ATOM 0 H GLU A 36 21.781 1.127 -6.249 1.00 0.99 H new ATOM 0 HA GLU A 36 24.322 -0.115 -6.697 1.00 1.00 H new ATOM 0 HB2 GLU A 36 22.664 1.584 -8.592 1.00 1.03 H new ATOM 0 HB3 GLU A 36 23.859 0.374 -9.019 1.00 1.03 H new ATOM 0 HG2 GLU A 36 21.225 -0.195 -7.617 1.00 1.31 H new ATOM 0 HG3 GLU A 36 21.519 -0.400 -9.332 1.00 1.31 H new ATOM 616 N SER A 37 24.119 3.147 -6.663 1.00 0.00 N ATOM 617 CA SER A 37 24.847 4.412 -6.643 1.00 0.00 C ATOM 618 C SER A 37 25.931 4.396 -5.590 1.00 0.00 C ATOM 619 O SER A 37 27.080 4.819 -5.841 1.00 0.00 O ATOM 620 CB SER A 37 23.878 5.604 -6.445 1.00 0.00 C ATOM 621 OG SER A 37 22.984 5.784 -7.549 1.00 0.00 O ATOM 0 H SER A 37 23.124 3.253 -6.467 1.00 0.00 H new ATOM 0 HA SER A 37 25.333 4.540 -7.610 1.00 0.00 H new ATOM 0 HB2 SER A 37 23.298 5.447 -5.536 1.00 0.00 H new ATOM 0 HB3 SER A 37 24.457 6.516 -6.300 1.00 0.00 H new ATOM 0 HG SER A 37 22.289 5.094 -7.523 1.00 0.00 H new ATOM 627 N VAL A 38 25.634 3.898 -4.386 1.00 1.03 N ATOM 628 CA VAL A 38 26.600 3.874 -3.293 1.00 1.06 C ATOM 629 C VAL A 38 27.680 2.821 -3.515 1.00 1.07 C ATOM 630 O VAL A 38 28.810 2.987 -3.060 1.00 1.09 O ATOM 631 CB VAL A 38 25.938 3.641 -1.912 1.00 1.10 C ATOM 632 CG1 VAL A 38 25.009 4.789 -1.557 1.00 1.12 C ATOM 633 CG2 VAL A 38 25.198 2.314 -1.870 1.00 1.10 C ATOM 0 H VAL A 38 24.724 3.504 -4.147 1.00 1.03 H new ATOM 0 HA VAL A 38 27.057 4.863 -3.289 1.00 1.06 H new ATOM 0 HB VAL A 38 26.732 3.602 -1.166 1.00 1.10 H new ATOM 0 HG11 VAL A 38 24.556 4.603 -0.583 1.00 1.12 H new ATOM 0 HG12 VAL A 38 25.577 5.719 -1.521 1.00 1.12 H new ATOM 0 HG13 VAL A 38 24.227 4.871 -2.311 1.00 1.12 H new ATOM 0 HG21 VAL A 38 24.745 2.181 -0.888 1.00 1.10 H new ATOM 0 HG22 VAL A 38 24.419 2.307 -2.633 1.00 1.10 H new ATOM 0 HG23 VAL A 38 25.898 1.501 -2.060 1.00 1.10 H new ATOM 643 N ASN A 39 27.343 1.752 -4.225 1.00 1.05 N ATOM 644 CA ASN A 39 28.309 0.692 -4.490 1.00 1.08 C ATOM 645 C ASN A 39 29.423 1.208 -5.393 1.00 1.07 C ATOM 646 O ASN A 39 30.609 1.031 -5.106 1.00 1.10 O ATOM 647 CB ASN A 39 27.631 -0.522 -5.130 1.00 1.10 C ATOM 648 CG ASN A 39 28.210 -1.835 -4.636 1.00 1.41 C ATOM 649 OD1 ASN A 39 29.357 -1.900 -4.195 1.00 1.68 O ATOM 650 ND2 ASN A 39 27.419 -2.894 -4.699 1.00 1.72 N ATOM 0 H ASN A 39 26.418 1.596 -4.625 1.00 1.05 H new ATOM 0 HA ASN A 39 28.739 0.379 -3.538 1.00 1.08 H new ATOM 0 HB2 ASN A 39 26.563 -0.495 -4.913 1.00 1.10 H new ATOM 0 HB3 ASN A 39 27.738 -0.465 -6.213 1.00 1.10 H new ATOM 0 HD21 ASN A 39 27.755 -3.801 -4.376 1.00 1.72 H new ATOM 0 HD22 ASN A 39 26.474 -2.803 -5.071 1.00 1.72 H new ATOM 657 N GLU A 40 29.031 1.881 -6.463 1.00 1.06 N ATOM 658 CA GLU A 40 29.990 2.429 -7.412 1.00 1.08 C ATOM 659 C GLU A 40 30.732 3.616 -6.805 1.00 1.06 C ATOM 660 O GLU A 40 31.920 3.816 -7.061 1.00 1.09 O ATOM 661 CB GLU A 40 29.288 2.836 -8.705 1.00 1.11 C ATOM 662 CG GLU A 40 28.648 1.666 -9.434 1.00 1.33 C ATOM 663 CD GLU A 40 29.632 0.555 -9.743 1.00 1.77 C ATOM 664 OE1 GLU A 40 30.257 0.599 -10.821 1.00 2.13 O ATOM 665 OE2 GLU A 40 29.792 -0.358 -8.906 1.00 2.31 O ATOM 0 H GLU A 40 28.055 2.062 -6.697 1.00 1.06 H new ATOM 0 HA GLU A 40 30.722 1.656 -7.646 1.00 1.08 H new ATOM 0 HB2 GLU A 40 28.521 3.576 -8.477 1.00 1.11 H new ATOM 0 HB3 GLU A 40 30.009 3.317 -9.366 1.00 1.11 H new ATOM 0 HG2 GLU A 40 27.835 1.267 -8.827 1.00 1.33 H new ATOM 0 HG3 GLU A 40 28.206 2.022 -10.364 1.00 1.33 H new ATOM 672 N LEU A 41 30.035 4.388 -5.984 1.00 1.04 N ATOM 673 CA LEU A 41 30.637 5.543 -5.340 1.00 1.05 C ATOM 674 C LEU A 41 31.743 5.100 -4.390 1.00 1.08 C ATOM 675 O LEU A 41 32.797 5.736 -4.305 1.00 1.12 O ATOM 676 CB LEU A 41 29.578 6.345 -4.584 1.00 1.04 C ATOM 677 CG LEU A 41 30.036 7.711 -4.064 1.00 1.04 C ATOM 678 CD1 LEU A 41 30.465 8.609 -5.216 1.00 1.19 C ATOM 679 CD2 LEU A 41 28.922 8.370 -3.263 1.00 1.07 C ATOM 0 H LEU A 41 29.054 4.235 -5.749 1.00 1.04 H new ATOM 0 HA LEU A 41 31.071 6.182 -6.109 1.00 1.05 H new ATOM 0 HB2 LEU A 41 28.721 6.494 -5.241 1.00 1.04 H new ATOM 0 HB3 LEU A 41 29.231 5.751 -3.738 1.00 1.04 H new ATOM 0 HG LEU A 41 30.895 7.561 -3.410 1.00 1.04 H new ATOM 0 HD11 LEU A 41 30.787 9.574 -4.825 1.00 1.19 H new ATOM 0 HD12 LEU A 41 31.290 8.142 -5.753 1.00 1.19 H new ATOM 0 HD13 LEU A 41 29.626 8.755 -5.896 1.00 1.19 H new ATOM 0 HD21 LEU A 41 29.260 9.340 -2.899 1.00 1.07 H new ATOM 0 HD22 LEU A 41 28.048 8.506 -3.900 1.00 1.07 H new ATOM 0 HD23 LEU A 41 28.659 7.736 -2.416 1.00 1.07 H new ATOM 691 N SER A 42 31.504 3.993 -3.696 1.00 1.07 N ATOM 692 CA SER A 42 32.476 3.452 -2.760 1.00 1.12 C ATOM 693 C SER A 42 33.726 2.982 -3.496 1.00 1.16 C ATOM 694 O SER A 42 34.831 3.025 -2.955 1.00 1.20 O ATOM 695 CB SER A 42 31.862 2.295 -1.970 1.00 1.13 C ATOM 696 OG SER A 42 30.721 2.721 -1.240 1.00 1.47 O ATOM 0 H SER A 42 30.642 3.453 -3.766 1.00 1.07 H new ATOM 0 HA SER A 42 32.761 4.241 -2.065 1.00 1.12 H new ATOM 0 HB2 SER A 42 31.582 1.493 -2.653 1.00 1.13 H new ATOM 0 HB3 SER A 42 32.604 1.885 -1.284 1.00 1.13 H new ATOM 0 HG SER A 42 29.967 2.843 -1.854 1.00 1.47 H new ATOM 702 N GLU A 43 33.542 2.544 -4.736 1.00 1.16 N ATOM 703 CA GLU A 43 34.648 2.070 -5.554 1.00 1.22 C ATOM 704 C GLU A 43 35.595 3.222 -5.882 1.00 1.21 C ATOM 705 O GLU A 43 36.806 3.033 -5.985 1.00 1.25 O ATOM 706 CB GLU A 43 34.121 1.449 -6.848 1.00 1.27 C ATOM 707 CG GLU A 43 34.944 0.270 -7.336 1.00 1.60 C ATOM 708 CD GLU A 43 34.746 -0.964 -6.484 1.00 1.71 C ATOM 709 OE1 GLU A 43 35.414 -1.085 -5.434 1.00 1.98 O ATOM 710 OE2 GLU A 43 33.914 -1.820 -6.851 1.00 1.94 O ATOM 0 H GLU A 43 32.633 2.508 -5.197 1.00 1.16 H new ATOM 0 HA GLU A 43 35.193 1.311 -4.993 1.00 1.22 H new ATOM 0 HB2 GLU A 43 33.092 1.124 -6.692 1.00 1.27 H new ATOM 0 HB3 GLU A 43 34.100 2.213 -7.625 1.00 1.27 H new ATOM 0 HG2 GLU A 43 34.673 0.043 -8.367 1.00 1.60 H new ATOM 0 HG3 GLU A 43 35.999 0.542 -7.336 1.00 1.60 H new ATOM 717 N LYS A 44 35.034 4.417 -6.030 1.00 1.18 N ATOM 718 CA LYS A 44 35.823 5.604 -6.349 1.00 1.20 C ATOM 719 C LYS A 44 36.449 6.197 -5.089 1.00 1.20 C ATOM 720 O LYS A 44 37.501 6.833 -5.145 1.00 1.25 O ATOM 721 CB LYS A 44 34.945 6.664 -7.022 1.00 1.22 C ATOM 722 CG LYS A 44 34.076 6.117 -8.142 1.00 1.25 C ATOM 723 CD LYS A 44 34.696 6.357 -9.508 1.00 1.46 C ATOM 724 CE LYS A 44 33.908 5.650 -10.598 1.00 1.75 C ATOM 725 NZ LYS A 44 34.348 6.054 -11.960 1.00 2.12 N ATOM 0 H LYS A 44 34.034 4.591 -5.934 1.00 1.18 H new ATOM 0 HA LYS A 44 36.617 5.302 -7.032 1.00 1.20 H new ATOM 0 HB2 LYS A 44 34.305 7.124 -6.269 1.00 1.22 H new ATOM 0 HB3 LYS A 44 35.584 7.452 -7.422 1.00 1.22 H new ATOM 0 HG2 LYS A 44 33.924 5.048 -7.995 1.00 1.25 H new ATOM 0 HG3 LYS A 44 33.093 6.587 -8.102 1.00 1.25 H new ATOM 0 HD2 LYS A 44 34.728 7.427 -9.714 1.00 1.46 H new ATOM 0 HD3 LYS A 44 35.726 6.001 -9.511 1.00 1.46 H new ATOM 0 HE2 LYS A 44 34.022 4.572 -10.486 1.00 1.75 H new ATOM 0 HE3 LYS A 44 32.847 5.872 -10.480 1.00 1.75 H new ATOM 0 HZ1 LYS A 44 33.784 5.547 -12.672 1.00 2.12 H new ATOM 0 HZ2 LYS A 44 34.215 7.079 -12.078 1.00 2.12 H new ATOM 0 HZ3 LYS A 44 35.353 5.819 -12.084 1.00 2.12 H new ATOM 739 N ALA A 45 35.793 5.980 -3.958 1.00 1.17 N ATOM 740 CA ALA A 45 36.261 6.509 -2.682 1.00 1.18 C ATOM 741 C ALA A 45 37.341 5.632 -2.058 1.00 1.18 C ATOM 742 O ALA A 45 38.039 6.054 -1.141 1.00 1.19 O ATOM 743 CB ALA A 45 35.092 6.652 -1.724 1.00 1.21 C ATOM 0 H ALA A 45 34.931 5.439 -3.897 1.00 1.17 H new ATOM 0 HA ALA A 45 36.704 7.486 -2.874 1.00 1.18 H new ATOM 0 HB1 ALA A 45 35.448 7.048 -0.773 1.00 1.21 H new ATOM 0 HB2 ALA A 45 34.355 7.334 -2.148 1.00 1.21 H new ATOM 0 HB3 ALA A 45 34.633 5.677 -1.563 1.00 1.21 H new ATOM 749 N LYS A 46 37.486 4.416 -2.566 1.00 1.21 N ATOM 750 CA LYS A 46 38.478 3.481 -2.039 1.00 1.24 C ATOM 751 C LYS A 46 39.906 3.935 -2.337 1.00 1.24 C ATOM 752 O LYS A 46 40.860 3.435 -1.740 1.00 1.27 O ATOM 753 CB LYS A 46 38.249 2.084 -2.615 1.00 1.32 C ATOM 754 CG LYS A 46 37.353 1.212 -1.747 1.00 1.61 C ATOM 755 CD LYS A 46 36.728 0.072 -2.541 1.00 2.02 C ATOM 756 CE LYS A 46 37.763 -0.961 -2.965 1.00 2.38 C ATOM 757 NZ LYS A 46 37.877 -1.056 -4.449 1.00 2.75 N ATOM 0 H LYS A 46 36.932 4.052 -3.341 1.00 1.21 H new ATOM 0 HA LYS A 46 38.355 3.454 -0.956 1.00 1.24 H new ATOM 0 HB2 LYS A 46 37.804 2.176 -3.606 1.00 1.32 H new ATOM 0 HB3 LYS A 46 39.212 1.589 -2.742 1.00 1.32 H new ATOM 0 HG2 LYS A 46 37.935 0.803 -0.921 1.00 1.61 H new ATOM 0 HG3 LYS A 46 36.565 1.824 -1.309 1.00 1.61 H new ATOM 0 HD2 LYS A 46 35.959 -0.411 -1.938 1.00 2.02 H new ATOM 0 HD3 LYS A 46 36.234 0.474 -3.425 1.00 2.02 H new ATOM 0 HE2 LYS A 46 38.733 -0.698 -2.542 1.00 2.38 H new ATOM 0 HE3 LYS A 46 37.492 -1.935 -2.558 1.00 2.38 H new ATOM 0 HZ1 LYS A 46 38.615 -1.745 -4.697 1.00 2.75 H new ATOM 0 HZ2 LYS A 46 36.967 -1.364 -4.848 1.00 2.75 H new ATOM 0 HZ3 LYS A 46 38.128 -0.125 -4.838 1.00 2.75 H new ATOM 771 N THR A 47 40.055 4.880 -3.257 1.00 1.23 N ATOM 772 CA THR A 47 41.370 5.383 -3.630 1.00 1.26 C ATOM 773 C THR A 47 41.713 6.699 -2.924 1.00 1.21 C ATOM 774 O THR A 47 42.574 7.454 -3.385 1.00 1.30 O ATOM 775 CB THR A 47 41.461 5.577 -5.150 1.00 1.39 C ATOM 776 OG1 THR A 47 40.141 5.572 -5.716 1.00 1.54 O ATOM 777 CG2 THR A 47 42.296 4.474 -5.788 1.00 1.62 C ATOM 0 H THR A 47 39.280 5.314 -3.759 1.00 1.23 H new ATOM 0 HA THR A 47 42.095 4.634 -3.310 1.00 1.26 H new ATOM 0 HB THR A 47 41.943 6.534 -5.349 1.00 1.39 H new ATOM 0 HG1 THR A 47 40.201 5.698 -6.686 1.00 1.54 H new ATOM 0 HG21 THR A 47 42.346 4.633 -6.865 1.00 1.62 H new ATOM 0 HG22 THR A 47 43.303 4.493 -5.371 1.00 1.62 H new ATOM 0 HG23 THR A 47 41.837 3.506 -5.585 1.00 1.62 H new ATOM 785 N ASP A 48 41.043 6.974 -1.809 1.00 1.15 N ATOM 786 CA ASP A 48 41.292 8.193 -1.039 1.00 1.15 C ATOM 787 C ASP A 48 40.891 7.981 0.420 1.00 1.09 C ATOM 788 O ASP A 48 39.784 7.527 0.699 1.00 1.06 O ATOM 789 CB ASP A 48 40.519 9.379 -1.629 1.00 1.24 C ATOM 790 CG ASP A 48 40.814 10.681 -0.909 1.00 1.32 C ATOM 791 OD1 ASP A 48 40.157 10.964 0.111 1.00 1.41 O ATOM 792 OD2 ASP A 48 41.709 11.429 -1.361 1.00 1.50 O ATOM 0 H ASP A 48 40.322 6.369 -1.416 1.00 1.15 H new ATOM 0 HA ASP A 48 42.357 8.419 -1.089 1.00 1.15 H new ATOM 0 HB2 ASP A 48 40.773 9.485 -2.684 1.00 1.24 H new ATOM 0 HB3 ASP A 48 39.450 9.173 -1.578 1.00 1.24 H new ATOM 797 N PRO A 49 41.783 8.307 1.371 1.00 1.12 N ATOM 798 CA PRO A 49 41.518 8.125 2.808 1.00 1.13 C ATOM 799 C PRO A 49 40.345 8.952 3.329 1.00 1.17 C ATOM 800 O PRO A 49 39.574 8.491 4.171 1.00 1.18 O ATOM 801 CB PRO A 49 42.818 8.584 3.478 1.00 1.22 C ATOM 802 CG PRO A 49 43.505 9.431 2.464 1.00 1.25 C ATOM 803 CD PRO A 49 43.116 8.876 1.124 1.00 1.19 C ATOM 0 HA PRO A 49 41.240 7.092 3.019 1.00 1.13 H new ATOM 0 HB2 PRO A 49 42.614 9.148 4.388 1.00 1.22 H new ATOM 0 HB3 PRO A 49 43.436 7.732 3.763 1.00 1.22 H new ATOM 0 HG2 PRO A 49 43.201 10.474 2.557 1.00 1.25 H new ATOM 0 HG3 PRO A 49 44.586 9.401 2.599 1.00 1.25 H new ATOM 0 HD2 PRO A 49 43.087 9.652 0.359 1.00 1.19 H new ATOM 0 HD3 PRO A 49 43.821 8.118 0.782 1.00 1.19 H new ATOM 811 N GLN A 50 40.207 10.172 2.831 1.00 1.23 N ATOM 812 CA GLN A 50 39.130 11.052 3.273 1.00 1.30 C ATOM 813 C GLN A 50 37.806 10.642 2.645 1.00 1.21 C ATOM 814 O GLN A 50 36.770 10.617 3.311 1.00 1.22 O ATOM 815 CB GLN A 50 39.450 12.509 2.932 1.00 1.43 C ATOM 816 CG GLN A 50 40.167 13.257 4.048 1.00 1.59 C ATOM 817 CD GLN A 50 41.486 12.616 4.440 1.00 1.77 C ATOM 818 OE1 GLN A 50 41.537 11.771 5.337 1.00 2.00 O ATOM 819 NE2 GLN A 50 42.557 13.012 3.777 1.00 1.96 N ATOM 0 H GLN A 50 40.822 10.575 2.125 1.00 1.23 H new ATOM 0 HA GLN A 50 39.041 10.960 4.355 1.00 1.30 H new ATOM 0 HB2 GLN A 50 40.068 12.535 2.034 1.00 1.43 H new ATOM 0 HB3 GLN A 50 38.522 13.030 2.696 1.00 1.43 H new ATOM 0 HG2 GLN A 50 40.349 14.284 3.731 1.00 1.59 H new ATOM 0 HG3 GLN A 50 39.518 13.303 4.922 1.00 1.59 H new ATOM 0 HE21 GLN A 50 42.471 13.714 3.042 1.00 1.96 H new ATOM 0 HE22 GLN A 50 43.470 12.616 4.000 1.00 1.96 H new ATOM 828 N ALA A 51 37.845 10.323 1.361 1.00 1.16 N ATOM 829 CA ALA A 51 36.650 9.895 0.650 1.00 1.11 C ATOM 830 C ALA A 51 36.128 8.588 1.233 1.00 1.02 C ATOM 831 O ALA A 51 34.923 8.419 1.431 1.00 1.00 O ATOM 832 CB ALA A 51 36.942 9.750 -0.833 1.00 1.15 C ATOM 0 H ALA A 51 38.690 10.352 0.790 1.00 1.16 H new ATOM 0 HA ALA A 51 35.877 10.654 0.771 1.00 1.11 H new ATOM 0 HB1 ALA A 51 36.039 9.429 -1.352 1.00 1.15 H new ATOM 0 HB2 ALA A 51 37.270 10.709 -1.235 1.00 1.15 H new ATOM 0 HB3 ALA A 51 37.727 9.008 -0.978 1.00 1.15 H new ATOM 838 N ALA A 52 37.050 7.673 1.527 1.00 1.01 N ATOM 839 CA ALA A 52 36.696 6.385 2.109 1.00 1.01 C ATOM 840 C ALA A 52 36.080 6.584 3.486 1.00 1.04 C ATOM 841 O ALA A 52 35.189 5.846 3.886 1.00 1.05 O ATOM 842 CB ALA A 52 37.915 5.478 2.198 1.00 1.07 C ATOM 0 H ALA A 52 38.050 7.803 1.370 1.00 1.01 H new ATOM 0 HA ALA A 52 35.963 5.904 1.462 1.00 1.01 H new ATOM 0 HB1 ALA A 52 37.626 4.522 2.636 1.00 1.07 H new ATOM 0 HB2 ALA A 52 38.319 5.313 1.199 1.00 1.07 H new ATOM 0 HB3 ALA A 52 38.674 5.949 2.823 1.00 1.07 H new ATOM 848 N GLU A 53 36.561 7.595 4.206 1.00 1.10 N ATOM 849 CA GLU A 53 36.041 7.911 5.531 1.00 1.20 C ATOM 850 C GLU A 53 34.614 8.447 5.415 1.00 1.18 C ATOM 851 O GLU A 53 33.767 8.194 6.273 1.00 1.23 O ATOM 852 CB GLU A 53 36.953 8.931 6.231 1.00 1.32 C ATOM 853 CG GLU A 53 36.499 9.320 7.631 1.00 1.52 C ATOM 854 CD GLU A 53 36.294 8.130 8.545 1.00 1.64 C ATOM 855 OE1 GLU A 53 37.300 7.577 9.038 1.00 1.87 O ATOM 856 OE2 GLU A 53 35.129 7.762 8.795 1.00 1.65 O ATOM 0 H GLU A 53 37.312 8.210 3.892 1.00 1.10 H new ATOM 0 HA GLU A 53 36.022 7.003 6.134 1.00 1.20 H new ATOM 0 HB2 GLU A 53 37.961 8.520 6.290 1.00 1.32 H new ATOM 0 HB3 GLU A 53 37.011 9.830 5.618 1.00 1.32 H new ATOM 0 HG2 GLU A 53 37.239 9.986 8.074 1.00 1.52 H new ATOM 0 HG3 GLU A 53 35.567 9.881 7.561 1.00 1.52 H new ATOM 863 N LYS A 54 34.349 9.188 4.346 1.00 1.14 N ATOM 864 CA LYS A 54 33.020 9.736 4.112 1.00 1.15 C ATOM 865 C LYS A 54 32.028 8.611 3.835 1.00 1.06 C ATOM 866 O LYS A 54 30.901 8.627 4.324 1.00 1.08 O ATOM 867 CB LYS A 54 33.038 10.729 2.945 1.00 1.20 C ATOM 868 CG LYS A 54 33.717 12.052 3.276 1.00 1.43 C ATOM 869 CD LYS A 54 33.835 12.952 2.051 1.00 1.56 C ATOM 870 CE LYS A 54 32.475 13.411 1.545 1.00 1.86 C ATOM 871 NZ LYS A 54 32.600 14.392 0.433 1.00 2.25 N ATOM 0 H LYS A 54 35.036 9.423 3.629 1.00 1.14 H new ATOM 0 HA LYS A 54 32.706 10.270 5.009 1.00 1.15 H new ATOM 0 HB2 LYS A 54 33.548 10.271 2.098 1.00 1.20 H new ATOM 0 HB3 LYS A 54 32.013 10.926 2.631 1.00 1.20 H new ATOM 0 HG2 LYS A 54 33.150 12.567 4.052 1.00 1.43 H new ATOM 0 HG3 LYS A 54 34.710 11.859 3.682 1.00 1.43 H new ATOM 0 HD2 LYS A 54 34.442 13.823 2.299 1.00 1.56 H new ATOM 0 HD3 LYS A 54 34.355 12.416 1.257 1.00 1.56 H new ATOM 0 HE2 LYS A 54 31.904 12.547 1.205 1.00 1.86 H new ATOM 0 HE3 LYS A 54 31.915 13.861 2.365 1.00 1.86 H new ATOM 0 HZ1 LYS A 54 31.652 14.680 0.116 1.00 2.25 H new ATOM 0 HZ2 LYS A 54 33.123 15.227 0.764 1.00 2.25 H new ATOM 0 HZ3 LYS A 54 33.112 13.955 -0.360 1.00 2.25 H new ATOM 885 N LEU A 55 32.463 7.625 3.062 1.00 0.98 N ATOM 886 CA LEU A 55 31.620 6.480 2.733 1.00 0.95 C ATOM 887 C LEU A 55 31.463 5.568 3.948 1.00 0.98 C ATOM 888 O LEU A 55 30.441 4.898 4.111 1.00 1.00 O ATOM 889 CB LEU A 55 32.213 5.698 1.557 1.00 0.93 C ATOM 890 CG LEU A 55 31.598 6.005 0.184 1.00 1.05 C ATOM 891 CD1 LEU A 55 30.106 5.705 0.188 1.00 1.34 C ATOM 892 CD2 LEU A 55 31.851 7.455 -0.211 1.00 1.22 C ATOM 0 H LEU A 55 33.396 7.594 2.650 1.00 0.98 H new ATOM 0 HA LEU A 55 30.636 6.849 2.444 1.00 0.95 H new ATOM 0 HB2 LEU A 55 33.283 5.901 1.510 1.00 0.93 H new ATOM 0 HB3 LEU A 55 32.099 4.633 1.757 1.00 0.93 H new ATOM 0 HG LEU A 55 32.077 5.363 -0.555 1.00 1.05 H new ATOM 0 HD11 LEU A 55 29.687 5.929 -0.793 1.00 1.34 H new ATOM 0 HD12 LEU A 55 29.947 4.652 0.419 1.00 1.34 H new ATOM 0 HD13 LEU A 55 29.613 6.320 0.941 1.00 1.34 H new ATOM 0 HD21 LEU A 55 31.406 7.649 -1.187 1.00 1.22 H new ATOM 0 HD22 LEU A 55 31.403 8.117 0.530 1.00 1.22 H new ATOM 0 HD23 LEU A 55 32.925 7.637 -0.259 1.00 1.22 H new ATOM 904 N ASN A 56 32.481 5.561 4.800 1.00 1.04 N ATOM 905 CA ASN A 56 32.485 4.751 6.014 1.00 1.14 C ATOM 906 C ASN A 56 31.340 5.157 6.935 1.00 1.19 C ATOM 907 O ASN A 56 30.540 4.329 7.354 1.00 1.25 O ATOM 908 CB ASN A 56 33.818 4.909 6.747 1.00 1.25 C ATOM 909 CG ASN A 56 33.791 4.312 8.138 1.00 1.42 C ATOM 910 OD1 ASN A 56 33.329 3.189 8.335 1.00 1.48 O ATOM 911 ND2 ASN A 56 34.259 5.069 9.121 1.00 1.57 N ATOM 0 H ASN A 56 33.327 6.116 4.670 1.00 1.04 H new ATOM 0 HA ASN A 56 32.352 3.707 5.730 1.00 1.14 H new ATOM 0 HB2 ASN A 56 34.607 4.432 6.166 1.00 1.25 H new ATOM 0 HB3 ASN A 56 34.068 5.968 6.815 1.00 1.25 H new ATOM 0 HD21 ASN A 56 34.244 4.725 10.081 1.00 1.57 H new ATOM 0 HD22 ASN A 56 34.634 5.995 8.917 1.00 1.57 H new ATOM 918 N LYS A 57 31.263 6.443 7.236 1.00 1.20 N ATOM 919 CA LYS A 57 30.206 6.954 8.097 1.00 1.28 C ATOM 920 C LYS A 57 28.853 6.852 7.404 1.00 1.22 C ATOM 921 O LYS A 57 27.826 6.697 8.059 1.00 1.27 O ATOM 922 CB LYS A 57 30.492 8.396 8.524 1.00 1.39 C ATOM 923 CG LYS A 57 30.968 9.305 7.398 1.00 1.52 C ATOM 924 CD LYS A 57 31.182 10.730 7.884 1.00 1.63 C ATOM 925 CE LYS A 57 32.152 10.786 9.052 1.00 1.74 C ATOM 926 NZ LYS A 57 33.475 10.201 8.716 1.00 1.86 N ATOM 0 H LYS A 57 31.916 7.150 6.899 1.00 1.20 H new ATOM 0 HA LYS A 57 30.177 6.339 8.997 1.00 1.28 H new ATOM 0 HB2 LYS A 57 29.586 8.820 8.958 1.00 1.39 H new ATOM 0 HB3 LYS A 57 31.247 8.386 9.310 1.00 1.39 H new ATOM 0 HG2 LYS A 57 31.899 8.917 6.985 1.00 1.52 H new ATOM 0 HG3 LYS A 57 30.235 9.301 6.591 1.00 1.52 H new ATOM 0 HD2 LYS A 57 31.563 11.340 7.065 1.00 1.63 H new ATOM 0 HD3 LYS A 57 30.226 11.160 8.184 1.00 1.63 H new ATOM 0 HE2 LYS A 57 32.284 11.823 9.362 1.00 1.74 H new ATOM 0 HE3 LYS A 57 31.726 10.251 9.901 1.00 1.74 H new ATOM 0 HZ1 LYS A 57 34.225 10.741 9.193 1.00 1.86 H new ATOM 0 HZ2 LYS A 57 33.507 9.211 9.032 1.00 1.86 H new ATOM 0 HZ3 LYS A 57 33.621 10.241 7.687 1.00 1.86 H new ATOM 940 N LEU A 58 28.864 6.949 6.078 1.00 1.12 N ATOM 941 CA LEU A 58 27.644 6.861 5.285 1.00 1.10 C ATOM 942 C LEU A 58 26.960 5.512 5.506 1.00 1.08 C ATOM 943 O LEU A 58 25.778 5.456 5.852 1.00 1.11 O ATOM 944 CB LEU A 58 27.958 7.053 3.797 1.00 1.06 C ATOM 945 CG LEU A 58 27.252 8.233 3.118 1.00 1.22 C ATOM 946 CD1 LEU A 58 25.743 8.072 3.189 1.00 1.35 C ATOM 947 CD2 LEU A 58 27.676 9.547 3.751 1.00 1.39 C ATOM 0 H LEU A 58 29.711 7.090 5.528 1.00 1.12 H new ATOM 0 HA LEU A 58 26.968 7.654 5.606 1.00 1.10 H new ATOM 0 HB2 LEU A 58 29.034 7.183 3.685 1.00 1.06 H new ATOM 0 HB3 LEU A 58 27.691 6.139 3.267 1.00 1.06 H new ATOM 0 HG LEU A 58 27.546 8.245 2.068 1.00 1.22 H new ATOM 0 HD11 LEU A 58 25.263 8.920 2.701 1.00 1.35 H new ATOM 0 HD12 LEU A 58 25.451 7.151 2.685 1.00 1.35 H new ATOM 0 HD13 LEU A 58 25.430 8.029 4.232 1.00 1.35 H new ATOM 0 HD21 LEU A 58 27.164 10.372 3.255 1.00 1.39 H new ATOM 0 HD22 LEU A 58 27.415 9.542 4.809 1.00 1.39 H new ATOM 0 HD23 LEU A 58 28.753 9.672 3.643 1.00 1.39 H new ATOM 959 N ILE A 59 27.713 4.428 5.333 1.00 1.07 N ATOM 960 CA ILE A 59 27.163 3.087 5.510 1.00 1.12 C ATOM 961 C ILE A 59 26.813 2.825 6.975 1.00 1.22 C ATOM 962 O ILE A 59 25.835 2.139 7.271 1.00 1.28 O ATOM 963 CB ILE A 59 28.114 1.983 4.981 1.00 1.15 C ATOM 964 CG1 ILE A 59 27.405 0.626 4.978 1.00 1.28 C ATOM 965 CG2 ILE A 59 29.391 1.907 5.807 1.00 1.26 C ATOM 966 CD1 ILE A 59 26.313 0.507 3.931 1.00 1.39 C ATOM 0 H ILE A 59 28.699 4.451 5.072 1.00 1.07 H new ATOM 0 HA ILE A 59 26.250 3.045 4.916 1.00 1.12 H new ATOM 0 HB ILE A 59 28.390 2.243 3.959 1.00 1.15 H new ATOM 0 HG12 ILE A 59 28.143 -0.158 4.810 1.00 1.28 H new ATOM 0 HG13 ILE A 59 26.972 0.451 5.963 1.00 1.28 H new ATOM 0 HG21 ILE A 59 30.035 1.123 5.409 1.00 1.26 H new ATOM 0 HG22 ILE A 59 29.912 2.863 5.760 1.00 1.26 H new ATOM 0 HG23 ILE A 59 29.141 1.680 6.843 1.00 1.26 H new ATOM 0 HD11 ILE A 59 25.858 -0.482 3.991 1.00 1.39 H new ATOM 0 HD12 ILE A 59 25.553 1.268 4.110 1.00 1.39 H new ATOM 0 HD13 ILE A 59 26.743 0.649 2.939 1.00 1.39 H new ATOM 978 N GLU A 60 27.608 3.381 7.884 1.00 1.27 N ATOM 979 CA GLU A 60 27.371 3.217 9.313 1.00 1.41 C ATOM 980 C GLU A 60 25.999 3.764 9.685 1.00 1.39 C ATOM 981 O GLU A 60 25.175 3.068 10.278 1.00 1.49 O ATOM 982 CB GLU A 60 28.457 3.943 10.111 1.00 1.52 C ATOM 983 CG GLU A 60 28.307 3.808 11.619 1.00 1.73 C ATOM 984 CD GLU A 60 28.860 2.503 12.158 1.00 2.09 C ATOM 985 OE1 GLU A 60 28.862 1.493 11.425 1.00 2.61 O ATOM 986 OE2 GLU A 60 29.304 2.485 13.328 1.00 2.28 O ATOM 0 H GLU A 60 28.423 3.950 7.655 1.00 1.27 H new ATOM 0 HA GLU A 60 27.403 2.155 9.554 1.00 1.41 H new ATOM 0 HB2 GLU A 60 29.432 3.554 9.816 1.00 1.52 H new ATOM 0 HB3 GLU A 60 28.442 5.001 9.847 1.00 1.52 H new ATOM 0 HG2 GLU A 60 28.817 4.640 12.105 1.00 1.73 H new ATOM 0 HG3 GLU A 60 27.252 3.884 11.881 1.00 1.73 H new ATOM 993 N GLY A 61 25.757 5.010 9.292 1.00 1.30 N ATOM 994 CA GLY A 61 24.496 5.661 9.577 1.00 1.30 C ATOM 995 C GLY A 61 23.336 5.025 8.844 1.00 1.26 C ATOM 996 O GLY A 61 22.199 5.065 9.316 1.00 1.27 O ATOM 0 H GLY A 61 26.422 5.585 8.775 1.00 1.30 H new ATOM 0 HA2 GLY A 61 24.307 5.625 10.650 1.00 1.30 H new ATOM 0 HA3 GLY A 61 24.563 6.713 9.300 1.00 1.30 H new ATOM 1000 N TYR A 62 23.615 4.469 7.674 1.00 1.25 N ATOM 1001 CA TYR A 62 22.590 3.811 6.886 1.00 1.31 C ATOM 1002 C TYR A 62 22.178 2.494 7.531 1.00 1.43 C ATOM 1003 O TYR A 62 20.992 2.188 7.635 1.00 1.47 O ATOM 1004 CB TYR A 62 23.087 3.566 5.463 1.00 1.39 C ATOM 1005 CG TYR A 62 22.133 4.056 4.399 1.00 1.59 C ATOM 1006 CD1 TYR A 62 21.980 5.415 4.157 1.00 2.27 C ATOM 1007 CD2 TYR A 62 21.392 3.163 3.631 1.00 2.03 C ATOM 1008 CE1 TYR A 62 21.116 5.872 3.181 1.00 2.80 C ATOM 1009 CE2 TYR A 62 20.526 3.614 2.654 1.00 2.60 C ATOM 1010 CZ TYR A 62 20.392 4.969 2.433 1.00 2.80 C ATOM 1011 OH TYR A 62 19.530 5.418 1.458 1.00 3.54 O ATOM 0 H TYR A 62 24.543 4.462 7.252 1.00 1.25 H new ATOM 0 HA TYR A 62 21.719 4.465 6.846 1.00 1.31 H new ATOM 0 HB2 TYR A 62 24.049 4.061 5.333 1.00 1.39 H new ATOM 0 HB3 TYR A 62 23.256 2.498 5.324 1.00 1.39 H new ATOM 0 HD1 TYR A 62 22.546 6.126 4.741 1.00 2.27 H new ATOM 0 HD2 TYR A 62 21.496 2.102 3.801 1.00 2.03 H new ATOM 0 HE1 TYR A 62 21.008 6.932 3.005 1.00 2.80 H new ATOM 0 HE2 TYR A 62 19.957 2.909 2.066 1.00 2.60 H new ATOM 0 HH TYR A 62 19.099 4.652 1.024 1.00 3.54 H new ATOM 1021 N THR A 63 23.168 1.719 7.961 1.00 1.55 N ATOM 1022 CA THR A 63 22.906 0.435 8.602 1.00 1.74 C ATOM 1023 C THR A 63 22.129 0.640 9.895 1.00 1.68 C ATOM 1024 O THR A 63 21.126 -0.027 10.149 1.00 1.81 O ATOM 1025 CB THR A 63 24.210 -0.328 8.906 1.00 1.96 C ATOM 1026 OG1 THR A 63 25.016 -0.392 7.723 1.00 2.00 O ATOM 1027 CG2 THR A 63 23.919 -1.739 9.406 1.00 2.37 C ATOM 0 H THR A 63 24.156 1.956 7.878 1.00 1.55 H new ATOM 0 HA THR A 63 22.315 -0.161 7.906 1.00 1.74 H new ATOM 0 HB THR A 63 24.745 0.208 9.690 1.00 1.96 H new ATOM 0 HG1 THR A 63 25.461 0.470 7.583 1.00 2.00 H new ATOM 0 HG21 THR A 63 24.858 -2.253 9.612 1.00 2.37 H new ATOM 0 HG22 THR A 63 23.326 -1.686 10.319 1.00 2.37 H new ATOM 0 HG23 THR A 63 23.365 -2.288 8.645 1.00 2.37 H new ATOM 1035 N TYR A 64 22.597 1.581 10.704 1.00 1.56 N ATOM 1036 CA TYR A 64 21.946 1.902 11.963 1.00 1.61 C ATOM 1037 C TYR A 64 20.936 3.019 11.737 1.00 1.32 C ATOM 1038 O TYR A 64 20.681 3.832 12.628 1.00 1.40 O ATOM 1039 CB TYR A 64 22.981 2.328 13.010 1.00 1.89 C ATOM 1040 CG TYR A 64 23.973 1.244 13.350 1.00 2.36 C ATOM 1041 CD1 TYR A 64 23.642 0.225 14.229 1.00 2.94 C ATOM 1042 CD2 TYR A 64 25.238 1.233 12.780 1.00 2.88 C ATOM 1043 CE1 TYR A 64 24.541 -0.778 14.530 1.00 3.61 C ATOM 1044 CE2 TYR A 64 26.144 0.238 13.079 1.00 3.56 C ATOM 1045 CZ TYR A 64 25.792 -0.766 13.953 1.00 3.79 C ATOM 1046 OH TYR A 64 26.693 -1.763 14.243 1.00 4.61 O ATOM 0 H TYR A 64 23.429 2.137 10.508 1.00 1.56 H new ATOM 0 HA TYR A 64 21.431 1.016 12.334 1.00 1.61 H new ATOM 0 HB2 TYR A 64 23.520 3.201 12.642 1.00 1.89 H new ATOM 0 HB3 TYR A 64 22.462 2.633 13.919 1.00 1.89 H new ATOM 0 HD1 TYR A 64 22.664 0.216 14.686 1.00 2.94 H new ATOM 0 HD2 TYR A 64 25.517 2.016 12.091 1.00 2.88 H new ATOM 0 HE1 TYR A 64 24.266 -1.567 15.214 1.00 3.61 H new ATOM 0 HE2 TYR A 64 27.126 0.246 12.630 1.00 3.56 H new ATOM 0 HH TYR A 64 27.526 -1.604 13.752 1.00 4.61 H new ATOM 1056 N GLY A 65 20.376 3.047 10.534 1.00 1.16 N ATOM 1057 CA GLY A 65 19.404 4.053 10.174 1.00 1.08 C ATOM 1058 C GLY A 65 18.101 3.919 10.927 1.00 1.03 C ATOM 1059 O GLY A 65 17.283 3.043 10.631 1.00 1.02 O ATOM 0 H GLY A 65 20.584 2.378 9.793 1.00 1.16 H new ATOM 0 HA2 GLY A 65 19.826 5.040 10.363 1.00 1.08 H new ATOM 0 HA3 GLY A 65 19.206 3.991 9.104 1.00 1.08 H new ATOM 1063 N GLU A 66 17.907 4.788 11.904 1.00 1.04 N ATOM 1064 CA GLU A 66 16.692 4.790 12.693 1.00 1.03 C ATOM 1065 C GLU A 66 15.527 5.239 11.821 1.00 0.98 C ATOM 1066 O GLU A 66 14.401 4.758 11.971 1.00 0.98 O ATOM 1067 CB GLU A 66 16.843 5.721 13.896 1.00 1.10 C ATOM 1068 CG GLU A 66 15.740 5.579 14.933 1.00 1.55 C ATOM 1069 CD GLU A 66 15.867 4.310 15.747 1.00 1.48 C ATOM 1070 OE1 GLU A 66 15.773 3.211 15.165 1.00 1.73 O ATOM 1071 OE2 GLU A 66 16.054 4.406 16.977 1.00 1.79 O ATOM 0 H GLU A 66 18.582 5.505 12.169 1.00 1.04 H new ATOM 0 HA GLU A 66 16.499 3.782 13.062 1.00 1.03 H new ATOM 0 HB2 GLU A 66 17.803 5.527 14.374 1.00 1.10 H new ATOM 0 HB3 GLU A 66 16.865 6.752 13.543 1.00 1.10 H new ATOM 0 HG2 GLU A 66 15.762 6.439 15.602 1.00 1.55 H new ATOM 0 HG3 GLU A 66 14.772 5.590 14.432 1.00 1.55 H new ATOM 1078 N GLU A 67 15.810 6.140 10.887 1.00 0.98 N ATOM 1079 CA GLU A 67 14.787 6.647 9.988 1.00 0.98 C ATOM 1080 C GLU A 67 14.379 5.555 9.009 1.00 0.95 C ATOM 1081 O GLU A 67 13.231 5.499 8.569 1.00 0.93 O ATOM 1082 CB GLU A 67 15.266 7.892 9.226 1.00 1.05 C ATOM 1083 CG GLU A 67 16.492 8.564 9.830 1.00 1.33 C ATOM 1084 CD GLU A 67 17.781 7.970 9.309 1.00 1.79 C ATOM 1085 OE1 GLU A 67 18.278 6.998 9.909 1.00 2.46 O ATOM 1086 OE2 GLU A 67 18.294 8.458 8.284 1.00 2.37 O ATOM 0 H GLU A 67 16.739 6.532 10.735 1.00 0.98 H new ATOM 0 HA GLU A 67 13.926 6.942 10.588 1.00 0.98 H new ATOM 0 HB2 GLU A 67 15.491 7.610 8.197 1.00 1.05 H new ATOM 0 HB3 GLU A 67 14.452 8.616 9.187 1.00 1.05 H new ATOM 0 HG2 GLU A 67 16.468 9.630 9.605 1.00 1.33 H new ATOM 0 HG3 GLU A 67 16.461 8.466 10.915 1.00 1.33 H new ATOM 1093 N ARG A 68 15.321 4.670 8.687 1.00 0.97 N ATOM 1094 CA ARG A 68 15.045 3.561 7.782 1.00 0.99 C ATOM 1095 C ARG A 68 13.972 2.683 8.402 1.00 0.96 C ATOM 1096 O ARG A 68 13.055 2.216 7.722 1.00 0.97 O ATOM 1097 CB ARG A 68 16.316 2.747 7.505 1.00 1.06 C ATOM 1098 CG ARG A 68 16.108 1.571 6.552 1.00 1.17 C ATOM 1099 CD ARG A 68 15.801 0.274 7.301 1.00 1.27 C ATOM 1100 NE ARG A 68 14.890 -0.591 6.543 1.00 1.43 N ATOM 1101 CZ ARG A 68 13.908 -1.318 7.094 1.00 1.40 C ATOM 1102 NH1 ARG A 68 13.762 -1.356 8.416 1.00 1.41 N ATOM 1103 NH2 ARG A 68 13.091 -2.031 6.320 1.00 1.70 N ATOM 0 H ARG A 68 16.278 4.701 9.039 1.00 0.97 H new ATOM 0 HA ARG A 68 14.695 3.952 6.827 1.00 0.99 H new ATOM 0 HB2 ARG A 68 17.075 3.409 7.088 1.00 1.06 H new ATOM 0 HB3 ARG A 68 16.706 2.370 8.450 1.00 1.06 H new ATOM 0 HG2 ARG A 68 15.289 1.798 5.869 1.00 1.17 H new ATOM 0 HG3 ARG A 68 17.002 1.435 5.943 1.00 1.17 H new ATOM 0 HD2 ARG A 68 16.730 -0.261 7.498 1.00 1.27 H new ATOM 0 HD3 ARG A 68 15.358 0.509 8.269 1.00 1.27 H new ATOM 0 HE ARG A 68 15.012 -0.642 5.532 1.00 1.43 H new ATOM 0 HH11 ARG A 68 14.399 -0.830 9.015 1.00 1.41 H new ATOM 0 HH12 ARG A 68 13.013 -1.911 8.831 1.00 1.41 H new ATOM 0 HH21 ARG A 68 13.213 -2.024 5.307 1.00 1.70 H new ATOM 0 HH22 ARG A 68 12.344 -2.584 6.740 1.00 1.70 H new ATOM 1117 N LYS A 69 14.084 2.493 9.708 1.00 0.95 N ATOM 1118 CA LYS A 69 13.128 1.694 10.453 1.00 0.97 C ATOM 1119 C LYS A 69 11.778 2.406 10.493 1.00 0.91 C ATOM 1120 O LYS A 69 10.734 1.766 10.570 1.00 0.92 O ATOM 1121 CB LYS A 69 13.639 1.448 11.873 1.00 1.04 C ATOM 1122 CG LYS A 69 12.933 0.310 12.591 1.00 1.31 C ATOM 1123 CD LYS A 69 13.486 0.109 13.992 1.00 1.43 C ATOM 1124 CE LYS A 69 13.036 1.212 14.936 1.00 1.48 C ATOM 1125 NZ LYS A 69 14.030 1.463 16.012 1.00 1.54 N ATOM 0 H LYS A 69 14.835 2.886 10.276 1.00 0.95 H new ATOM 0 HA LYS A 69 13.006 0.731 9.956 1.00 0.97 H new ATOM 0 HB2 LYS A 69 14.707 1.233 11.833 1.00 1.04 H new ATOM 0 HB3 LYS A 69 13.520 2.362 12.455 1.00 1.04 H new ATOM 0 HG2 LYS A 69 11.865 0.520 12.647 1.00 1.31 H new ATOM 0 HG3 LYS A 69 13.047 -0.610 12.018 1.00 1.31 H new ATOM 0 HD2 LYS A 69 13.159 -0.856 14.378 1.00 1.43 H new ATOM 0 HD3 LYS A 69 14.575 0.084 13.954 1.00 1.43 H new ATOM 0 HE2 LYS A 69 12.874 2.130 14.371 1.00 1.48 H new ATOM 0 HE3 LYS A 69 12.080 0.940 15.382 1.00 1.48 H new ATOM 0 HZ1 LYS A 69 13.622 2.109 16.718 1.00 1.54 H new ATOM 0 HZ2 LYS A 69 14.280 0.564 16.470 1.00 1.54 H new ATOM 0 HZ3 LYS A 69 14.884 1.892 15.602 1.00 1.54 H new ATOM 1139 N LEU A 70 11.809 3.736 10.431 1.00 0.90 N ATOM 1140 CA LEU A 70 10.588 4.535 10.447 1.00 0.88 C ATOM 1141 C LEU A 70 9.772 4.278 9.187 1.00 0.85 C ATOM 1142 O LEU A 70 8.548 4.167 9.245 1.00 0.85 O ATOM 1143 CB LEU A 70 10.915 6.028 10.572 1.00 0.93 C ATOM 1144 CG LEU A 70 9.701 6.960 10.561 1.00 1.01 C ATOM 1145 CD1 LEU A 70 8.864 6.776 11.816 1.00 1.14 C ATOM 1146 CD2 LEU A 70 10.139 8.406 10.415 1.00 1.15 C ATOM 0 H LEU A 70 12.668 4.282 10.369 1.00 0.90 H new ATOM 0 HA LEU A 70 9.998 4.240 11.315 1.00 0.88 H new ATOM 0 HB2 LEU A 70 11.468 6.187 11.498 1.00 0.93 H new ATOM 0 HB3 LEU A 70 11.577 6.309 9.753 1.00 0.93 H new ATOM 0 HG LEU A 70 9.082 6.701 9.702 1.00 1.01 H new ATOM 0 HD11 LEU A 70 8.007 7.449 11.784 1.00 1.14 H new ATOM 0 HD12 LEU A 70 8.513 5.745 11.872 1.00 1.14 H new ATOM 0 HD13 LEU A 70 9.470 7.001 12.694 1.00 1.14 H new ATOM 0 HD21 LEU A 70 9.262 9.053 10.409 1.00 1.15 H new ATOM 0 HD22 LEU A 70 10.784 8.677 11.251 1.00 1.15 H new ATOM 0 HD23 LEU A 70 10.686 8.528 9.480 1.00 1.15 H new ATOM 1158 N TYR A 71 10.454 4.175 8.047 1.00 0.84 N ATOM 1159 CA TYR A 71 9.776 3.909 6.783 1.00 0.86 C ATOM 1160 C TYR A 71 9.128 2.530 6.846 1.00 0.85 C ATOM 1161 O TYR A 71 8.025 2.318 6.340 1.00 0.85 O ATOM 1162 CB TYR A 71 10.741 3.960 5.587 1.00 0.91 C ATOM 1163 CG TYR A 71 11.766 5.076 5.632 1.00 0.92 C ATOM 1164 CD1 TYR A 71 11.419 6.367 6.017 1.00 0.94 C ATOM 1165 CD2 TYR A 71 13.087 4.828 5.286 1.00 0.99 C ATOM 1166 CE1 TYR A 71 12.366 7.375 6.058 1.00 1.01 C ATOM 1167 CE2 TYR A 71 14.035 5.829 5.322 1.00 1.05 C ATOM 1168 CZ TYR A 71 13.674 7.098 5.710 1.00 1.05 C ATOM 1169 OH TYR A 71 14.626 8.088 5.759 1.00 1.16 O ATOM 0 H TYR A 71 11.467 4.271 7.974 1.00 0.84 H new ATOM 0 HA TYR A 71 9.024 4.685 6.637 1.00 0.86 H new ATOM 0 HB2 TYR A 71 11.267 3.007 5.524 1.00 0.91 H new ATOM 0 HB3 TYR A 71 10.156 4.062 4.673 1.00 0.91 H new ATOM 0 HD1 TYR A 71 10.397 6.585 6.288 1.00 0.94 H new ATOM 0 HD2 TYR A 71 13.378 3.833 4.983 1.00 0.99 H new ATOM 0 HE1 TYR A 71 12.084 8.373 6.360 1.00 1.01 H new ATOM 0 HE2 TYR A 71 15.057 5.617 5.046 1.00 1.05 H new ATOM 0 HH TYR A 71 15.493 7.722 5.484 1.00 1.16 H new ATOM 1179 N ASP A 72 9.834 1.603 7.486 1.00 0.86 N ATOM 1180 CA ASP A 72 9.363 0.231 7.651 1.00 0.90 C ATOM 1181 C ASP A 72 8.082 0.204 8.480 1.00 0.87 C ATOM 1182 O ASP A 72 7.092 -0.423 8.095 1.00 0.87 O ATOM 1183 CB ASP A 72 10.450 -0.607 8.335 1.00 0.98 C ATOM 1184 CG ASP A 72 10.178 -2.097 8.294 1.00 1.21 C ATOM 1185 OD1 ASP A 72 9.285 -2.564 9.032 1.00 1.47 O ATOM 1186 OD2 ASP A 72 10.887 -2.813 7.560 1.00 1.48 O ATOM 0 H ASP A 72 10.747 1.781 7.904 1.00 0.86 H new ATOM 0 HA ASP A 72 9.148 -0.190 6.669 1.00 0.90 H new ATOM 0 HB2 ASP A 72 11.408 -0.407 7.855 1.00 0.98 H new ATOM 0 HB3 ASP A 72 10.542 -0.291 9.374 1.00 0.98 H new ATOM 1191 N SER A 73 8.102 0.913 9.606 1.00 0.85 N ATOM 1192 CA SER A 73 6.952 0.982 10.500 1.00 0.85 C ATOM 1193 C SER A 73 5.769 1.660 9.819 1.00 0.81 C ATOM 1194 O SER A 73 4.613 1.355 10.112 1.00 0.80 O ATOM 1195 CB SER A 73 7.338 1.725 11.776 1.00 0.90 C ATOM 1196 OG SER A 73 8.499 1.151 12.352 1.00 0.96 O ATOM 0 H SER A 73 8.909 1.451 9.921 1.00 0.85 H new ATOM 0 HA SER A 73 6.648 -0.033 10.757 1.00 0.85 H new ATOM 0 HB2 SER A 73 7.518 2.776 11.552 1.00 0.90 H new ATOM 0 HB3 SER A 73 6.514 1.688 12.489 1.00 0.90 H new ATOM 0 HG SER A 73 9.289 1.428 11.842 1.00 0.96 H new ATOM 1202 N ALA A 74 6.058 2.572 8.903 1.00 0.80 N ATOM 1203 CA ALA A 74 5.014 3.267 8.173 1.00 0.79 C ATOM 1204 C ALA A 74 4.270 2.282 7.285 1.00 0.76 C ATOM 1205 O ALA A 74 3.048 2.345 7.145 1.00 0.75 O ATOM 1206 CB ALA A 74 5.605 4.402 7.352 1.00 0.82 C ATOM 0 H ALA A 74 7.007 2.846 8.649 1.00 0.80 H new ATOM 0 HA ALA A 74 4.308 3.701 8.881 1.00 0.79 H new ATOM 0 HB1 ALA A 74 4.808 4.913 6.811 1.00 0.82 H new ATOM 0 HB2 ALA A 74 6.104 5.109 8.015 1.00 0.82 H new ATOM 0 HB3 ALA A 74 6.326 3.999 6.641 1.00 0.82 H new ATOM 1212 N LEU A 75 5.023 1.347 6.713 1.00 0.77 N ATOM 1213 CA LEU A 75 4.450 0.321 5.851 1.00 0.78 C ATOM 1214 C LEU A 75 3.615 -0.649 6.673 1.00 0.77 C ATOM 1215 O LEU A 75 2.665 -1.246 6.169 1.00 0.77 O ATOM 1216 CB LEU A 75 5.549 -0.446 5.110 1.00 0.83 C ATOM 1217 CG LEU A 75 5.590 -0.230 3.594 1.00 0.92 C ATOM 1218 CD1 LEU A 75 4.196 -0.336 2.992 1.00 1.13 C ATOM 1219 CD2 LEU A 75 6.221 1.115 3.265 1.00 1.15 C ATOM 0 H LEU A 75 6.034 1.280 6.832 1.00 0.77 H new ATOM 0 HA LEU A 75 3.813 0.814 5.116 1.00 0.78 H new ATOM 0 HB2 LEU A 75 6.514 -0.159 5.527 1.00 0.83 H new ATOM 0 HB3 LEU A 75 5.421 -1.511 5.305 1.00 0.83 H new ATOM 0 HG LEU A 75 6.205 -1.015 3.154 1.00 0.92 H new ATOM 0 HD11 LEU A 75 4.252 -0.179 1.915 1.00 1.13 H new ATOM 0 HD12 LEU A 75 3.787 -1.326 3.194 1.00 1.13 H new ATOM 0 HD13 LEU A 75 3.549 0.421 3.436 1.00 1.13 H new ATOM 0 HD21 LEU A 75 6.242 1.252 2.184 1.00 1.15 H new ATOM 0 HD22 LEU A 75 5.635 1.913 3.721 1.00 1.15 H new ATOM 0 HD23 LEU A 75 7.239 1.144 3.654 1.00 1.15 H new ATOM 1231 N SER A 76 3.980 -0.800 7.942 1.00 0.78 N ATOM 1232 CA SER A 76 3.254 -1.683 8.844 1.00 0.80 C ATOM 1233 C SER A 76 1.819 -1.189 9.025 1.00 0.76 C ATOM 1234 O SER A 76 0.885 -1.983 9.134 1.00 0.77 O ATOM 1235 CB SER A 76 3.962 -1.757 10.200 1.00 0.85 C ATOM 1236 OG SER A 76 5.377 -1.829 10.051 1.00 0.88 O ATOM 0 H SER A 76 4.774 -0.322 8.368 1.00 0.78 H new ATOM 0 HA SER A 76 3.229 -2.682 8.408 1.00 0.80 H new ATOM 0 HB2 SER A 76 3.703 -0.881 10.795 1.00 0.85 H new ATOM 0 HB3 SER A 76 3.609 -2.630 10.748 1.00 0.85 H new ATOM 0 HG SER A 76 5.787 -2.033 10.917 1.00 0.88 H new ATOM 1242 N LYS A 77 1.656 0.132 9.038 1.00 0.75 N ATOM 1243 CA LYS A 77 0.341 0.738 9.192 1.00 0.74 C ATOM 1244 C LYS A 77 -0.528 0.416 7.982 1.00 0.71 C ATOM 1245 O LYS A 77 -1.738 0.235 8.106 1.00 0.70 O ATOM 1246 CB LYS A 77 0.460 2.255 9.362 1.00 0.76 C ATOM 1247 CG LYS A 77 1.489 2.682 10.400 1.00 0.90 C ATOM 1248 CD LYS A 77 1.313 4.136 10.812 1.00 0.98 C ATOM 1249 CE LYS A 77 0.053 4.332 11.640 1.00 1.35 C ATOM 1250 NZ LYS A 77 0.119 5.562 12.470 1.00 1.61 N ATOM 0 H LYS A 77 2.420 0.801 8.944 1.00 0.75 H new ATOM 0 HA LYS A 77 -0.125 0.326 10.087 1.00 0.74 H new ATOM 0 HB2 LYS A 77 0.722 2.699 8.401 1.00 0.76 H new ATOM 0 HB3 LYS A 77 -0.513 2.656 9.644 1.00 0.76 H new ATOM 0 HG2 LYS A 77 1.404 2.043 11.279 1.00 0.90 H new ATOM 0 HG3 LYS A 77 2.492 2.538 9.997 1.00 0.90 H new ATOM 0 HD2 LYS A 77 2.181 4.460 11.386 1.00 0.98 H new ATOM 0 HD3 LYS A 77 1.266 4.764 9.922 1.00 0.98 H new ATOM 0 HE2 LYS A 77 -0.811 4.387 10.978 1.00 1.35 H new ATOM 0 HE3 LYS A 77 -0.095 3.466 12.286 1.00 1.35 H new ATOM 0 HZ1 LYS A 77 -0.759 5.658 13.019 1.00 1.61 H new ATOM 0 HZ2 LYS A 77 0.928 5.499 13.120 1.00 1.61 H new ATOM 0 HZ3 LYS A 77 0.234 6.391 11.853 1.00 1.61 H new ATOM 1264 N ILE A 78 0.105 0.336 6.813 1.00 0.71 N ATOM 1265 CA ILE A 78 -0.598 0.023 5.576 1.00 0.71 C ATOM 1266 C ILE A 78 -1.169 -1.391 5.638 1.00 0.70 C ATOM 1267 O ILE A 78 -2.313 -1.625 5.257 1.00 0.69 O ATOM 1268 CB ILE A 78 0.334 0.137 4.352 1.00 0.77 C ATOM 1269 CG1 ILE A 78 0.962 1.535 4.265 1.00 1.04 C ATOM 1270 CG2 ILE A 78 -0.425 -0.200 3.077 1.00 0.84 C ATOM 1271 CD1 ILE A 78 0.047 2.598 3.691 1.00 1.33 C ATOM 0 H ILE A 78 1.108 0.485 6.699 1.00 0.71 H new ATOM 0 HA ILE A 78 -1.406 0.746 5.467 1.00 0.71 H new ATOM 0 HB ILE A 78 1.145 -0.582 4.470 1.00 0.77 H new ATOM 0 HG12 ILE A 78 1.275 1.842 5.263 1.00 1.04 H new ATOM 0 HG13 ILE A 78 1.862 1.478 3.653 1.00 1.04 H new ATOM 0 HG21 ILE A 78 0.245 -0.115 2.221 1.00 0.84 H new ATOM 0 HG22 ILE A 78 -0.807 -1.219 3.139 1.00 0.84 H new ATOM 0 HG23 ILE A 78 -1.258 0.493 2.955 1.00 0.84 H new ATOM 0 HD11 ILE A 78 0.570 3.554 3.666 1.00 1.33 H new ATOM 0 HD12 ILE A 78 -0.246 2.318 2.679 1.00 1.33 H new ATOM 0 HD13 ILE A 78 -0.842 2.688 4.315 1.00 1.33 H new ATOM 1283 N GLU A 79 -0.358 -2.325 6.133 1.00 0.72 N ATOM 1284 CA GLU A 79 -0.768 -3.722 6.265 1.00 0.74 C ATOM 1285 C GLU A 79 -2.024 -3.822 7.122 1.00 0.73 C ATOM 1286 O GLU A 79 -2.924 -4.614 6.844 1.00 0.74 O ATOM 1287 CB GLU A 79 0.357 -4.547 6.890 1.00 0.79 C ATOM 1288 CG GLU A 79 0.030 -6.025 7.057 1.00 1.00 C ATOM 1289 CD GLU A 79 0.124 -6.808 5.764 1.00 1.32 C ATOM 1290 OE1 GLU A 79 1.253 -6.989 5.259 1.00 1.95 O ATOM 1291 OE2 GLU A 79 -0.923 -7.259 5.256 1.00 1.93 O ATOM 0 H GLU A 79 0.593 -2.137 6.451 1.00 0.72 H new ATOM 0 HA GLU A 79 -0.984 -4.117 5.272 1.00 0.74 H new ATOM 0 HB2 GLU A 79 1.249 -4.452 6.271 1.00 0.79 H new ATOM 0 HB3 GLU A 79 0.600 -4.128 7.866 1.00 0.79 H new ATOM 0 HG2 GLU A 79 0.711 -6.461 7.788 1.00 1.00 H new ATOM 0 HG3 GLU A 79 -0.977 -6.124 7.461 1.00 1.00 H new ATOM 1298 N LYS A 80 -2.087 -2.994 8.158 1.00 0.72 N ATOM 1299 CA LYS A 80 -3.235 -2.979 9.052 1.00 0.73 C ATOM 1300 C LYS A 80 -4.483 -2.538 8.295 1.00 0.72 C ATOM 1301 O LYS A 80 -5.567 -3.083 8.499 1.00 0.75 O ATOM 1302 CB LYS A 80 -2.984 -2.051 10.239 1.00 0.74 C ATOM 1303 CG LYS A 80 -1.691 -2.352 10.977 1.00 0.81 C ATOM 1304 CD LYS A 80 -1.669 -1.714 12.354 1.00 0.96 C ATOM 1305 CE LYS A 80 -2.564 -2.456 13.334 1.00 1.35 C ATOM 1306 NZ LYS A 80 -2.232 -3.903 13.403 1.00 1.71 N ATOM 0 H LYS A 80 -1.356 -2.325 8.398 1.00 0.72 H new ATOM 0 HA LYS A 80 -3.389 -3.989 9.432 1.00 0.73 H new ATOM 0 HB2 LYS A 80 -2.961 -1.020 9.886 1.00 0.74 H new ATOM 0 HB3 LYS A 80 -3.818 -2.131 10.936 1.00 0.74 H new ATOM 0 HG2 LYS A 80 -1.570 -3.431 11.074 1.00 0.81 H new ATOM 0 HG3 LYS A 80 -0.846 -1.988 10.393 1.00 0.81 H new ATOM 0 HD2 LYS A 80 -0.647 -1.702 12.733 1.00 0.96 H new ATOM 0 HD3 LYS A 80 -1.994 -0.676 12.279 1.00 0.96 H new ATOM 0 HE2 LYS A 80 -2.463 -2.013 14.325 1.00 1.35 H new ATOM 0 HE3 LYS A 80 -3.606 -2.337 13.036 1.00 1.35 H new ATOM 0 HZ1 LYS A 80 -2.588 -4.299 14.296 1.00 1.71 H new ATOM 0 HZ2 LYS A 80 -2.675 -4.399 12.603 1.00 1.71 H new ATOM 0 HZ3 LYS A 80 -1.200 -4.025 13.358 1.00 1.71 H new ATOM 1320 N LEU A 81 -4.318 -1.559 7.409 1.00 0.69 N ATOM 1321 CA LEU A 81 -5.426 -1.055 6.604 1.00 0.71 C ATOM 1322 C LEU A 81 -5.949 -2.164 5.692 1.00 0.72 C ATOM 1323 O LEU A 81 -7.161 -2.340 5.535 1.00 0.76 O ATOM 1324 CB LEU A 81 -4.970 0.150 5.771 1.00 0.71 C ATOM 1325 CG LEU A 81 -5.951 1.326 5.708 1.00 0.78 C ATOM 1326 CD1 LEU A 81 -7.220 0.933 4.966 1.00 1.00 C ATOM 1327 CD2 LEU A 81 -6.280 1.827 7.107 1.00 0.94 C ATOM 0 H LEU A 81 -3.426 -1.099 7.231 1.00 0.69 H new ATOM 0 HA LEU A 81 -6.230 -0.733 7.266 1.00 0.71 H new ATOM 0 HB2 LEU A 81 -4.025 0.511 6.176 1.00 0.71 H new ATOM 0 HB3 LEU A 81 -4.772 -0.189 4.754 1.00 0.71 H new ATOM 0 HG LEU A 81 -5.474 2.137 5.158 1.00 0.78 H new ATOM 0 HD11 LEU A 81 -7.901 1.783 4.934 1.00 1.00 H new ATOM 0 HD12 LEU A 81 -6.968 0.631 3.949 1.00 1.00 H new ATOM 0 HD13 LEU A 81 -7.701 0.102 5.482 1.00 1.00 H new ATOM 0 HD21 LEU A 81 -6.978 2.662 7.040 1.00 0.94 H new ATOM 0 HD22 LEU A 81 -6.733 1.021 7.685 1.00 0.94 H new ATOM 0 HD23 LEU A 81 -5.365 2.157 7.600 1.00 0.94 H new ATOM 1339 N ILE A 82 -5.019 -2.913 5.106 1.00 0.72 N ATOM 1340 CA ILE A 82 -5.356 -4.022 4.220 1.00 0.76 C ATOM 1341 C ILE A 82 -6.107 -5.105 4.991 1.00 0.80 C ATOM 1342 O ILE A 82 -7.037 -5.726 4.477 1.00 0.84 O ATOM 1343 CB ILE A 82 -4.086 -4.628 3.571 1.00 0.75 C ATOM 1344 CG1 ILE A 82 -3.218 -3.520 2.963 1.00 0.74 C ATOM 1345 CG2 ILE A 82 -4.467 -5.648 2.503 1.00 0.80 C ATOM 1346 CD1 ILE A 82 -1.859 -3.987 2.475 1.00 0.77 C ATOM 0 H ILE A 82 -4.017 -2.769 5.231 1.00 0.72 H new ATOM 0 HA ILE A 82 -5.995 -3.633 3.427 1.00 0.76 H new ATOM 0 HB ILE A 82 -3.511 -5.136 4.345 1.00 0.75 H new ATOM 0 HG12 ILE A 82 -3.756 -3.070 2.128 1.00 0.74 H new ATOM 0 HG13 ILE A 82 -3.074 -2.737 3.708 1.00 0.74 H new ATOM 0 HG21 ILE A 82 -3.563 -6.063 2.058 1.00 0.80 H new ATOM 0 HG22 ILE A 82 -5.049 -6.450 2.957 1.00 0.80 H new ATOM 0 HG23 ILE A 82 -5.061 -5.161 1.730 1.00 0.80 H new ATOM 0 HD11 ILE A 82 -1.311 -3.141 2.060 1.00 0.77 H new ATOM 0 HD12 ILE A 82 -1.298 -4.409 3.309 1.00 0.77 H new ATOM 0 HD13 ILE A 82 -1.990 -4.747 1.705 1.00 0.77 H new ATOM 1358 N GLU A 83 -5.701 -5.316 6.236 1.00 0.80 N ATOM 1359 CA GLU A 83 -6.330 -6.305 7.095 1.00 0.86 C ATOM 1360 C GLU A 83 -7.720 -5.840 7.521 1.00 0.85 C ATOM 1361 O GLU A 83 -8.629 -6.647 7.691 1.00 0.90 O ATOM 1362 CB GLU A 83 -5.454 -6.561 8.324 1.00 0.90 C ATOM 1363 CG GLU A 83 -5.839 -7.806 9.109 1.00 1.24 C ATOM 1364 CD GLU A 83 -4.964 -8.021 10.326 1.00 1.70 C ATOM 1365 OE1 GLU A 83 -5.197 -7.355 11.355 1.00 2.18 O ATOM 1366 OE2 GLU A 83 -4.044 -8.863 10.259 1.00 2.36 O ATOM 0 H GLU A 83 -4.932 -4.810 6.675 1.00 0.80 H new ATOM 0 HA GLU A 83 -6.437 -7.235 6.537 1.00 0.86 H new ATOM 0 HB2 GLU A 83 -4.416 -6.652 8.005 1.00 0.90 H new ATOM 0 HB3 GLU A 83 -5.510 -5.696 8.984 1.00 0.90 H new ATOM 0 HG2 GLU A 83 -6.879 -7.725 9.424 1.00 1.24 H new ATOM 0 HG3 GLU A 83 -5.770 -8.677 8.458 1.00 1.24 H new ATOM 1373 N THR A 84 -7.880 -4.526 7.670 1.00 0.82 N ATOM 1374 CA THR A 84 -9.159 -3.946 8.070 1.00 0.84 C ATOM 1375 C THR A 84 -10.220 -4.168 6.987 1.00 0.89 C ATOM 1376 O THR A 84 -11.419 -4.191 7.267 1.00 0.92 O ATOM 1377 CB THR A 84 -9.020 -2.435 8.358 1.00 0.83 C ATOM 1378 OG1 THR A 84 -7.928 -2.205 9.264 1.00 0.84 O ATOM 1379 CG2 THR A 84 -10.298 -1.864 8.959 1.00 0.85 C ATOM 0 H THR A 84 -7.138 -3.843 7.519 1.00 0.82 H new ATOM 0 HA THR A 84 -9.474 -4.448 8.985 1.00 0.84 H new ATOM 0 HB THR A 84 -8.828 -1.933 7.409 1.00 0.83 H new ATOM 0 HG1 THR A 84 -7.079 -2.285 8.780 1.00 0.84 H new ATOM 0 HG21 THR A 84 -10.166 -0.799 9.150 1.00 0.85 H new ATOM 0 HG22 THR A 84 -11.124 -2.009 8.262 1.00 0.85 H new ATOM 0 HG23 THR A 84 -10.520 -2.375 9.896 1.00 0.85 H new ATOM 1387 N LEU A 85 -9.767 -4.358 5.752 1.00 0.93 N ATOM 1388 CA LEU A 85 -10.673 -4.580 4.634 1.00 1.01 C ATOM 1389 C LEU A 85 -11.097 -6.041 4.562 1.00 1.08 C ATOM 1390 O LEU A 85 -11.970 -6.405 3.772 1.00 1.17 O ATOM 1391 CB LEU A 85 -10.018 -4.143 3.320 1.00 1.04 C ATOM 1392 CG LEU A 85 -9.729 -2.642 3.210 1.00 1.05 C ATOM 1393 CD1 LEU A 85 -8.902 -2.350 1.968 1.00 1.22 C ATOM 1394 CD2 LEU A 85 -11.029 -1.846 3.188 1.00 1.13 C ATOM 0 H LEU A 85 -8.778 -4.362 5.502 1.00 0.93 H new ATOM 0 HA LEU A 85 -11.566 -3.976 4.793 1.00 1.01 H new ATOM 0 HB2 LEU A 85 -9.082 -4.688 3.199 1.00 1.04 H new ATOM 0 HB3 LEU A 85 -10.666 -4.435 2.493 1.00 1.04 H new ATOM 0 HG LEU A 85 -9.156 -2.336 4.085 1.00 1.05 H new ATOM 0 HD11 LEU A 85 -8.706 -1.280 1.905 1.00 1.22 H new ATOM 0 HD12 LEU A 85 -7.957 -2.890 2.025 1.00 1.22 H new ATOM 0 HD13 LEU A 85 -9.450 -2.671 1.082 1.00 1.22 H new ATOM 0 HD21 LEU A 85 -10.803 -0.783 3.110 1.00 1.13 H new ATOM 0 HD22 LEU A 85 -11.630 -2.154 2.332 1.00 1.13 H new ATOM 0 HD23 LEU A 85 -11.585 -2.032 4.107 1.00 1.13 H new ATOM 1406 N SER A 86 -10.495 -6.867 5.406 1.00 1.18 N ATOM 1407 CA SER A 86 -10.808 -8.285 5.443 1.00 1.31 C ATOM 1408 C SER A 86 -11.743 -8.600 6.610 1.00 1.73 C ATOM 1409 O SER A 86 -11.395 -8.366 7.768 1.00 2.31 O ATOM 1410 CB SER A 86 -9.520 -9.102 5.565 1.00 1.71 C ATOM 1411 OG SER A 86 -8.748 -9.014 4.379 1.00 1.97 O ATOM 0 H SER A 86 -9.784 -6.576 6.077 1.00 1.18 H new ATOM 0 HA SER A 86 -11.313 -8.553 4.515 1.00 1.31 H new ATOM 0 HB2 SER A 86 -8.935 -8.741 6.411 1.00 1.71 H new ATOM 0 HB3 SER A 86 -9.764 -10.145 5.768 1.00 1.71 H new ATOM 0 HG SER A 86 -7.929 -9.543 4.482 1.00 1.97 H new ATOM 1914 N LYS B 10 16.718 15.013 4.236 1.00 1.52 N ATOM 1915 CA LYS B 10 16.045 14.288 5.307 1.00 1.44 C ATOM 1916 C LYS B 10 14.633 14.821 5.533 1.00 1.38 C ATOM 1917 O LYS B 10 13.699 14.044 5.720 1.00 1.32 O ATOM 1918 CB LYS B 10 16.860 14.367 6.608 1.00 1.48 C ATOM 1919 CG LYS B 10 16.505 13.293 7.637 1.00 1.54 C ATOM 1920 CD LYS B 10 17.488 12.128 7.604 1.00 1.71 C ATOM 1921 CE LYS B 10 17.297 11.267 6.366 1.00 2.08 C ATOM 1922 NZ LYS B 10 18.305 10.180 6.293 1.00 2.41 N ATOM 0 HA LYS B 10 15.968 13.244 5.005 1.00 1.44 H new ATOM 0 HB2 LYS B 10 17.919 14.285 6.365 1.00 1.48 H new ATOM 0 HB3 LYS B 10 16.711 15.349 7.058 1.00 1.48 H new ATOM 0 HG2 LYS B 10 16.497 13.734 8.634 1.00 1.54 H new ATOM 0 HG3 LYS B 10 15.498 12.924 7.444 1.00 1.54 H new ATOM 0 HD2 LYS B 10 18.508 12.512 7.627 1.00 1.71 H new ATOM 0 HD3 LYS B 10 17.358 11.516 8.497 1.00 1.71 H new ATOM 0 HE2 LYS B 10 16.296 10.835 6.374 1.00 2.08 H new ATOM 0 HE3 LYS B 10 17.369 11.890 5.475 1.00 2.08 H new ATOM 0 HZ1 LYS B 10 18.265 9.732 5.355 1.00 2.41 H new ATOM 0 HZ2 LYS B 10 19.254 10.576 6.448 1.00 2.41 H new ATOM 0 HZ3 LYS B 10 18.103 9.469 7.025 1.00 2.41 H new ATOM 1936 N GLU B 11 14.475 16.139 5.494 1.00 1.42 N ATOM 1937 CA GLU B 11 13.167 16.746 5.698 1.00 1.39 C ATOM 1938 C GLU B 11 12.241 16.451 4.519 1.00 1.36 C ATOM 1939 O GLU B 11 11.041 16.233 4.696 1.00 1.30 O ATOM 1940 CB GLU B 11 13.303 18.259 5.883 1.00 1.47 C ATOM 1941 CG GLU B 11 12.063 18.911 6.476 1.00 1.48 C ATOM 1942 CD GLU B 11 12.109 20.425 6.413 1.00 1.62 C ATOM 1943 OE1 GLU B 11 13.194 21.004 6.625 1.00 1.72 O ATOM 1944 OE2 GLU B 11 11.058 21.047 6.154 1.00 1.90 O ATOM 0 H GLU B 11 15.231 16.803 5.324 1.00 1.42 H new ATOM 0 HA GLU B 11 12.733 16.314 6.600 1.00 1.39 H new ATOM 0 HB2 GLU B 11 14.156 18.463 6.530 1.00 1.47 H new ATOM 0 HB3 GLU B 11 13.519 18.717 4.918 1.00 1.47 H new ATOM 0 HG2 GLU B 11 11.181 18.556 5.943 1.00 1.48 H new ATOM 0 HG3 GLU B 11 11.955 18.598 7.515 1.00 1.48 H new ATOM 1951 N LEU B 12 12.814 16.426 3.321 1.00 1.43 N ATOM 1952 CA LEU B 12 12.056 16.177 2.098 1.00 1.45 C ATOM 1953 C LEU B 12 11.378 14.806 2.115 1.00 1.36 C ATOM 1954 O LEU B 12 10.157 14.713 1.985 1.00 1.32 O ATOM 1955 CB LEU B 12 12.983 16.286 0.884 1.00 1.57 C ATOM 1956 CG LEU B 12 12.376 15.839 -0.446 1.00 1.73 C ATOM 1957 CD1 LEU B 12 11.398 16.879 -0.961 1.00 1.89 C ATOM 1958 CD2 LEU B 12 13.475 15.573 -1.466 1.00 1.89 C ATOM 0 H LEU B 12 13.811 16.577 3.169 1.00 1.43 H new ATOM 0 HA LEU B 12 11.271 16.931 2.034 1.00 1.45 H new ATOM 0 HB2 LEU B 12 13.306 17.322 0.787 1.00 1.57 H new ATOM 0 HB3 LEU B 12 13.876 15.691 1.075 1.00 1.57 H new ATOM 0 HG LEU B 12 11.828 14.911 -0.285 1.00 1.73 H new ATOM 0 HD11 LEU B 12 10.976 16.544 -1.908 1.00 1.89 H new ATOM 0 HD12 LEU B 12 10.597 17.016 -0.235 1.00 1.89 H new ATOM 0 HD13 LEU B 12 11.918 17.825 -1.110 1.00 1.89 H new ATOM 0 HD21 LEU B 12 13.028 15.256 -2.408 1.00 1.89 H new ATOM 0 HD22 LEU B 12 14.051 16.484 -1.627 1.00 1.89 H new ATOM 0 HD23 LEU B 12 14.134 14.788 -1.094 1.00 1.89 H new ATOM 1970 N LEU B 13 12.170 13.754 2.287 1.00 1.35 N ATOM 1971 CA LEU B 13 11.638 12.389 2.294 1.00 1.30 C ATOM 1972 C LEU B 13 10.714 12.151 3.482 1.00 1.18 C ATOM 1973 O LEU B 13 9.765 11.367 3.395 1.00 1.15 O ATOM 1974 CB LEU B 13 12.776 11.358 2.290 1.00 1.35 C ATOM 1975 CG LEU B 13 13.925 11.627 3.268 1.00 1.32 C ATOM 1976 CD1 LEU B 13 13.650 10.982 4.617 1.00 1.48 C ATOM 1977 CD2 LEU B 13 15.236 11.117 2.698 1.00 1.50 C ATOM 0 H LEU B 13 13.179 13.815 2.423 1.00 1.35 H new ATOM 0 HA LEU B 13 11.051 12.266 1.384 1.00 1.30 H new ATOM 0 HB2 LEU B 13 12.354 10.379 2.516 1.00 1.35 H new ATOM 0 HB3 LEU B 13 13.187 11.303 1.282 1.00 1.35 H new ATOM 0 HG LEU B 13 14.002 12.705 3.413 1.00 1.32 H new ATOM 0 HD11 LEU B 13 14.479 11.187 5.294 1.00 1.48 H new ATOM 0 HD12 LEU B 13 12.731 11.391 5.035 1.00 1.48 H new ATOM 0 HD13 LEU B 13 13.543 9.905 4.490 1.00 1.48 H new ATOM 0 HD21 LEU B 13 16.042 11.316 3.405 1.00 1.50 H new ATOM 0 HD22 LEU B 13 15.164 10.044 2.523 1.00 1.50 H new ATOM 0 HD23 LEU B 13 15.446 11.625 1.757 1.00 1.50 H new ATOM 1989 N LEU B 14 10.981 12.844 4.579 1.00 1.15 N ATOM 1990 CA LEU B 14 10.180 12.703 5.784 1.00 1.07 C ATOM 1991 C LEU B 14 8.754 13.175 5.534 1.00 1.07 C ATOM 1992 O LEU B 14 7.794 12.481 5.863 1.00 1.02 O ATOM 1993 CB LEU B 14 10.798 13.499 6.934 1.00 1.08 C ATOM 1994 CG LEU B 14 10.873 12.761 8.274 1.00 1.04 C ATOM 1995 CD1 LEU B 14 11.700 11.490 8.148 1.00 1.06 C ATOM 1996 CD2 LEU B 14 11.457 13.667 9.346 1.00 1.14 C ATOM 0 H LEU B 14 11.748 13.511 4.659 1.00 1.15 H new ATOM 0 HA LEU B 14 10.159 11.648 6.058 1.00 1.07 H new ATOM 0 HB2 LEU B 14 11.806 13.799 6.646 1.00 1.08 H new ATOM 0 HB3 LEU B 14 10.221 14.413 7.073 1.00 1.08 H new ATOM 0 HG LEU B 14 9.860 12.482 8.565 1.00 1.04 H new ATOM 0 HD11 LEU B 14 11.738 10.984 9.113 1.00 1.06 H new ATOM 0 HD12 LEU B 14 11.243 10.830 7.410 1.00 1.06 H new ATOM 0 HD13 LEU B 14 12.711 11.744 7.831 1.00 1.06 H new ATOM 0 HD21 LEU B 14 11.504 13.128 10.292 1.00 1.14 H new ATOM 0 HD22 LEU B 14 12.461 13.976 9.054 1.00 1.14 H new ATOM 0 HD23 LEU B 14 10.826 14.548 9.461 1.00 1.14 H new ATOM 2008 N LYS B 15 8.622 14.344 4.922 1.00 1.15 N ATOM 2009 CA LYS B 15 7.309 14.907 4.633 1.00 1.18 C ATOM 2010 C LYS B 15 6.602 14.121 3.532 1.00 1.13 C ATOM 2011 O LYS B 15 5.375 14.017 3.524 1.00 1.11 O ATOM 2012 CB LYS B 15 7.441 16.374 4.220 1.00 1.32 C ATOM 2013 CG LYS B 15 8.043 17.256 5.299 1.00 1.46 C ATOM 2014 CD LYS B 15 7.974 18.724 4.929 1.00 1.55 C ATOM 2015 CE LYS B 15 8.216 19.612 6.140 1.00 1.76 C ATOM 2016 NZ LYS B 15 8.343 21.040 5.759 1.00 1.80 N ATOM 0 H LYS B 15 9.406 14.920 4.616 1.00 1.15 H new ATOM 0 HA LYS B 15 6.709 14.841 5.541 1.00 1.18 H new ATOM 0 HB2 LYS B 15 8.059 16.437 3.324 1.00 1.32 H new ATOM 0 HB3 LYS B 15 6.456 16.759 3.955 1.00 1.32 H new ATOM 0 HG2 LYS B 15 7.515 17.093 6.238 1.00 1.46 H new ATOM 0 HG3 LYS B 15 9.082 16.971 5.464 1.00 1.46 H new ATOM 0 HD2 LYS B 15 8.716 18.943 4.161 1.00 1.55 H new ATOM 0 HD3 LYS B 15 6.997 18.948 4.501 1.00 1.55 H new ATOM 0 HE2 LYS B 15 7.394 19.496 6.846 1.00 1.76 H new ATOM 0 HE3 LYS B 15 9.123 19.290 6.651 1.00 1.76 H new ATOM 0 HZ1 LYS B 15 9.324 21.352 5.905 1.00 1.80 H new ATOM 0 HZ2 LYS B 15 8.088 21.156 4.757 1.00 1.80 H new ATOM 0 HZ3 LYS B 15 7.706 21.614 6.347 1.00 1.80 H new ATOM 2030 N LYS B 16 7.383 13.564 2.612 1.00 1.14 N ATOM 2031 CA LYS B 16 6.833 12.797 1.499 1.00 1.14 C ATOM 2032 C LYS B 16 6.100 11.549 1.978 1.00 1.03 C ATOM 2033 O LYS B 16 4.946 11.318 1.609 1.00 1.01 O ATOM 2034 CB LYS B 16 7.948 12.397 0.528 1.00 1.22 C ATOM 2035 CG LYS B 16 8.244 13.442 -0.541 1.00 1.31 C ATOM 2036 CD LYS B 16 7.302 13.314 -1.733 1.00 1.30 C ATOM 2037 CE LYS B 16 7.605 12.069 -2.558 1.00 1.45 C ATOM 2038 NZ LYS B 16 7.060 12.168 -3.938 1.00 1.65 N ATOM 0 H LYS B 16 8.401 13.629 2.615 1.00 1.14 H new ATOM 0 HA LYS B 16 6.113 13.436 0.988 1.00 1.14 H new ATOM 0 HB2 LYS B 16 8.858 12.205 1.096 1.00 1.22 H new ATOM 0 HB3 LYS B 16 7.673 11.462 0.041 1.00 1.22 H new ATOM 0 HG2 LYS B 16 8.152 14.439 -0.110 1.00 1.31 H new ATOM 0 HG3 LYS B 16 9.275 13.335 -0.879 1.00 1.31 H new ATOM 0 HD2 LYS B 16 6.271 13.275 -1.380 1.00 1.30 H new ATOM 0 HD3 LYS B 16 7.390 14.199 -2.363 1.00 1.30 H new ATOM 0 HE2 LYS B 16 8.684 11.919 -2.604 1.00 1.45 H new ATOM 0 HE3 LYS B 16 7.182 11.195 -2.063 1.00 1.45 H new ATOM 0 HZ1 LYS B 16 7.288 11.301 -4.465 1.00 1.65 H new ATOM 0 HZ2 LYS B 16 6.028 12.286 -3.896 1.00 1.65 H new ATOM 0 HZ3 LYS B 16 7.482 12.987 -4.420 1.00 1.65 H new ATOM 2052 N ILE B 17 6.758 10.756 2.812 1.00 0.98 N ATOM 2053 CA ILE B 17 6.166 9.518 3.306 1.00 0.92 C ATOM 2054 C ILE B 17 5.147 9.777 4.419 1.00 0.89 C ATOM 2055 O ILE B 17 4.144 9.067 4.521 1.00 0.86 O ATOM 2056 CB ILE B 17 7.256 8.523 3.769 1.00 0.94 C ATOM 2057 CG1 ILE B 17 8.167 8.191 2.583 1.00 1.00 C ATOM 2058 CG2 ILE B 17 6.633 7.255 4.342 1.00 1.00 C ATOM 2059 CD1 ILE B 17 9.166 7.084 2.846 1.00 0.96 C ATOM 0 H ILE B 17 7.698 10.945 3.160 1.00 0.98 H new ATOM 0 HA ILE B 17 5.627 9.065 2.474 1.00 0.92 H new ATOM 0 HB ILE B 17 7.845 8.983 4.562 1.00 0.94 H new ATOM 0 HG12 ILE B 17 7.546 7.908 1.733 1.00 1.00 H new ATOM 0 HG13 ILE B 17 8.710 9.091 2.295 1.00 1.00 H new ATOM 0 HG21 ILE B 17 7.422 6.573 4.660 1.00 1.00 H new ATOM 0 HG22 ILE B 17 6.009 7.511 5.198 1.00 1.00 H new ATOM 0 HG23 ILE B 17 6.022 6.773 3.579 1.00 1.00 H new ATOM 0 HD11 ILE B 17 9.768 6.917 1.953 1.00 0.96 H new ATOM 0 HD12 ILE B 17 9.816 7.369 3.673 1.00 0.96 H new ATOM 0 HD13 ILE B 17 8.634 6.167 3.102 1.00 0.96 H new ATOM 2071 N ASP B 18 5.378 10.803 5.234 1.00 0.94 N ATOM 2072 CA ASP B 18 4.450 11.131 6.316 1.00 0.99 C ATOM 2073 C ASP B 18 3.079 11.506 5.748 1.00 0.96 C ATOM 2074 O ASP B 18 2.041 11.097 6.271 1.00 0.94 O ATOM 2075 CB ASP B 18 5.001 12.277 7.170 1.00 1.14 C ATOM 2076 CG ASP B 18 4.052 12.702 8.272 1.00 1.29 C ATOM 2077 OD1 ASP B 18 3.626 11.837 9.068 1.00 1.88 O ATOM 2078 OD2 ASP B 18 3.751 13.912 8.363 1.00 1.59 O ATOM 0 H ASP B 18 6.190 11.417 5.169 1.00 0.94 H new ATOM 0 HA ASP B 18 4.337 10.251 6.949 1.00 0.99 H new ATOM 0 HB2 ASP B 18 5.949 11.970 7.612 1.00 1.14 H new ATOM 0 HB3 ASP B 18 5.211 13.133 6.528 1.00 1.14 H new ATOM 2083 N SER B 19 3.087 12.260 4.659 1.00 0.98 N ATOM 2084 CA SER B 19 1.847 12.672 4.006 1.00 0.99 C ATOM 2085 C SER B 19 1.223 11.495 3.263 1.00 0.91 C ATOM 2086 O SER B 19 0.002 11.407 3.126 1.00 0.90 O ATOM 2087 CB SER B 19 2.104 13.821 3.033 1.00 1.10 C ATOM 2088 OG SER B 19 2.825 14.865 3.661 1.00 1.21 O ATOM 0 H SER B 19 3.936 12.600 4.207 1.00 0.98 H new ATOM 0 HA SER B 19 1.156 13.015 4.776 1.00 0.99 H new ATOM 0 HB2 SER B 19 2.663 13.455 2.172 1.00 1.10 H new ATOM 0 HB3 SER B 19 1.155 14.204 2.658 1.00 1.10 H new ATOM 0 HG SER B 19 3.786 14.694 3.579 1.00 1.21 H new ATOM 2094 N LEU B 20 2.080 10.595 2.790 1.00 0.87 N ATOM 2095 CA LEU B 20 1.646 9.412 2.051 1.00 0.84 C ATOM 2096 C LEU B 20 0.674 8.566 2.876 1.00 0.80 C ATOM 2097 O LEU B 20 -0.417 8.230 2.413 1.00 0.79 O ATOM 2098 CB LEU B 20 2.868 8.578 1.652 1.00 0.86 C ATOM 2099 CG LEU B 20 2.571 7.340 0.809 1.00 0.91 C ATOM 2100 CD1 LEU B 20 2.223 7.750 -0.612 1.00 1.07 C ATOM 2101 CD2 LEU B 20 3.763 6.399 0.840 1.00 1.35 C ATOM 0 H LEU B 20 3.091 10.664 2.907 1.00 0.87 H new ATOM 0 HA LEU B 20 1.121 9.740 1.154 1.00 0.84 H new ATOM 0 HB2 LEU B 20 3.557 9.216 1.099 1.00 0.86 H new ATOM 0 HB3 LEU B 20 3.384 8.263 2.559 1.00 0.86 H new ATOM 0 HG LEU B 20 1.712 6.812 1.224 1.00 0.91 H new ATOM 0 HD11 LEU B 20 2.013 6.861 -1.206 1.00 1.07 H new ATOM 0 HD12 LEU B 20 1.344 8.394 -0.600 1.00 1.07 H new ATOM 0 HD13 LEU B 20 3.062 8.289 -1.051 1.00 1.07 H new ATOM 0 HD21 LEU B 20 3.546 5.517 0.237 1.00 1.35 H new ATOM 0 HD22 LEU B 20 4.639 6.908 0.437 1.00 1.35 H new ATOM 0 HD23 LEU B 20 3.961 6.096 1.868 1.00 1.35 H new ATOM 2113 N ILE B 21 1.065 8.243 4.106 1.00 0.81 N ATOM 2114 CA ILE B 21 0.217 7.433 4.981 1.00 0.82 C ATOM 2115 C ILE B 21 -1.027 8.209 5.400 1.00 0.81 C ATOM 2116 O ILE B 21 -2.073 7.620 5.677 1.00 0.81 O ATOM 2117 CB ILE B 21 0.967 6.943 6.241 1.00 0.88 C ATOM 2118 CG1 ILE B 21 1.776 8.077 6.877 1.00 1.19 C ATOM 2119 CG2 ILE B 21 1.870 5.768 5.896 1.00 1.21 C ATOM 2120 CD1 ILE B 21 2.273 7.759 8.272 1.00 1.38 C ATOM 0 H ILE B 21 1.954 8.526 4.518 1.00 0.81 H new ATOM 0 HA ILE B 21 -0.076 6.556 4.403 1.00 0.82 H new ATOM 0 HB ILE B 21 0.227 6.611 6.969 1.00 0.88 H new ATOM 0 HG12 ILE B 21 2.630 8.305 6.239 1.00 1.19 H new ATOM 0 HG13 ILE B 21 1.159 8.975 6.916 1.00 1.19 H new ATOM 0 HG21 ILE B 21 2.391 5.434 6.793 1.00 1.21 H new ATOM 0 HG22 ILE B 21 1.268 4.950 5.501 1.00 1.21 H new ATOM 0 HG23 ILE B 21 2.599 6.077 5.147 1.00 1.21 H new ATOM 0 HD11 ILE B 21 2.837 8.607 8.659 1.00 1.38 H new ATOM 0 HD12 ILE B 21 1.423 7.560 8.925 1.00 1.38 H new ATOM 0 HD13 ILE B 21 2.917 6.880 8.237 1.00 1.38 H new ATOM 2132 N GLU B 22 -0.910 9.531 5.433 1.00 0.83 N ATOM 2133 CA GLU B 22 -2.026 10.386 5.805 1.00 0.86 C ATOM 2134 C GLU B 22 -3.110 10.329 4.732 1.00 0.83 C ATOM 2135 O GLU B 22 -4.301 10.258 5.034 1.00 0.84 O ATOM 2136 CB GLU B 22 -1.551 11.829 5.989 1.00 0.94 C ATOM 2137 CG GLU B 22 -1.931 12.440 7.327 1.00 1.11 C ATOM 2138 CD GLU B 22 -3.371 12.161 7.708 1.00 1.55 C ATOM 2139 OE1 GLU B 22 -4.271 12.867 7.206 1.00 1.98 O ATOM 2140 OE2 GLU B 22 -3.609 11.231 8.510 1.00 1.95 O ATOM 0 H GLU B 22 -0.052 10.033 5.206 1.00 0.83 H new ATOM 0 HA GLU B 22 -2.439 10.029 6.748 1.00 0.86 H new ATOM 0 HB2 GLU B 22 -0.467 11.860 5.882 1.00 0.94 H new ATOM 0 HB3 GLU B 22 -1.968 12.442 5.190 1.00 0.94 H new ATOM 0 HG2 GLU B 22 -1.272 12.048 8.101 1.00 1.11 H new ATOM 0 HG3 GLU B 22 -1.772 13.518 7.288 1.00 1.11 H new ATOM 2147 N ALA B 23 -2.680 10.354 3.475 1.00 0.82 N ATOM 2148 CA ALA B 23 -3.597 10.297 2.348 1.00 0.83 C ATOM 2149 C ALA B 23 -4.416 9.009 2.391 1.00 0.79 C ATOM 2150 O ALA B 23 -5.641 9.037 2.261 1.00 0.80 O ATOM 2151 CB ALA B 23 -2.832 10.402 1.039 1.00 0.86 C ATOM 0 H ALA B 23 -1.696 10.414 3.213 1.00 0.82 H new ATOM 0 HA ALA B 23 -4.283 11.141 2.415 1.00 0.83 H new ATOM 0 HB1 ALA B 23 -3.532 10.358 0.204 1.00 0.86 H new ATOM 0 HB2 ALA B 23 -2.290 11.347 1.009 1.00 0.86 H new ATOM 0 HB3 ALA B 23 -2.125 9.576 0.964 1.00 0.86 H new ATOM 2157 N ILE B 24 -3.731 7.889 2.596 1.00 0.78 N ATOM 2158 CA ILE B 24 -4.387 6.590 2.669 1.00 0.78 C ATOM 2159 C ILE B 24 -5.329 6.535 3.873 1.00 0.74 C ATOM 2160 O ILE B 24 -6.421 5.965 3.797 1.00 0.74 O ATOM 2161 CB ILE B 24 -3.344 5.441 2.728 1.00 0.83 C ATOM 2162 CG1 ILE B 24 -2.875 5.098 1.311 1.00 0.99 C ATOM 2163 CG2 ILE B 24 -3.910 4.203 3.417 1.00 1.03 C ATOM 2164 CD1 ILE B 24 -1.376 5.178 1.115 1.00 0.89 C ATOM 0 H ILE B 24 -2.718 7.856 2.715 1.00 0.78 H new ATOM 0 HA ILE B 24 -4.978 6.455 1.763 1.00 0.78 H new ATOM 0 HB ILE B 24 -2.494 5.782 3.319 1.00 0.83 H new ATOM 0 HG12 ILE B 24 -3.209 4.090 1.064 1.00 0.99 H new ATOM 0 HG13 ILE B 24 -3.358 5.775 0.607 1.00 0.99 H new ATOM 0 HG21 ILE B 24 -3.152 3.420 3.439 1.00 1.03 H new ATOM 0 HG22 ILE B 24 -4.201 4.455 4.437 1.00 1.03 H new ATOM 0 HG23 ILE B 24 -4.782 3.848 2.868 1.00 1.03 H new ATOM 0 HD11 ILE B 24 -1.129 4.920 0.085 1.00 0.89 H new ATOM 0 HD12 ILE B 24 -1.035 6.191 1.327 1.00 0.89 H new ATOM 0 HD13 ILE B 24 -0.883 4.480 1.792 1.00 0.89 H new ATOM 2176 N LYS B 25 -4.912 7.159 4.972 1.00 0.74 N ATOM 2177 CA LYS B 25 -5.721 7.194 6.182 1.00 0.75 C ATOM 2178 C LYS B 25 -7.019 7.961 5.928 1.00 0.78 C ATOM 2179 O LYS B 25 -8.082 7.603 6.436 1.00 0.80 O ATOM 2180 CB LYS B 25 -4.935 7.836 7.331 1.00 0.79 C ATOM 2181 CG LYS B 25 -5.671 7.833 8.665 1.00 0.88 C ATOM 2182 CD LYS B 25 -6.115 6.433 9.057 1.00 1.17 C ATOM 2183 CE LYS B 25 -6.810 6.426 10.409 1.00 1.48 C ATOM 2184 NZ LYS B 25 -5.886 6.796 11.513 1.00 1.72 N ATOM 0 H LYS B 25 -4.019 7.646 5.047 1.00 0.74 H new ATOM 0 HA LYS B 25 -5.971 6.171 6.465 1.00 0.75 H new ATOM 0 HB2 LYS B 25 -3.989 7.308 7.449 1.00 0.79 H new ATOM 0 HB3 LYS B 25 -4.695 8.865 7.063 1.00 0.79 H new ATOM 0 HG2 LYS B 25 -5.022 8.240 9.440 1.00 0.88 H new ATOM 0 HG3 LYS B 25 -6.541 8.487 8.603 1.00 0.88 H new ATOM 0 HD2 LYS B 25 -6.790 6.039 8.298 1.00 1.17 H new ATOM 0 HD3 LYS B 25 -5.249 5.771 9.088 1.00 1.17 H new ATOM 0 HE2 LYS B 25 -7.648 7.123 10.389 1.00 1.48 H new ATOM 0 HE3 LYS B 25 -7.223 5.435 10.599 1.00 1.48 H new ATOM 0 HZ1 LYS B 25 -6.342 6.600 12.427 1.00 1.72 H new ATOM 0 HZ2 LYS B 25 -5.012 6.238 11.436 1.00 1.72 H new ATOM 0 HZ3 LYS B 25 -5.657 7.809 11.450 1.00 1.72 H new ATOM 2198 N LYS B 26 -6.922 9.012 5.131 1.00 0.80 N ATOM 2199 CA LYS B 26 -8.085 9.821 4.799 1.00 0.85 C ATOM 2200 C LYS B 26 -9.013 9.074 3.845 1.00 0.83 C ATOM 2201 O LYS B 26 -10.232 9.191 3.944 1.00 0.86 O ATOM 2202 CB LYS B 26 -7.653 11.149 4.180 1.00 0.91 C ATOM 2203 CG LYS B 26 -7.972 12.350 5.052 1.00 1.01 C ATOM 2204 CD LYS B 26 -9.471 12.582 5.151 1.00 1.13 C ATOM 2205 CE LYS B 26 -9.863 13.099 6.527 1.00 1.38 C ATOM 2206 NZ LYS B 26 -11.273 13.570 6.564 1.00 1.39 N ATOM 0 H LYS B 26 -6.051 9.326 4.702 1.00 0.80 H new ATOM 0 HA LYS B 26 -8.630 10.023 5.721 1.00 0.85 H new ATOM 0 HB2 LYS B 26 -6.580 11.121 3.990 1.00 0.91 H new ATOM 0 HB3 LYS B 26 -8.145 11.269 3.215 1.00 0.91 H new ATOM 0 HG2 LYS B 26 -7.559 12.197 6.049 1.00 1.01 H new ATOM 0 HG3 LYS B 26 -7.491 13.238 4.641 1.00 1.01 H new ATOM 0 HD2 LYS B 26 -9.781 13.298 4.390 1.00 1.13 H new ATOM 0 HD3 LYS B 26 -9.999 11.651 4.947 1.00 1.13 H new ATOM 0 HE2 LYS B 26 -9.726 12.308 7.264 1.00 1.38 H new ATOM 0 HE3 LYS B 26 -9.200 13.917 6.809 1.00 1.38 H new ATOM 0 HZ1 LYS B 26 -11.530 13.819 7.540 1.00 1.39 H new ATOM 0 HZ2 LYS B 26 -11.376 14.407 5.955 1.00 1.39 H new ATOM 0 HZ3 LYS B 26 -11.901 12.814 6.222 1.00 1.39 H new ATOM 2220 N ILE B 27 -8.428 8.307 2.930 1.00 0.80 N ATOM 2221 CA ILE B 27 -9.197 7.536 1.954 1.00 0.81 C ATOM 2222 C ILE B 27 -10.232 6.641 2.648 1.00 0.80 C ATOM 2223 O ILE B 27 -11.418 6.663 2.313 1.00 0.82 O ATOM 2224 CB ILE B 27 -8.267 6.666 1.071 1.00 0.81 C ATOM 2225 CG1 ILE B 27 -7.481 7.540 0.082 1.00 0.79 C ATOM 2226 CG2 ILE B 27 -9.066 5.601 0.327 1.00 0.90 C ATOM 2227 CD1 ILE B 27 -8.338 8.172 -0.998 1.00 1.04 C ATOM 0 H ILE B 27 -7.417 8.201 2.843 1.00 0.80 H new ATOM 0 HA ILE B 27 -9.719 8.250 1.318 1.00 0.81 H new ATOM 0 HB ILE B 27 -7.554 6.163 1.725 1.00 0.81 H new ATOM 0 HG12 ILE B 27 -6.972 8.329 0.635 1.00 0.79 H new ATOM 0 HG13 ILE B 27 -6.709 6.932 -0.390 1.00 0.79 H new ATOM 0 HG21 ILE B 27 -8.392 5.003 -0.286 1.00 0.90 H new ATOM 0 HG22 ILE B 27 -9.571 4.956 1.046 1.00 0.90 H new ATOM 0 HG23 ILE B 27 -9.807 6.082 -0.312 1.00 0.90 H new ATOM 0 HD11 ILE B 27 -7.710 8.773 -1.656 1.00 1.04 H new ATOM 0 HD12 ILE B 27 -8.827 7.390 -1.579 1.00 1.04 H new ATOM 0 HD13 ILE B 27 -9.094 8.808 -0.537 1.00 1.04 H new ATOM 2239 N ILE B 28 -9.775 5.870 3.630 1.00 0.78 N ATOM 2240 CA ILE B 28 -10.656 4.961 4.363 1.00 0.78 C ATOM 2241 C ILE B 28 -11.660 5.728 5.231 1.00 0.81 C ATOM 2242 O ILE B 28 -12.809 5.312 5.380 1.00 0.84 O ATOM 2243 CB ILE B 28 -9.854 3.960 5.236 1.00 0.77 C ATOM 2244 CG1 ILE B 28 -10.766 2.829 5.724 1.00 0.80 C ATOM 2245 CG2 ILE B 28 -9.197 4.660 6.419 1.00 0.82 C ATOM 2246 CD1 ILE B 28 -11.167 1.861 4.631 1.00 0.97 C ATOM 0 H ILE B 28 -8.803 5.855 3.938 1.00 0.78 H new ATOM 0 HA ILE B 28 -11.209 4.393 3.615 1.00 0.78 H new ATOM 0 HB ILE B 28 -9.064 3.534 4.618 1.00 0.77 H new ATOM 0 HG12 ILE B 28 -10.258 2.279 6.516 1.00 0.80 H new ATOM 0 HG13 ILE B 28 -11.665 3.262 6.163 1.00 0.80 H new ATOM 0 HG21 ILE B 28 -8.643 3.932 7.011 1.00 0.82 H new ATOM 0 HG22 ILE B 28 -8.513 5.427 6.054 1.00 0.82 H new ATOM 0 HG23 ILE B 28 -9.964 5.123 7.039 1.00 0.82 H new ATOM 0 HD11 ILE B 28 -11.812 1.088 5.048 1.00 0.97 H new ATOM 0 HD12 ILE B 28 -11.704 2.398 3.849 1.00 0.97 H new ATOM 0 HD13 ILE B 28 -10.275 1.400 4.208 1.00 0.97 H new ATOM 2258 N ALA B 29 -11.227 6.858 5.780 1.00 0.82 N ATOM 2259 CA ALA B 29 -12.074 7.671 6.641 1.00 0.87 C ATOM 2260 C ALA B 29 -13.271 8.227 5.877 1.00 0.90 C ATOM 2261 O ALA B 29 -14.405 8.162 6.353 1.00 0.93 O ATOM 2262 CB ALA B 29 -11.266 8.805 7.250 1.00 0.90 C ATOM 0 H ALA B 29 -10.288 7.232 5.642 1.00 0.82 H new ATOM 0 HA ALA B 29 -12.453 7.033 7.440 1.00 0.87 H new ATOM 0 HB1 ALA B 29 -11.910 9.406 7.892 1.00 0.90 H new ATOM 0 HB2 ALA B 29 -10.448 8.393 7.840 1.00 0.90 H new ATOM 0 HB3 ALA B 29 -10.860 9.430 6.455 1.00 0.90 H new ATOM 2268 N GLU B 30 -13.011 8.758 4.686 1.00 0.91 N ATOM 2269 CA GLU B 30 -14.061 9.333 3.855 1.00 0.95 C ATOM 2270 C GLU B 30 -15.086 8.276 3.451 1.00 0.95 C ATOM 2271 O GLU B 30 -16.287 8.537 3.469 1.00 0.96 O ATOM 2272 CB GLU B 30 -13.462 9.969 2.597 1.00 1.00 C ATOM 2273 CG GLU B 30 -12.451 11.069 2.880 1.00 1.02 C ATOM 2274 CD GLU B 30 -12.986 12.142 3.801 1.00 1.13 C ATOM 2275 OE1 GLU B 30 -13.580 13.119 3.301 1.00 1.38 O ATOM 2276 OE2 GLU B 30 -12.799 12.028 5.028 1.00 1.18 O ATOM 0 H GLU B 30 -12.079 8.801 4.275 1.00 0.91 H new ATOM 0 HA GLU B 30 -14.564 10.100 4.444 1.00 0.95 H new ATOM 0 HB2 GLU B 30 -12.981 9.192 2.004 1.00 1.00 H new ATOM 0 HB3 GLU B 30 -14.269 10.379 1.990 1.00 1.00 H new ATOM 0 HG2 GLU B 30 -11.558 10.629 3.324 1.00 1.02 H new ATOM 0 HG3 GLU B 30 -12.146 11.525 1.938 1.00 1.02 H new ATOM 2283 N PHE B 31 -14.606 7.081 3.105 1.00 0.96 N ATOM 2284 CA PHE B 31 -15.487 5.992 2.684 1.00 0.99 C ATOM 2285 C PHE B 31 -16.504 5.656 3.772 1.00 0.97 C ATOM 2286 O PHE B 31 -17.675 5.392 3.491 1.00 1.01 O ATOM 2287 CB PHE B 31 -14.664 4.750 2.327 1.00 1.01 C ATOM 2288 CG PHE B 31 -15.249 3.953 1.199 1.00 1.04 C ATOM 2289 CD1 PHE B 31 -14.961 4.279 -0.116 1.00 1.50 C ATOM 2290 CD2 PHE B 31 -16.091 2.881 1.450 1.00 1.68 C ATOM 2291 CE1 PHE B 31 -15.501 3.553 -1.160 1.00 1.59 C ATOM 2292 CE2 PHE B 31 -16.635 2.152 0.411 1.00 1.83 C ATOM 2293 CZ PHE B 31 -16.340 2.489 -0.896 1.00 1.37 C ATOM 0 H PHE B 31 -13.614 6.843 3.108 1.00 0.96 H new ATOM 0 HA PHE B 31 -16.032 6.322 1.800 1.00 0.99 H new ATOM 0 HB2 PHE B 31 -13.653 5.058 2.059 1.00 1.01 H new ATOM 0 HB3 PHE B 31 -14.581 4.113 3.207 1.00 1.01 H new ATOM 0 HD1 PHE B 31 -14.306 5.111 -0.328 1.00 1.50 H new ATOM 0 HD2 PHE B 31 -16.324 2.613 2.470 1.00 1.68 H new ATOM 0 HE1 PHE B 31 -15.267 3.817 -2.181 1.00 1.59 H new ATOM 0 HE2 PHE B 31 -17.290 1.319 0.620 1.00 1.83 H new ATOM 0 HZ PHE B 31 -16.765 1.921 -1.710 1.00 1.37 H new ATOM 2303 N ASP B 32 -16.044 5.684 5.014 1.00 0.94 N ATOM 2304 CA ASP B 32 -16.893 5.397 6.165 1.00 0.93 C ATOM 2305 C ASP B 32 -17.994 6.452 6.290 1.00 0.93 C ATOM 2306 O ASP B 32 -19.167 6.128 6.506 1.00 0.96 O ATOM 2307 CB ASP B 32 -16.034 5.353 7.434 1.00 0.94 C ATOM 2308 CG ASP B 32 -16.834 5.151 8.709 1.00 1.20 C ATOM 2309 OD1 ASP B 32 -17.706 4.258 8.744 1.00 1.64 O ATOM 2310 OD2 ASP B 32 -16.573 5.880 9.691 1.00 1.54 O ATOM 0 H ASP B 32 -15.077 5.905 5.254 1.00 0.94 H new ATOM 0 HA ASP B 32 -17.371 4.427 6.029 1.00 0.93 H new ATOM 0 HB2 ASP B 32 -15.306 4.547 7.341 1.00 0.94 H new ATOM 0 HB3 ASP B 32 -15.471 6.283 7.513 1.00 0.94 H new ATOM 2315 N VAL B 33 -17.616 7.712 6.111 1.00 0.92 N ATOM 2316 CA VAL B 33 -18.562 8.821 6.203 1.00 0.93 C ATOM 2317 C VAL B 33 -19.582 8.768 5.065 1.00 0.94 C ATOM 2318 O VAL B 33 -20.781 8.933 5.293 1.00 0.95 O ATOM 2319 CB VAL B 33 -17.839 10.185 6.176 1.00 0.94 C ATOM 2320 CG1 VAL B 33 -18.834 11.334 6.260 1.00 1.00 C ATOM 2321 CG2 VAL B 33 -16.827 10.271 7.305 1.00 0.92 C ATOM 0 H VAL B 33 -16.658 7.993 5.901 1.00 0.92 H new ATOM 0 HA VAL B 33 -19.081 8.718 7.156 1.00 0.93 H new ATOM 0 HB VAL B 33 -17.309 10.269 5.227 1.00 0.94 H new ATOM 0 HG11 VAL B 33 -18.297 12.282 6.239 1.00 1.00 H new ATOM 0 HG12 VAL B 33 -19.518 11.285 5.413 1.00 1.00 H new ATOM 0 HG13 VAL B 33 -19.400 11.258 7.188 1.00 1.00 H new ATOM 0 HG21 VAL B 33 -16.326 11.239 7.272 1.00 0.92 H new ATOM 0 HG22 VAL B 33 -17.338 10.160 8.261 1.00 0.92 H new ATOM 0 HG23 VAL B 33 -16.089 9.477 7.194 1.00 0.92 H new ATOM 2331 N VAL B 34 -19.103 8.521 3.849 1.00 0.96 N ATOM 2332 CA VAL B 34 -19.976 8.443 2.679 1.00 0.99 C ATOM 2333 C VAL B 34 -21.028 7.350 2.862 1.00 1.00 C ATOM 2334 O VAL B 34 -22.189 7.524 2.493 1.00 1.02 O ATOM 2335 CB VAL B 34 -19.171 8.174 1.386 1.00 1.02 C ATOM 2336 CG1 VAL B 34 -20.097 7.952 0.198 1.00 1.21 C ATOM 2337 CG2 VAL B 34 -18.215 9.325 1.101 1.00 1.13 C ATOM 0 H VAL B 34 -18.115 8.371 3.647 1.00 0.96 H new ATOM 0 HA VAL B 34 -20.472 9.409 2.582 1.00 0.99 H new ATOM 0 HB VAL B 34 -18.590 7.265 1.538 1.00 1.02 H new ATOM 0 HG11 VAL B 34 -19.503 7.765 -0.697 1.00 1.21 H new ATOM 0 HG12 VAL B 34 -20.739 7.093 0.393 1.00 1.21 H new ATOM 0 HG13 VAL B 34 -20.713 8.838 0.046 1.00 1.21 H new ATOM 0 HG21 VAL B 34 -17.658 9.117 0.188 1.00 1.13 H new ATOM 0 HG22 VAL B 34 -18.783 10.247 0.978 1.00 1.13 H new ATOM 0 HG23 VAL B 34 -17.520 9.435 1.933 1.00 1.13 H new ATOM 2347 N LYS B 35 -20.614 6.236 3.457 1.00 1.01 N ATOM 2348 CA LYS B 35 -21.510 5.114 3.699 1.00 1.05 C ATOM 2349 C LYS B 35 -22.673 5.537 4.597 1.00 1.03 C ATOM 2350 O LYS B 35 -23.816 5.125 4.394 1.00 1.05 O ATOM 2351 CB LYS B 35 -20.748 3.953 4.340 1.00 1.08 C ATOM 2352 CG LYS B 35 -21.299 2.589 3.966 1.00 1.13 C ATOM 2353 CD LYS B 35 -20.640 1.481 4.771 1.00 1.32 C ATOM 2354 CE LYS B 35 -20.978 0.109 4.211 1.00 1.51 C ATOM 2355 NZ LYS B 35 -20.237 -0.181 2.953 1.00 1.86 N ATOM 0 H LYS B 35 -19.658 6.087 3.781 1.00 1.01 H new ATOM 0 HA LYS B 35 -21.912 4.785 2.741 1.00 1.05 H new ATOM 0 HB2 LYS B 35 -19.701 4.007 4.042 1.00 1.08 H new ATOM 0 HB3 LYS B 35 -20.777 4.064 5.424 1.00 1.08 H new ATOM 0 HG2 LYS B 35 -22.376 2.572 4.135 1.00 1.13 H new ATOM 0 HG3 LYS B 35 -21.141 2.411 2.902 1.00 1.13 H new ATOM 0 HD2 LYS B 35 -19.559 1.621 4.767 1.00 1.32 H new ATOM 0 HD3 LYS B 35 -20.965 1.541 5.810 1.00 1.32 H new ATOM 0 HE2 LYS B 35 -20.742 -0.653 4.954 1.00 1.51 H new ATOM 0 HE3 LYS B 35 -22.050 0.049 4.022 1.00 1.51 H new ATOM 0 HZ1 LYS B 35 -20.731 -0.927 2.423 1.00 1.86 H new ATOM 0 HZ2 LYS B 35 -20.187 0.681 2.373 1.00 1.86 H new ATOM 0 HZ3 LYS B 35 -19.274 -0.500 3.183 1.00 1.86 H new ATOM 2369 N GLU B 36 -22.363 6.355 5.595 1.00 1.00 N ATOM 2370 CA GLU B 36 -23.370 6.853 6.521 1.00 1.00 C ATOM 2371 C GLU B 36 -24.242 7.924 5.862 1.00 0.96 C ATOM 2372 O GLU B 36 -25.456 7.967 6.064 1.00 0.97 O ATOM 2373 CB GLU B 36 -22.699 7.416 7.776 1.00 1.01 C ATOM 2374 CG GLU B 36 -23.653 7.609 8.945 1.00 1.15 C ATOM 2375 CD GLU B 36 -24.348 6.323 9.344 1.00 1.29 C ATOM 2376 OE1 GLU B 36 -23.745 5.522 10.088 1.00 1.57 O ATOM 2377 OE2 GLU B 36 -25.499 6.106 8.918 1.00 1.40 O ATOM 0 H GLU B 36 -21.418 6.688 5.784 1.00 1.00 H new ATOM 0 HA GLU B 36 -24.013 6.020 6.804 1.00 1.00 H new ATOM 0 HB2 GLU B 36 -21.896 6.744 8.081 1.00 1.01 H new ATOM 0 HB3 GLU B 36 -22.238 8.373 7.533 1.00 1.01 H new ATOM 0 HG2 GLU B 36 -23.101 8.000 9.800 1.00 1.15 H new ATOM 0 HG3 GLU B 36 -24.401 8.356 8.680 1.00 1.15 H new ATOM 2384 N SER B 37 -23.624 8.767 5.056 1.00 0.00 N ATOM 2385 CA SER B 37 -24.303 9.853 4.355 1.00 0.00 C ATOM 2386 C SER B 37 -25.422 9.322 3.490 1.00 0.00 C ATOM 2387 O SER B 37 -26.543 9.841 3.512 1.00 0.00 O ATOM 2388 CB SER B 37 -23.295 10.692 3.532 1.00 0.00 C ATOM 2389 OG SER B 37 -22.365 11.408 4.352 1.00 0.00 O ATOM 0 H SER B 37 -22.623 8.720 4.864 1.00 0.00 H new ATOM 0 HA SER B 37 -24.750 10.513 5.099 1.00 0.00 H new ATOM 0 HB2 SER B 37 -22.746 10.033 2.859 1.00 0.00 H new ATOM 0 HB3 SER B 37 -23.842 11.400 2.909 1.00 0.00 H new ATOM 0 HG SER B 37 -21.741 10.776 4.767 1.00 0.00 H new ATOM 2395 N VAL B 38 -25.119 8.321 2.665 1.00 0.96 N ATOM 2396 CA VAL B 38 -26.118 7.748 1.766 1.00 1.00 C ATOM 2397 C VAL B 38 -27.238 7.081 2.554 1.00 1.02 C ATOM 2398 O VAL B 38 -28.370 6.994 2.083 1.00 1.04 O ATOM 2399 CB VAL B 38 -25.511 6.740 0.764 1.00 1.05 C ATOM 2400 CG1 VAL B 38 -24.519 7.434 -0.156 1.00 1.05 C ATOM 2401 CG2 VAL B 38 -24.858 5.568 1.486 1.00 1.07 C ATOM 0 H VAL B 38 -24.196 7.893 2.601 1.00 0.96 H new ATOM 0 HA VAL B 38 -26.524 8.579 1.189 1.00 1.00 H new ATOM 0 HB VAL B 38 -26.322 6.340 0.155 1.00 1.05 H new ATOM 0 HG11 VAL B 38 -24.102 6.709 -0.855 1.00 1.05 H new ATOM 0 HG12 VAL B 38 -25.028 8.222 -0.712 1.00 1.05 H new ATOM 0 HG13 VAL B 38 -23.715 7.870 0.438 1.00 1.05 H new ATOM 0 HG21 VAL B 38 -24.440 4.877 0.754 1.00 1.07 H new ATOM 0 HG22 VAL B 38 -24.062 5.937 2.132 1.00 1.07 H new ATOM 0 HG23 VAL B 38 -25.604 5.051 2.089 1.00 1.07 H new ATOM 2411 N ASN B 39 -26.912 6.605 3.751 1.00 1.03 N ATOM 2412 CA ASN B 39 -27.894 5.965 4.619 1.00 1.07 C ATOM 2413 C ASN B 39 -28.968 6.971 5.016 1.00 1.05 C ATOM 2414 O ASN B 39 -30.161 6.727 4.839 1.00 1.08 O ATOM 2415 CB ASN B 39 -27.202 5.403 5.868 1.00 1.11 C ATOM 2416 CG ASN B 39 -28.183 4.865 6.892 1.00 1.20 C ATOM 2417 OD1 ASN B 39 -29.218 4.304 6.540 1.00 1.25 O ATOM 2418 ND2 ASN B 39 -27.862 5.029 8.167 1.00 1.25 N ATOM 0 H ASN B 39 -25.972 6.651 4.143 1.00 1.03 H new ATOM 0 HA ASN B 39 -28.365 5.142 4.081 1.00 1.07 H new ATOM 0 HB2 ASN B 39 -26.519 4.606 5.572 1.00 1.11 H new ATOM 0 HB3 ASN B 39 -26.598 6.186 6.327 1.00 1.11 H new ATOM 0 HD21 ASN B 39 -28.484 4.684 8.898 1.00 1.25 H new ATOM 0 HD22 ASN B 39 -26.993 5.500 8.418 1.00 1.25 H new ATOM 2425 N GLU B 40 -28.530 8.115 5.525 1.00 1.02 N ATOM 2426 CA GLU B 40 -29.446 9.171 5.937 1.00 1.02 C ATOM 2427 C GLU B 40 -30.218 9.713 4.738 1.00 0.98 C ATOM 2428 O GLU B 40 -31.417 9.979 4.829 1.00 1.01 O ATOM 2429 CB GLU B 40 -28.676 10.304 6.617 1.00 1.04 C ATOM 2430 CG GLU B 40 -28.243 9.970 8.033 1.00 1.24 C ATOM 2431 CD GLU B 40 -29.401 9.517 8.898 1.00 1.46 C ATOM 2432 OE1 GLU B 40 -30.486 10.133 8.821 1.00 2.04 O ATOM 2433 OE2 GLU B 40 -29.236 8.537 9.651 1.00 1.92 O ATOM 0 H GLU B 40 -27.544 8.336 5.663 1.00 1.02 H new ATOM 0 HA GLU B 40 -30.158 8.749 6.646 1.00 1.02 H new ATOM 0 HB2 GLU B 40 -27.795 10.543 6.022 1.00 1.04 H new ATOM 0 HB3 GLU B 40 -29.300 11.198 6.636 1.00 1.04 H new ATOM 0 HG2 GLU B 40 -27.486 9.186 8.003 1.00 1.24 H new ATOM 0 HG3 GLU B 40 -27.777 10.846 8.484 1.00 1.24 H new ATOM 2440 N LEU B 41 -29.522 9.856 3.615 1.00 0.95 N ATOM 2441 CA LEU B 41 -30.123 10.361 2.386 1.00 0.94 C ATOM 2442 C LEU B 41 -31.257 9.448 1.929 1.00 0.95 C ATOM 2443 O LEU B 41 -32.286 9.915 1.445 1.00 0.97 O ATOM 2444 CB LEU B 41 -29.057 10.478 1.290 1.00 0.92 C ATOM 2445 CG LEU B 41 -29.535 11.080 -0.035 1.00 0.97 C ATOM 2446 CD1 LEU B 41 -30.090 12.481 0.178 1.00 1.08 C ATOM 2447 CD2 LEU B 41 -28.400 11.108 -1.051 1.00 1.01 C ATOM 0 H LEU B 41 -28.532 9.627 3.531 1.00 0.95 H new ATOM 0 HA LEU B 41 -30.538 11.350 2.581 1.00 0.94 H new ATOM 0 HB2 LEU B 41 -28.236 11.086 1.670 1.00 0.92 H new ATOM 0 HB3 LEU B 41 -28.653 9.485 1.093 1.00 0.92 H new ATOM 0 HG LEU B 41 -30.334 10.450 -0.425 1.00 0.97 H new ATOM 0 HD11 LEU B 41 -30.423 12.889 -0.776 1.00 1.08 H new ATOM 0 HD12 LEU B 41 -30.932 12.438 0.868 1.00 1.08 H new ATOM 0 HD13 LEU B 41 -29.312 13.121 0.594 1.00 1.08 H new ATOM 0 HD21 LEU B 41 -28.759 11.539 -1.986 1.00 1.01 H new ATOM 0 HD22 LEU B 41 -27.580 11.713 -0.664 1.00 1.01 H new ATOM 0 HD23 LEU B 41 -28.048 10.092 -1.231 1.00 1.01 H new ATOM 2459 N SER B 42 -31.063 8.149 2.099 1.00 0.97 N ATOM 2460 CA SER B 42 -32.058 7.158 1.720 1.00 1.01 C ATOM 2461 C SER B 42 -33.344 7.341 2.522 1.00 1.02 C ATOM 2462 O SER B 42 -34.449 7.181 1.997 1.00 1.03 O ATOM 2463 CB SER B 42 -31.491 5.752 1.929 1.00 1.07 C ATOM 2464 OG SER B 42 -32.489 4.753 1.786 1.00 1.56 O ATOM 0 H SER B 42 -30.214 7.753 2.502 1.00 0.97 H new ATOM 0 HA SER B 42 -32.300 7.292 0.666 1.00 1.01 H new ATOM 0 HB2 SER B 42 -30.692 5.572 1.210 1.00 1.07 H new ATOM 0 HB3 SER B 42 -31.048 5.683 2.922 1.00 1.07 H new ATOM 0 HG SER B 42 -32.089 3.869 1.925 1.00 1.56 H new ATOM 2470 N GLU B 43 -33.191 7.692 3.787 1.00 1.04 N ATOM 2471 CA GLU B 43 -34.327 7.887 4.672 1.00 1.07 C ATOM 2472 C GLU B 43 -35.159 9.081 4.220 1.00 1.05 C ATOM 2473 O GLU B 43 -36.387 9.008 4.132 1.00 1.10 O ATOM 2474 CB GLU B 43 -33.833 8.089 6.108 1.00 1.12 C ATOM 2475 CG GLU B 43 -34.926 8.008 7.162 1.00 1.24 C ATOM 2476 CD GLU B 43 -35.617 9.336 7.392 1.00 1.41 C ATOM 2477 OE1 GLU B 43 -34.923 10.331 7.689 1.00 1.56 O ATOM 2478 OE2 GLU B 43 -36.859 9.390 7.286 1.00 1.92 O ATOM 0 H GLU B 43 -32.284 7.849 4.227 1.00 1.04 H new ATOM 0 HA GLU B 43 -34.960 7.001 4.636 1.00 1.07 H new ATOM 0 HB2 GLU B 43 -33.075 7.337 6.328 1.00 1.12 H new ATOM 0 HB3 GLU B 43 -33.347 9.062 6.179 1.00 1.12 H new ATOM 0 HG2 GLU B 43 -35.665 7.267 6.857 1.00 1.24 H new ATOM 0 HG3 GLU B 43 -34.495 7.660 8.101 1.00 1.24 H new ATOM 2485 N LYS B 44 -34.478 10.170 3.912 1.00 1.00 N ATOM 2486 CA LYS B 44 -35.143 11.393 3.481 1.00 1.00 C ATOM 2487 C LYS B 44 -35.820 11.216 2.113 1.00 0.98 C ATOM 2488 O LYS B 44 -36.947 11.671 1.908 1.00 1.03 O ATOM 2489 CB LYS B 44 -34.137 12.558 3.415 1.00 1.01 C ATOM 2490 CG LYS B 44 -33.085 12.565 4.519 1.00 1.06 C ATOM 2491 CD LYS B 44 -33.693 12.783 5.894 1.00 1.17 C ATOM 2492 CE LYS B 44 -32.622 12.834 6.980 1.00 1.32 C ATOM 2493 NZ LYS B 44 -32.617 11.604 7.823 1.00 1.35 N ATOM 0 H LYS B 44 -33.461 10.235 3.952 1.00 1.00 H new ATOM 0 HA LYS B 44 -35.914 11.622 4.216 1.00 1.00 H new ATOM 0 HB2 LYS B 44 -33.630 12.526 2.451 1.00 1.01 H new ATOM 0 HB3 LYS B 44 -34.689 13.497 3.454 1.00 1.01 H new ATOM 0 HG2 LYS B 44 -32.545 11.618 4.509 1.00 1.06 H new ATOM 0 HG3 LYS B 44 -32.356 13.350 4.318 1.00 1.06 H new ATOM 0 HD2 LYS B 44 -34.261 13.713 5.898 1.00 1.17 H new ATOM 0 HD3 LYS B 44 -34.396 11.980 6.113 1.00 1.17 H new ATOM 0 HE2 LYS B 44 -31.643 12.959 6.517 1.00 1.32 H new ATOM 0 HE3 LYS B 44 -32.789 13.706 7.613 1.00 1.32 H new ATOM 0 HZ1 LYS B 44 -32.917 11.844 8.790 1.00 1.35 H new ATOM 0 HZ2 LYS B 44 -33.274 10.905 7.421 1.00 1.35 H new ATOM 0 HZ3 LYS B 44 -31.657 11.204 7.847 1.00 1.35 H new ATOM 2507 N ALA B 45 -35.141 10.525 1.201 1.00 0.98 N ATOM 2508 CA ALA B 45 -35.622 10.307 -0.164 1.00 0.99 C ATOM 2509 C ALA B 45 -36.823 9.357 -0.251 1.00 1.01 C ATOM 2510 O ALA B 45 -37.567 9.380 -1.233 1.00 1.03 O ATOM 2511 CB ALA B 45 -34.457 9.824 -1.018 1.00 1.01 C ATOM 0 H ALA B 45 -34.234 10.097 1.388 1.00 0.98 H new ATOM 0 HA ALA B 45 -35.997 11.257 -0.544 1.00 0.99 H new ATOM 0 HB1 ALA B 45 -34.799 9.657 -2.039 1.00 1.01 H new ATOM 0 HB2 ALA B 45 -33.669 10.577 -1.018 1.00 1.01 H new ATOM 0 HB3 ALA B 45 -34.068 8.892 -0.609 1.00 1.01 H new ATOM 2517 N LYS B 46 -37.018 8.549 0.784 1.00 1.04 N ATOM 2518 CA LYS B 46 -38.134 7.591 0.837 1.00 1.10 C ATOM 2519 C LYS B 46 -39.496 8.269 0.668 1.00 1.12 C ATOM 2520 O LYS B 46 -40.456 7.636 0.254 1.00 1.18 O ATOM 2521 CB LYS B 46 -38.117 6.853 2.175 1.00 1.18 C ATOM 2522 CG LYS B 46 -38.428 5.366 2.064 1.00 1.46 C ATOM 2523 CD LYS B 46 -37.212 4.504 2.373 1.00 1.98 C ATOM 2524 CE LYS B 46 -36.162 4.650 1.289 1.00 2.66 C ATOM 2525 NZ LYS B 46 -35.043 3.689 1.451 1.00 3.40 N ATOM 0 H LYS B 46 -36.417 8.533 1.608 1.00 1.04 H new ATOM 0 HA LYS B 46 -37.997 6.897 0.008 1.00 1.10 H new ATOM 0 HB2 LYS B 46 -37.136 6.976 2.634 1.00 1.18 H new ATOM 0 HB3 LYS B 46 -38.842 7.317 2.844 1.00 1.18 H new ATOM 0 HG2 LYS B 46 -39.236 5.112 2.750 1.00 1.46 H new ATOM 0 HG3 LYS B 46 -38.783 5.144 1.058 1.00 1.46 H new ATOM 0 HD2 LYS B 46 -36.790 4.793 3.336 1.00 1.98 H new ATOM 0 HD3 LYS B 46 -37.512 3.460 2.457 1.00 1.98 H new ATOM 0 HE2 LYS B 46 -36.627 4.501 0.314 1.00 2.66 H new ATOM 0 HE3 LYS B 46 -35.769 5.667 1.302 1.00 2.66 H new ATOM 0 HZ1 LYS B 46 -34.140 4.204 1.447 1.00 3.40 H new ATOM 0 HZ2 LYS B 46 -35.149 3.182 2.353 1.00 3.40 H new ATOM 0 HZ3 LYS B 46 -35.055 3.006 0.666 1.00 3.40 H new ATOM 2539 N THR B 47 -39.573 9.564 0.986 1.00 1.10 N ATOM 2540 CA THR B 47 -40.835 10.311 0.893 1.00 1.16 C ATOM 2541 C THR B 47 -41.282 10.549 -0.556 1.00 1.17 C ATOM 2542 O THR B 47 -42.470 10.769 -0.811 1.00 1.27 O ATOM 2543 CB THR B 47 -40.696 11.675 1.594 1.00 1.24 C ATOM 2544 OG1 THR B 47 -39.426 12.252 1.270 1.00 1.54 O ATOM 2545 CG2 THR B 47 -40.833 11.532 3.102 1.00 1.41 C ATOM 0 H THR B 47 -38.780 10.118 1.310 1.00 1.10 H new ATOM 0 HA THR B 47 -41.592 9.698 1.383 1.00 1.16 H new ATOM 0 HB THR B 47 -41.495 12.328 1.243 1.00 1.24 H new ATOM 0 HG1 THR B 47 -38.750 11.932 1.903 1.00 1.54 H new ATOM 0 HG21 THR B 47 -40.731 12.511 3.571 1.00 1.41 H new ATOM 0 HG22 THR B 47 -41.812 11.116 3.341 1.00 1.41 H new ATOM 0 HG23 THR B 47 -40.055 10.867 3.477 1.00 1.41 H new ATOM 2553 N ASP B 48 -40.348 10.501 -1.498 1.00 1.14 N ATOM 2554 CA ASP B 48 -40.683 10.747 -2.899 1.00 1.18 C ATOM 2555 C ASP B 48 -40.360 9.536 -3.770 1.00 1.14 C ATOM 2556 O ASP B 48 -39.293 8.946 -3.647 1.00 1.10 O ATOM 2557 CB ASP B 48 -39.945 11.986 -3.414 1.00 1.23 C ATOM 2558 CG ASP B 48 -40.308 12.339 -4.848 1.00 1.28 C ATOM 2559 OD1 ASP B 48 -41.305 13.063 -5.056 1.00 1.39 O ATOM 2560 OD2 ASP B 48 -39.591 11.913 -5.778 1.00 1.43 O ATOM 0 H ASP B 48 -39.364 10.297 -1.323 1.00 1.14 H new ATOM 0 HA ASP B 48 -41.757 10.925 -2.959 1.00 1.18 H new ATOM 0 HB2 ASP B 48 -40.174 12.833 -2.768 1.00 1.23 H new ATOM 0 HB3 ASP B 48 -38.870 11.816 -3.348 1.00 1.23 H new ATOM 2565 N PRO B 49 -41.288 9.161 -4.668 1.00 1.20 N ATOM 2566 CA PRO B 49 -41.117 8.009 -5.559 1.00 1.22 C ATOM 2567 C PRO B 49 -39.907 8.137 -6.487 1.00 1.24 C ATOM 2568 O PRO B 49 -39.220 7.153 -6.763 1.00 1.24 O ATOM 2569 CB PRO B 49 -42.414 7.981 -6.377 1.00 1.33 C ATOM 2570 CG PRO B 49 -42.997 9.346 -6.242 1.00 1.36 C ATOM 2571 CD PRO B 49 -42.585 9.836 -4.884 1.00 1.29 C ATOM 0 HA PRO B 49 -40.933 7.098 -4.989 1.00 1.22 H new ATOM 0 HB2 PRO B 49 -42.215 7.741 -7.421 1.00 1.33 H new ATOM 0 HB3 PRO B 49 -43.100 7.222 -6.000 1.00 1.33 H new ATOM 0 HG2 PRO B 49 -42.627 10.008 -7.025 1.00 1.36 H new ATOM 0 HG3 PRO B 49 -44.083 9.318 -6.335 1.00 1.36 H new ATOM 0 HD2 PRO B 49 -42.485 10.921 -4.860 1.00 1.29 H new ATOM 0 HD3 PRO B 49 -43.313 9.566 -4.119 1.00 1.29 H new ATOM 2579 N GLN B 50 -39.647 9.345 -6.972 1.00 1.28 N ATOM 2580 CA GLN B 50 -38.523 9.571 -7.870 1.00 1.33 C ATOM 2581 C GLN B 50 -37.225 9.616 -7.077 1.00 1.22 C ATOM 2582 O GLN B 50 -36.202 9.074 -7.498 1.00 1.22 O ATOM 2583 CB GLN B 50 -38.716 10.866 -8.658 1.00 1.45 C ATOM 2584 CG GLN B 50 -39.978 10.868 -9.506 1.00 1.58 C ATOM 2585 CD GLN B 50 -40.802 12.133 -9.353 1.00 1.65 C ATOM 2586 OE1 GLN B 50 -41.462 12.575 -10.296 1.00 1.81 O ATOM 2587 NE2 GLN B 50 -40.786 12.724 -8.165 1.00 1.66 N ATOM 0 H GLN B 50 -40.196 10.178 -6.760 1.00 1.28 H new ATOM 0 HA GLN B 50 -38.471 8.746 -8.581 1.00 1.33 H new ATOM 0 HB2 GLN B 50 -38.752 11.705 -7.963 1.00 1.45 H new ATOM 0 HB3 GLN B 50 -37.852 11.023 -9.303 1.00 1.45 H new ATOM 0 HG2 GLN B 50 -39.704 10.746 -10.554 1.00 1.58 H new ATOM 0 HG3 GLN B 50 -40.591 10.008 -9.235 1.00 1.58 H new ATOM 0 HE21 GLN B 50 -40.228 12.330 -7.407 1.00 1.66 H new ATOM 0 HE22 GLN B 50 -41.331 13.572 -8.010 1.00 1.66 H new ATOM 2596 N ALA B 51 -37.283 10.256 -5.915 1.00 1.15 N ATOM 2597 CA ALA B 51 -36.124 10.361 -5.043 1.00 1.08 C ATOM 2598 C ALA B 51 -35.719 8.982 -4.536 1.00 1.00 C ATOM 2599 O ALA B 51 -34.533 8.645 -4.496 1.00 0.98 O ATOM 2600 CB ALA B 51 -36.418 11.290 -3.877 1.00 1.09 C ATOM 0 H ALA B 51 -38.123 10.710 -5.556 1.00 1.15 H new ATOM 0 HA ALA B 51 -35.296 10.779 -5.615 1.00 1.08 H new ATOM 0 HB1 ALA B 51 -35.540 11.357 -3.235 1.00 1.09 H new ATOM 0 HB2 ALA B 51 -36.667 12.281 -4.255 1.00 1.09 H new ATOM 0 HB3 ALA B 51 -37.258 10.899 -3.303 1.00 1.09 H new ATOM 2606 N ALA B 52 -36.714 8.183 -4.156 1.00 0.99 N ATOM 2607 CA ALA B 52 -36.469 6.836 -3.663 1.00 0.98 C ATOM 2608 C ALA B 52 -35.849 5.968 -4.751 1.00 1.02 C ATOM 2609 O ALA B 52 -35.044 5.087 -4.465 1.00 1.03 O ATOM 2610 CB ALA B 52 -37.760 6.214 -3.146 1.00 1.03 C ATOM 0 H ALA B 52 -37.698 8.449 -4.181 1.00 0.99 H new ATOM 0 HA ALA B 52 -35.763 6.897 -2.835 1.00 0.98 H new ATOM 0 HB1 ALA B 52 -37.558 5.207 -2.781 1.00 1.03 H new ATOM 0 HB2 ALA B 52 -38.156 6.822 -2.333 1.00 1.03 H new ATOM 0 HB3 ALA B 52 -38.490 6.168 -3.954 1.00 1.03 H new ATOM 2616 N GLU B 53 -36.224 6.229 -5.998 1.00 1.09 N ATOM 2617 CA GLU B 53 -35.693 5.482 -7.130 1.00 1.18 C ATOM 2618 C GLU B 53 -34.215 5.802 -7.326 1.00 1.17 C ATOM 2619 O GLU B 53 -33.405 4.907 -7.547 1.00 1.23 O ATOM 2620 CB GLU B 53 -36.487 5.799 -8.403 1.00 1.28 C ATOM 2621 CG GLU B 53 -35.762 5.444 -9.696 1.00 1.45 C ATOM 2622 CD GLU B 53 -35.691 3.950 -9.965 1.00 1.51 C ATOM 2623 OE1 GLU B 53 -35.808 3.147 -9.012 1.00 1.66 O ATOM 2624 OE2 GLU B 53 -35.510 3.567 -11.141 1.00 1.58 O ATOM 0 H GLU B 53 -36.895 6.954 -6.250 1.00 1.09 H new ATOM 0 HA GLU B 53 -35.793 4.417 -6.922 1.00 1.18 H new ATOM 0 HB2 GLU B 53 -37.434 5.260 -8.371 1.00 1.28 H new ATOM 0 HB3 GLU B 53 -36.726 6.862 -8.414 1.00 1.28 H new ATOM 0 HG2 GLU B 53 -36.266 5.931 -10.531 1.00 1.45 H new ATOM 0 HG3 GLU B 53 -34.750 5.846 -9.657 1.00 1.45 H new ATOM 2631 N LYS B 54 -33.867 7.080 -7.228 1.00 1.13 N ATOM 2632 CA LYS B 54 -32.484 7.509 -7.388 1.00 1.14 C ATOM 2633 C LYS B 54 -31.580 6.819 -6.371 1.00 1.05 C ATOM 2634 O LYS B 54 -30.479 6.383 -6.700 1.00 1.09 O ATOM 2635 CB LYS B 54 -32.377 9.026 -7.246 1.00 1.16 C ATOM 2636 CG LYS B 54 -32.531 9.772 -8.562 1.00 1.32 C ATOM 2637 CD LYS B 54 -32.470 11.276 -8.353 1.00 1.48 C ATOM 2638 CE LYS B 54 -32.222 12.027 -9.657 1.00 1.68 C ATOM 2639 NZ LYS B 54 -33.364 11.913 -10.605 1.00 2.09 N ATOM 0 H LYS B 54 -34.524 7.837 -7.038 1.00 1.13 H new ATOM 0 HA LYS B 54 -32.154 7.226 -8.388 1.00 1.14 H new ATOM 0 HB2 LYS B 54 -33.141 9.372 -6.550 1.00 1.16 H new ATOM 0 HB3 LYS B 54 -31.410 9.274 -6.808 1.00 1.16 H new ATOM 0 HG2 LYS B 54 -31.743 9.466 -9.251 1.00 1.32 H new ATOM 0 HG3 LYS B 54 -33.481 9.505 -9.025 1.00 1.32 H new ATOM 0 HD2 LYS B 54 -33.405 11.618 -7.910 1.00 1.48 H new ATOM 0 HD3 LYS B 54 -31.677 11.511 -7.643 1.00 1.48 H new ATOM 0 HE2 LYS B 54 -32.039 13.079 -9.438 1.00 1.68 H new ATOM 0 HE3 LYS B 54 -31.320 11.639 -10.131 1.00 1.68 H new ATOM 0 HZ1 LYS B 54 -33.147 12.440 -11.475 1.00 2.09 H new ATOM 0 HZ2 LYS B 54 -33.524 10.912 -10.837 1.00 2.09 H new ATOM 0 HZ3 LYS B 54 -34.220 12.308 -10.166 1.00 2.09 H new ATOM 2653 N LEU B 55 -32.062 6.704 -5.139 1.00 0.98 N ATOM 2654 CA LEU B 55 -31.302 6.055 -4.074 1.00 0.95 C ATOM 2655 C LEU B 55 -31.280 4.543 -4.276 1.00 0.99 C ATOM 2656 O LEU B 55 -30.318 3.865 -3.909 1.00 0.99 O ATOM 2657 CB LEU B 55 -31.898 6.407 -2.709 1.00 0.94 C ATOM 2658 CG LEU B 55 -31.208 7.560 -1.975 1.00 1.02 C ATOM 2659 CD1 LEU B 55 -29.811 7.154 -1.533 1.00 1.13 C ATOM 2660 CD2 LEU B 55 -31.145 8.804 -2.855 1.00 1.09 C ATOM 0 H LEU B 55 -32.977 7.052 -4.851 1.00 0.98 H new ATOM 0 HA LEU B 55 -30.275 6.418 -4.109 1.00 0.95 H new ATOM 0 HB2 LEU B 55 -32.949 6.661 -2.844 1.00 0.94 H new ATOM 0 HB3 LEU B 55 -31.863 5.521 -2.075 1.00 0.94 H new ATOM 0 HG LEU B 55 -31.797 7.796 -1.089 1.00 1.02 H new ATOM 0 HD11 LEU B 55 -29.337 7.987 -1.013 1.00 1.13 H new ATOM 0 HD12 LEU B 55 -29.876 6.298 -0.862 1.00 1.13 H new ATOM 0 HD13 LEU B 55 -29.217 6.886 -2.406 1.00 1.13 H new ATOM 0 HD21 LEU B 55 -30.651 9.609 -2.312 1.00 1.09 H new ATOM 0 HD22 LEU B 55 -30.584 8.580 -3.762 1.00 1.09 H new ATOM 0 HD23 LEU B 55 -32.156 9.113 -3.121 1.00 1.09 H new ATOM 2672 N ASN B 56 -32.347 4.026 -4.868 1.00 1.06 N ATOM 2673 CA ASN B 56 -32.471 2.601 -5.152 1.00 1.16 C ATOM 2674 C ASN B 56 -31.395 2.171 -6.144 1.00 1.20 C ATOM 2675 O ASN B 56 -30.787 1.109 -6.013 1.00 1.26 O ATOM 2676 CB ASN B 56 -33.861 2.307 -5.727 1.00 1.26 C ATOM 2677 CG ASN B 56 -34.028 0.874 -6.192 1.00 1.44 C ATOM 2678 OD1 ASN B 56 -33.581 -0.066 -5.533 1.00 1.49 O ATOM 2679 ND2 ASN B 56 -34.677 0.703 -7.333 1.00 1.58 N ATOM 0 H ASN B 56 -33.150 4.580 -5.165 1.00 1.06 H new ATOM 0 HA ASN B 56 -32.341 2.040 -4.226 1.00 1.16 H new ATOM 0 HB2 ASN B 56 -34.613 2.526 -4.969 1.00 1.26 H new ATOM 0 HB3 ASN B 56 -34.049 2.978 -6.565 1.00 1.26 H new ATOM 0 HD21 ASN B 56 -34.824 -0.237 -7.700 1.00 1.58 H new ATOM 0 HD22 ASN B 56 -35.030 1.511 -7.845 1.00 1.58 H new ATOM 2686 N LYS B 57 -31.162 3.023 -7.129 1.00 1.21 N ATOM 2687 CA LYS B 57 -30.160 2.767 -8.155 1.00 1.29 C ATOM 2688 C LYS B 57 -28.765 3.034 -7.609 1.00 1.21 C ATOM 2689 O LYS B 57 -27.797 2.382 -8.000 1.00 1.26 O ATOM 2690 CB LYS B 57 -30.424 3.641 -9.380 1.00 1.39 C ATOM 2691 CG LYS B 57 -31.875 3.622 -9.819 1.00 1.52 C ATOM 2692 CD LYS B 57 -32.118 4.521 -11.018 1.00 1.62 C ATOM 2693 CE LYS B 57 -32.175 3.717 -12.301 1.00 1.73 C ATOM 2694 NZ LYS B 57 -33.223 2.667 -12.246 1.00 1.81 N ATOM 0 H LYS B 57 -31.658 3.907 -7.241 1.00 1.21 H new ATOM 0 HA LYS B 57 -30.224 1.720 -8.451 1.00 1.29 H new ATOM 0 HB2 LYS B 57 -30.131 4.667 -9.158 1.00 1.39 H new ATOM 0 HB3 LYS B 57 -29.796 3.302 -10.204 1.00 1.39 H new ATOM 0 HG2 LYS B 57 -32.166 2.601 -10.067 1.00 1.52 H new ATOM 0 HG3 LYS B 57 -32.508 3.942 -8.992 1.00 1.52 H new ATOM 0 HD2 LYS B 57 -33.053 5.065 -10.885 1.00 1.62 H new ATOM 0 HD3 LYS B 57 -31.323 5.264 -11.086 1.00 1.62 H new ATOM 0 HE2 LYS B 57 -32.372 4.384 -13.140 1.00 1.73 H new ATOM 0 HE3 LYS B 57 -31.205 3.254 -12.483 1.00 1.73 H new ATOM 0 HZ1 LYS B 57 -33.578 2.480 -13.206 1.00 1.81 H new ATOM 0 HZ2 LYS B 57 -32.819 1.794 -11.850 1.00 1.81 H new ATOM 0 HZ3 LYS B 57 -34.007 2.990 -11.644 1.00 1.81 H new ATOM 2708 N LEU B 58 -28.678 3.994 -6.696 1.00 1.12 N ATOM 2709 CA LEU B 58 -27.412 4.365 -6.077 1.00 1.09 C ATOM 2710 C LEU B 58 -26.841 3.187 -5.285 1.00 1.08 C ATOM 2711 O LEU B 58 -25.685 2.806 -5.464 1.00 1.11 O ATOM 2712 CB LEU B 58 -27.620 5.585 -5.161 1.00 1.06 C ATOM 2713 CG LEU B 58 -26.372 6.420 -4.842 1.00 1.21 C ATOM 2714 CD1 LEU B 58 -25.571 5.790 -3.717 1.00 1.37 C ATOM 2715 CD2 LEU B 58 -25.508 6.609 -6.080 1.00 1.40 C ATOM 0 H LEU B 58 -29.478 4.534 -6.366 1.00 1.12 H new ATOM 0 HA LEU B 58 -26.697 4.628 -6.857 1.00 1.09 H new ATOM 0 HB2 LEU B 58 -28.359 6.238 -5.625 1.00 1.06 H new ATOM 0 HB3 LEU B 58 -28.048 5.237 -4.221 1.00 1.06 H new ATOM 0 HG LEU B 58 -26.705 7.404 -4.512 1.00 1.21 H new ATOM 0 HD11 LEU B 58 -24.692 6.400 -3.510 1.00 1.37 H new ATOM 0 HD12 LEU B 58 -26.189 5.728 -2.821 1.00 1.37 H new ATOM 0 HD13 LEU B 58 -25.256 4.789 -4.011 1.00 1.37 H new ATOM 0 HD21 LEU B 58 -24.631 7.204 -5.824 1.00 1.40 H new ATOM 0 HD22 LEU B 58 -25.190 5.636 -6.454 1.00 1.40 H new ATOM 0 HD23 LEU B 58 -26.083 7.123 -6.850 1.00 1.40 H new ATOM 2727 N ILE B 59 -27.674 2.603 -4.423 1.00 1.08 N ATOM 2728 CA ILE B 59 -27.258 1.472 -3.596 1.00 1.15 C ATOM 2729 C ILE B 59 -26.896 0.262 -4.465 1.00 1.25 C ATOM 2730 O ILE B 59 -25.988 -0.510 -4.134 1.00 1.32 O ATOM 2731 CB ILE B 59 -28.347 1.088 -2.558 1.00 1.20 C ATOM 2732 CG1 ILE B 59 -27.806 0.056 -1.568 1.00 1.33 C ATOM 2733 CG2 ILE B 59 -29.600 0.557 -3.233 1.00 1.22 C ATOM 2734 CD1 ILE B 59 -26.834 0.631 -0.560 1.00 1.37 C ATOM 0 H ILE B 59 -28.641 2.895 -4.280 1.00 1.08 H new ATOM 0 HA ILE B 59 -26.370 1.783 -3.046 1.00 1.15 H new ATOM 0 HB ILE B 59 -28.616 1.994 -2.015 1.00 1.20 H new ATOM 0 HG12 ILE B 59 -28.642 -0.397 -1.036 1.00 1.33 H new ATOM 0 HG13 ILE B 59 -27.311 -0.742 -2.122 1.00 1.33 H new ATOM 0 HG21 ILE B 59 -30.340 0.299 -2.475 1.00 1.22 H new ATOM 0 HG22 ILE B 59 -30.009 1.321 -3.894 1.00 1.22 H new ATOM 0 HG23 ILE B 59 -29.351 -0.331 -3.815 1.00 1.22 H new ATOM 0 HD11 ILE B 59 -26.493 -0.160 0.109 1.00 1.37 H new ATOM 0 HD12 ILE B 59 -25.978 1.059 -1.083 1.00 1.37 H new ATOM 0 HD13 ILE B 59 -27.330 1.409 0.021 1.00 1.37 H new ATOM 2746 N GLU B 60 -27.610 0.097 -5.574 1.00 1.29 N ATOM 2747 CA GLU B 60 -27.353 -1.002 -6.496 1.00 1.44 C ATOM 2748 C GLU B 60 -25.968 -0.840 -7.118 1.00 1.40 C ATOM 2749 O GLU B 60 -25.168 -1.780 -7.142 1.00 1.51 O ATOM 2750 CB GLU B 60 -28.424 -1.049 -7.590 1.00 1.54 C ATOM 2751 CG GLU B 60 -28.512 -2.394 -8.299 1.00 1.75 C ATOM 2752 CD GLU B 60 -29.246 -2.313 -9.624 1.00 1.96 C ATOM 2753 OE1 GLU B 60 -30.411 -1.865 -9.642 1.00 2.17 O ATOM 2754 OE2 GLU B 60 -28.660 -2.701 -10.657 1.00 2.28 O ATOM 0 H GLU B 60 -28.373 0.713 -5.856 1.00 1.29 H new ATOM 0 HA GLU B 60 -27.389 -1.941 -5.943 1.00 1.44 H new ATOM 0 HB2 GLU B 60 -29.393 -0.816 -7.148 1.00 1.54 H new ATOM 0 HB3 GLU B 60 -28.214 -0.273 -8.326 1.00 1.54 H new ATOM 0 HG2 GLU B 60 -27.506 -2.776 -8.469 1.00 1.75 H new ATOM 0 HG3 GLU B 60 -29.019 -3.109 -7.651 1.00 1.75 H new ATOM 2761 N GLY B 61 -25.681 0.370 -7.589 1.00 1.29 N ATOM 2762 CA GLY B 61 -24.394 0.655 -8.196 1.00 1.28 C ATOM 2763 C GLY B 61 -23.269 0.614 -7.187 1.00 1.21 C ATOM 2764 O GLY B 61 -22.112 0.422 -7.548 1.00 1.23 O ATOM 0 H GLY B 61 -26.322 1.163 -7.560 1.00 1.29 H new ATOM 0 HA2 GLY B 61 -24.198 -0.069 -8.987 1.00 1.28 H new ATOM 0 HA3 GLY B 61 -24.424 1.639 -8.665 1.00 1.28 H new ATOM 2768 N TYR B 62 -23.608 0.838 -5.930 1.00 1.19 N ATOM 2769 CA TYR B 62 -22.632 0.796 -4.850 1.00 1.23 C ATOM 2770 C TYR B 62 -22.201 -0.648 -4.611 1.00 1.35 C ATOM 2771 O TYR B 62 -21.013 -0.946 -4.472 1.00 1.37 O ATOM 2772 CB TYR B 62 -23.239 1.397 -3.577 1.00 1.28 C ATOM 2773 CG TYR B 62 -22.299 1.451 -2.391 1.00 1.60 C ATOM 2774 CD1 TYR B 62 -21.057 2.072 -2.478 1.00 2.11 C ATOM 2775 CD2 TYR B 62 -22.668 0.891 -1.174 1.00 2.25 C ATOM 2776 CE1 TYR B 62 -20.212 2.129 -1.386 1.00 2.72 C ATOM 2777 CE2 TYR B 62 -21.828 0.943 -0.079 1.00 2.90 C ATOM 2778 CZ TYR B 62 -20.602 1.563 -0.190 1.00 2.96 C ATOM 2779 OH TYR B 62 -19.765 1.624 0.903 1.00 3.75 O ATOM 0 H TYR B 62 -24.558 1.053 -5.628 1.00 1.19 H new ATOM 0 HA TYR B 62 -21.756 1.384 -5.124 1.00 1.23 H new ATOM 0 HB2 TYR B 62 -23.583 2.408 -3.797 1.00 1.28 H new ATOM 0 HB3 TYR B 62 -24.118 0.815 -3.300 1.00 1.28 H new ATOM 0 HD1 TYR B 62 -20.749 2.516 -3.413 1.00 2.11 H new ATOM 0 HD2 TYR B 62 -23.629 0.406 -1.083 1.00 2.25 H new ATOM 0 HE1 TYR B 62 -19.251 2.614 -1.469 1.00 2.72 H new ATOM 0 HE2 TYR B 62 -22.130 0.500 0.859 1.00 2.90 H new ATOM 0 HH TYR B 62 -18.938 2.089 0.656 1.00 3.75 H new ATOM 2789 N THR B 63 -23.184 -1.539 -4.582 1.00 1.51 N ATOM 2790 CA THR B 63 -22.938 -2.957 -4.381 1.00 1.71 C ATOM 2791 C THR B 63 -22.229 -3.559 -5.596 1.00 1.67 C ATOM 2792 O THR B 63 -21.329 -4.388 -5.455 1.00 1.80 O ATOM 2793 CB THR B 63 -24.254 -3.702 -4.112 1.00 1.94 C ATOM 2794 OG1 THR B 63 -24.979 -3.029 -3.075 1.00 2.00 O ATOM 2795 CG2 THR B 63 -23.999 -5.144 -3.706 1.00 2.31 C ATOM 0 H THR B 63 -24.169 -1.299 -4.697 1.00 1.51 H new ATOM 0 HA THR B 63 -22.291 -3.069 -3.511 1.00 1.71 H new ATOM 0 HB THR B 63 -24.839 -3.708 -5.032 1.00 1.94 H new ATOM 0 HG1 THR B 63 -25.377 -2.209 -3.434 1.00 2.00 H new ATOM 0 HG21 THR B 63 -24.950 -5.644 -3.523 1.00 2.31 H new ATOM 0 HG22 THR B 63 -23.467 -5.659 -4.506 1.00 2.31 H new ATOM 0 HG23 THR B 63 -23.397 -5.165 -2.798 1.00 2.31 H new ATOM 2803 N TYR B 64 -22.635 -3.130 -6.786 1.00 1.57 N ATOM 2804 CA TYR B 64 -22.022 -3.603 -8.023 1.00 1.63 C ATOM 2805 C TYR B 64 -20.931 -2.636 -8.457 1.00 1.37 C ATOM 2806 O TYR B 64 -20.600 -2.539 -9.642 1.00 1.46 O ATOM 2807 CB TYR B 64 -23.070 -3.723 -9.136 1.00 1.90 C ATOM 2808 CG TYR B 64 -24.121 -4.782 -8.894 1.00 2.42 C ATOM 2809 CD1 TYR B 64 -23.785 -6.020 -8.352 1.00 3.10 C ATOM 2810 CD2 TYR B 64 -25.449 -4.549 -9.221 1.00 2.81 C ATOM 2811 CE1 TYR B 64 -24.746 -6.990 -8.143 1.00 3.76 C ATOM 2812 CE2 TYR B 64 -26.414 -5.516 -9.017 1.00 3.50 C ATOM 2813 CZ TYR B 64 -26.057 -6.734 -8.478 1.00 3.84 C ATOM 2814 OH TYR B 64 -27.016 -7.701 -8.284 1.00 4.62 O ATOM 0 H TYR B 64 -23.387 -2.454 -6.921 1.00 1.57 H new ATOM 0 HA TYR B 64 -21.591 -4.587 -7.840 1.00 1.63 H new ATOM 0 HB2 TYR B 64 -23.564 -2.759 -9.258 1.00 1.90 H new ATOM 0 HB3 TYR B 64 -22.561 -3.941 -10.075 1.00 1.90 H new ATOM 0 HD1 TYR B 64 -22.757 -6.225 -8.091 1.00 3.10 H new ATOM 0 HD2 TYR B 64 -25.733 -3.596 -9.642 1.00 2.81 H new ATOM 0 HE1 TYR B 64 -24.471 -7.944 -7.719 1.00 3.76 H new ATOM 0 HE2 TYR B 64 -27.443 -5.319 -9.278 1.00 3.50 H new ATOM 0 HH TYR B 64 -27.888 -7.359 -8.571 1.00 4.62 H new ATOM 2824 N GLY B 65 -20.383 -1.923 -7.480 1.00 1.20 N ATOM 2825 CA GLY B 65 -19.354 -0.944 -7.740 1.00 1.11 C ATOM 2826 C GLY B 65 -18.093 -1.536 -8.323 1.00 1.04 C ATOM 2827 O GLY B 65 -17.295 -2.161 -7.614 1.00 1.03 O ATOM 0 H GLY B 65 -20.641 -2.011 -6.497 1.00 1.20 H new ATOM 0 HA2 GLY B 65 -19.744 -0.192 -8.426 1.00 1.11 H new ATOM 0 HA3 GLY B 65 -19.109 -0.431 -6.810 1.00 1.11 H new ATOM 2831 N GLU B 66 -17.911 -1.347 -9.623 1.00 1.04 N ATOM 2832 CA GLU B 66 -16.729 -1.845 -10.302 1.00 1.02 C ATOM 2833 C GLU B 66 -15.516 -1.030 -9.888 1.00 0.98 C ATOM 2834 O GLU B 66 -14.385 -1.524 -9.900 1.00 0.95 O ATOM 2835 CB GLU B 66 -16.911 -1.801 -11.817 1.00 1.10 C ATOM 2836 CG GLU B 66 -17.381 -3.128 -12.396 1.00 1.36 C ATOM 2837 CD GLU B 66 -16.523 -4.298 -11.938 1.00 1.66 C ATOM 2838 OE1 GLU B 66 -15.342 -4.370 -12.341 1.00 2.08 O ATOM 2839 OE2 GLU B 66 -17.025 -5.148 -11.172 1.00 2.08 O ATOM 0 H GLU B 66 -18.568 -0.852 -10.226 1.00 1.04 H new ATOM 0 HA GLU B 66 -16.574 -2.885 -10.014 1.00 1.02 H new ATOM 0 HB2 GLU B 66 -17.633 -1.024 -12.069 1.00 1.10 H new ATOM 0 HB3 GLU B 66 -15.966 -1.521 -12.283 1.00 1.10 H new ATOM 0 HG2 GLU B 66 -18.416 -3.303 -12.102 1.00 1.36 H new ATOM 0 HG3 GLU B 66 -17.364 -3.073 -13.484 1.00 1.36 H new ATOM 2846 N GLU B 67 -15.765 0.216 -9.505 1.00 1.00 N ATOM 2847 CA GLU B 67 -14.703 1.102 -9.064 1.00 1.01 C ATOM 2848 C GLU B 67 -14.217 0.674 -7.687 1.00 0.97 C ATOM 2849 O GLU B 67 -13.036 0.800 -7.369 1.00 0.95 O ATOM 2850 CB GLU B 67 -15.180 2.552 -9.034 1.00 1.10 C ATOM 2851 CG GLU B 67 -14.571 3.408 -10.132 1.00 1.53 C ATOM 2852 CD GLU B 67 -15.024 2.991 -11.515 1.00 1.81 C ATOM 2853 OE1 GLU B 67 -14.380 2.110 -12.116 1.00 2.28 O ATOM 2854 OE2 GLU B 67 -16.027 3.548 -12.013 1.00 2.44 O ATOM 0 H GLU B 67 -16.696 0.633 -9.492 1.00 1.00 H new ATOM 0 HA GLU B 67 -13.877 1.036 -9.772 1.00 1.01 H new ATOM 0 HB2 GLU B 67 -16.266 2.572 -9.127 1.00 1.10 H new ATOM 0 HB3 GLU B 67 -14.935 2.988 -8.065 1.00 1.10 H new ATOM 0 HG2 GLU B 67 -14.839 4.451 -9.965 1.00 1.53 H new ATOM 0 HG3 GLU B 67 -13.484 3.345 -10.076 1.00 1.53 H new ATOM 2861 N ARG B 68 -15.136 0.154 -6.873 1.00 0.98 N ATOM 2862 CA ARG B 68 -14.795 -0.322 -5.539 1.00 0.99 C ATOM 2863 C ARG B 68 -13.773 -1.442 -5.654 1.00 0.95 C ATOM 2864 O ARG B 68 -12.810 -1.513 -4.889 1.00 0.95 O ATOM 2865 CB ARG B 68 -16.040 -0.828 -4.795 1.00 1.04 C ATOM 2866 CG ARG B 68 -15.751 -1.274 -3.368 1.00 1.10 C ATOM 2867 CD ARG B 68 -16.707 -2.366 -2.909 1.00 1.41 C ATOM 2868 NE ARG B 68 -16.212 -3.064 -1.718 1.00 1.59 N ATOM 2869 CZ ARG B 68 -15.619 -4.259 -1.744 1.00 1.88 C ATOM 2870 NH1 ARG B 68 -15.474 -4.915 -2.896 1.00 2.30 N ATOM 2871 NH2 ARG B 68 -15.173 -4.799 -0.613 1.00 2.17 N ATOM 0 H ARG B 68 -16.121 0.053 -7.117 1.00 0.98 H new ATOM 0 HA ARG B 68 -14.377 0.508 -4.970 1.00 0.99 H new ATOM 0 HB2 ARG B 68 -16.790 -0.037 -4.776 1.00 1.04 H new ATOM 0 HB3 ARG B 68 -16.471 -1.662 -5.348 1.00 1.04 H new ATOM 0 HG2 ARG B 68 -14.726 -1.638 -3.302 1.00 1.10 H new ATOM 0 HG3 ARG B 68 -15.829 -0.418 -2.698 1.00 1.10 H new ATOM 0 HD2 ARG B 68 -17.682 -1.928 -2.694 1.00 1.41 H new ATOM 0 HD3 ARG B 68 -16.852 -3.084 -3.716 1.00 1.41 H new ATOM 0 HE ARG B 68 -16.328 -2.607 -0.813 1.00 1.59 H new ATOM 0 HH11 ARG B 68 -15.817 -4.504 -3.764 1.00 2.30 H new ATOM 0 HH12 ARG B 68 -15.020 -5.828 -2.909 1.00 2.30 H new ATOM 0 HH21 ARG B 68 -15.285 -4.300 0.269 1.00 2.17 H new ATOM 0 HH22 ARG B 68 -14.719 -5.712 -0.628 1.00 2.17 H new ATOM 2885 N LYS B 69 -13.985 -2.309 -6.640 1.00 0.94 N ATOM 2886 CA LYS B 69 -13.086 -3.427 -6.882 1.00 0.94 C ATOM 2887 C LYS B 69 -11.733 -2.912 -7.360 1.00 0.89 C ATOM 2888 O LYS B 69 -10.694 -3.519 -7.095 1.00 0.88 O ATOM 2889 CB LYS B 69 -13.694 -4.377 -7.912 1.00 1.00 C ATOM 2890 CG LYS B 69 -13.176 -5.802 -7.812 1.00 1.28 C ATOM 2891 CD LYS B 69 -14.105 -6.777 -8.513 1.00 1.46 C ATOM 2892 CE LYS B 69 -14.188 -6.495 -10.005 1.00 1.55 C ATOM 2893 NZ LYS B 69 -15.336 -7.192 -10.640 1.00 1.70 N ATOM 0 H LYS B 69 -14.774 -2.256 -7.284 1.00 0.94 H new ATOM 0 HA LYS B 69 -12.940 -3.976 -5.951 1.00 0.94 H new ATOM 0 HB2 LYS B 69 -14.777 -4.385 -7.791 1.00 1.00 H new ATOM 0 HB3 LYS B 69 -13.488 -3.995 -8.912 1.00 1.00 H new ATOM 0 HG2 LYS B 69 -12.182 -5.862 -8.255 1.00 1.28 H new ATOM 0 HG3 LYS B 69 -13.076 -6.082 -6.763 1.00 1.28 H new ATOM 0 HD2 LYS B 69 -13.752 -7.796 -8.354 1.00 1.46 H new ATOM 0 HD3 LYS B 69 -15.100 -6.712 -8.074 1.00 1.46 H new ATOM 0 HE2 LYS B 69 -14.282 -5.421 -10.166 1.00 1.55 H new ATOM 0 HE3 LYS B 69 -13.262 -6.810 -10.486 1.00 1.55 H new ATOM 0 HZ1 LYS B 69 -15.052 -7.547 -11.575 1.00 1.70 H new ATOM 0 HZ2 LYS B 69 -15.632 -7.990 -10.042 1.00 1.70 H new ATOM 0 HZ3 LYS B 69 -16.129 -6.528 -10.748 1.00 1.70 H new ATOM 2907 N LEU B 70 -11.754 -1.774 -8.047 1.00 0.89 N ATOM 2908 CA LEU B 70 -10.534 -1.162 -8.548 1.00 0.87 C ATOM 2909 C LEU B 70 -9.679 -0.661 -7.387 1.00 0.83 C ATOM 2910 O LEU B 70 -8.459 -0.822 -7.395 1.00 0.82 O ATOM 2911 CB LEU B 70 -10.864 -0.011 -9.503 1.00 0.91 C ATOM 2912 CG LEU B 70 -9.662 0.791 -10.008 1.00 0.96 C ATOM 2913 CD1 LEU B 70 -8.802 -0.059 -10.934 1.00 1.04 C ATOM 2914 CD2 LEU B 70 -10.131 2.050 -10.718 1.00 1.04 C ATOM 0 H LEU B 70 -12.606 -1.258 -8.268 1.00 0.89 H new ATOM 0 HA LEU B 70 -9.969 -1.915 -9.098 1.00 0.87 H new ATOM 0 HB2 LEU B 70 -11.395 -0.417 -10.364 1.00 0.91 H new ATOM 0 HB3 LEU B 70 -11.548 0.671 -8.999 1.00 0.91 H new ATOM 0 HG LEU B 70 -9.054 1.082 -9.152 1.00 0.96 H new ATOM 0 HD11 LEU B 70 -7.953 0.528 -11.283 1.00 1.04 H new ATOM 0 HD12 LEU B 70 -8.441 -0.934 -10.394 1.00 1.04 H new ATOM 0 HD13 LEU B 70 -9.396 -0.381 -11.789 1.00 1.04 H new ATOM 0 HD21 LEU B 70 -9.266 2.611 -11.072 1.00 1.04 H new ATOM 0 HD22 LEU B 70 -10.759 1.777 -11.566 1.00 1.04 H new ATOM 0 HD23 LEU B 70 -10.705 2.666 -10.025 1.00 1.04 H new ATOM 2926 N TYR B 71 -10.324 -0.071 -6.384 1.00 0.84 N ATOM 2927 CA TYR B 71 -9.607 0.431 -5.215 1.00 0.84 C ATOM 2928 C TYR B 71 -8.989 -0.733 -4.453 1.00 0.83 C ATOM 2929 O TYR B 71 -7.855 -0.655 -3.978 1.00 0.82 O ATOM 2930 CB TYR B 71 -10.542 1.210 -4.282 1.00 0.91 C ATOM 2931 CG TYR B 71 -11.423 2.225 -4.972 1.00 0.92 C ATOM 2932 CD1 TYR B 71 -10.936 3.033 -5.991 1.00 0.93 C ATOM 2933 CD2 TYR B 71 -12.748 2.376 -4.593 1.00 1.01 C ATOM 2934 CE1 TYR B 71 -11.751 3.962 -6.614 1.00 1.00 C ATOM 2935 CE2 TYR B 71 -13.569 3.301 -5.208 1.00 1.09 C ATOM 2936 CZ TYR B 71 -13.069 4.091 -6.218 1.00 1.07 C ATOM 2937 OH TYR B 71 -13.886 5.010 -6.834 1.00 1.19 O ATOM 0 H TYR B 71 -11.334 0.071 -6.356 1.00 0.84 H new ATOM 0 HA TYR B 71 -8.825 1.107 -5.562 1.00 0.84 H new ATOM 0 HB2 TYR B 71 -11.176 0.500 -3.751 1.00 0.91 H new ATOM 0 HB3 TYR B 71 -9.940 1.723 -3.532 1.00 0.91 H new ATOM 0 HD1 TYR B 71 -9.906 2.935 -6.302 1.00 0.93 H new ATOM 0 HD2 TYR B 71 -13.146 1.758 -3.801 1.00 1.01 H new ATOM 0 HE1 TYR B 71 -11.359 4.583 -7.406 1.00 1.00 H new ATOM 0 HE2 TYR B 71 -14.598 3.404 -4.898 1.00 1.09 H new ATOM 0 HH TYR B 71 -14.781 4.971 -6.436 1.00 1.19 H new ATOM 2947 N ASP B 72 -9.750 -1.812 -4.357 1.00 0.86 N ATOM 2948 CA ASP B 72 -9.301 -3.019 -3.673 1.00 0.88 C ATOM 2949 C ASP B 72 -8.053 -3.563 -4.347 1.00 0.85 C ATOM 2950 O ASP B 72 -7.069 -3.888 -3.684 1.00 0.85 O ATOM 2951 CB ASP B 72 -10.409 -4.076 -3.679 1.00 0.95 C ATOM 2952 CG ASP B 72 -10.024 -5.342 -2.930 1.00 1.07 C ATOM 2953 OD1 ASP B 72 -9.367 -6.220 -3.526 1.00 1.31 O ATOM 2954 OD2 ASP B 72 -10.396 -5.474 -1.745 1.00 1.32 O ATOM 0 H ASP B 72 -10.690 -1.878 -4.747 1.00 0.86 H new ATOM 0 HA ASP B 72 -9.064 -2.770 -2.639 1.00 0.88 H new ATOM 0 HB2 ASP B 72 -11.309 -3.654 -3.231 1.00 0.95 H new ATOM 0 HB3 ASP B 72 -10.656 -4.331 -4.710 1.00 0.95 H new ATOM 2959 N SER B 73 -8.092 -3.610 -5.674 1.00 0.84 N ATOM 2960 CA SER B 73 -6.973 -4.103 -6.465 1.00 0.83 C ATOM 2961 C SER B 73 -5.750 -3.198 -6.308 1.00 0.79 C ATOM 2962 O SER B 73 -4.610 -3.657 -6.405 1.00 0.78 O ATOM 2963 CB SER B 73 -7.367 -4.203 -7.943 1.00 0.86 C ATOM 2964 OG SER B 73 -8.591 -4.905 -8.105 1.00 0.91 O ATOM 0 H SER B 73 -8.894 -3.310 -6.227 1.00 0.84 H new ATOM 0 HA SER B 73 -6.714 -5.097 -6.099 1.00 0.83 H new ATOM 0 HB2 SER B 73 -7.461 -3.202 -8.365 1.00 0.86 H new ATOM 0 HB3 SER B 73 -6.578 -4.710 -8.498 1.00 0.86 H new ATOM 0 HG SER B 73 -9.335 -4.336 -7.816 1.00 0.91 H new ATOM 2970 N ALA B 74 -5.992 -1.914 -6.062 1.00 0.79 N ATOM 2971 CA ALA B 74 -4.914 -0.954 -5.878 1.00 0.78 C ATOM 2972 C ALA B 74 -4.176 -1.234 -4.575 1.00 0.74 C ATOM 2973 O ALA B 74 -2.952 -1.120 -4.507 1.00 0.72 O ATOM 2974 CB ALA B 74 -5.455 0.470 -5.902 1.00 0.81 C ATOM 0 H ALA B 74 -6.928 -1.516 -5.986 1.00 0.79 H new ATOM 0 HA ALA B 74 -4.208 -1.059 -6.702 1.00 0.78 H new ATOM 0 HB1 ALA B 74 -4.634 1.173 -5.763 1.00 0.81 H new ATOM 0 HB2 ALA B 74 -5.937 0.660 -6.861 1.00 0.81 H new ATOM 0 HB3 ALA B 74 -6.181 0.597 -5.099 1.00 0.81 H new ATOM 2980 N LEU B 75 -4.925 -1.618 -3.545 1.00 0.76 N ATOM 2981 CA LEU B 75 -4.333 -1.935 -2.255 1.00 0.76 C ATOM 2982 C LEU B 75 -3.540 -3.232 -2.364 1.00 0.73 C ATOM 2983 O LEU B 75 -2.515 -3.404 -1.703 1.00 0.71 O ATOM 2984 CB LEU B 75 -5.411 -2.061 -1.171 1.00 0.81 C ATOM 2985 CG LEU B 75 -5.221 -1.163 0.060 1.00 0.89 C ATOM 2986 CD1 LEU B 75 -3.769 -1.168 0.516 1.00 1.13 C ATOM 2987 CD2 LEU B 75 -5.678 0.254 -0.240 1.00 1.14 C ATOM 0 H LEU B 75 -5.940 -1.716 -3.581 1.00 0.76 H new ATOM 0 HA LEU B 75 -3.664 -1.123 -1.969 1.00 0.76 H new ATOM 0 HB2 LEU B 75 -6.379 -1.834 -1.618 1.00 0.81 H new ATOM 0 HB3 LEU B 75 -5.448 -3.099 -0.839 1.00 0.81 H new ATOM 0 HG LEU B 75 -5.833 -1.562 0.869 1.00 0.89 H new ATOM 0 HD11 LEU B 75 -3.660 -0.525 1.389 1.00 1.13 H new ATOM 0 HD12 LEU B 75 -3.472 -2.184 0.775 1.00 1.13 H new ATOM 0 HD13 LEU B 75 -3.134 -0.798 -0.289 1.00 1.13 H new ATOM 0 HD21 LEU B 75 -5.536 0.877 0.643 1.00 1.14 H new ATOM 0 HD22 LEU B 75 -5.093 0.658 -1.066 1.00 1.14 H new ATOM 0 HD23 LEU B 75 -6.733 0.246 -0.513 1.00 1.14 H new ATOM 2999 N SER B 76 -4.020 -4.140 -3.206 1.00 0.75 N ATOM 3000 CA SER B 76 -3.348 -5.411 -3.428 1.00 0.75 C ATOM 3001 C SER B 76 -1.940 -5.174 -3.976 1.00 0.72 C ATOM 3002 O SER B 76 -1.000 -5.904 -3.660 1.00 0.72 O ATOM 3003 CB SER B 76 -4.159 -6.264 -4.404 1.00 0.81 C ATOM 3004 OG SER B 76 -5.535 -6.242 -4.073 1.00 0.91 O ATOM 0 H SER B 76 -4.876 -4.017 -3.747 1.00 0.75 H new ATOM 0 HA SER B 76 -3.267 -5.941 -2.479 1.00 0.75 H new ATOM 0 HB2 SER B 76 -4.019 -5.893 -5.419 1.00 0.81 H new ATOM 0 HB3 SER B 76 -3.793 -7.291 -4.386 1.00 0.81 H new ATOM 0 HG SER B 76 -6.034 -6.793 -4.712 1.00 0.91 H new ATOM 3010 N LYS B 77 -1.803 -4.126 -4.784 1.00 0.72 N ATOM 3011 CA LYS B 77 -0.519 -3.768 -5.372 1.00 0.71 C ATOM 3012 C LYS B 77 0.445 -3.328 -4.276 1.00 0.67 C ATOM 3013 O LYS B 77 1.642 -3.610 -4.332 1.00 0.66 O ATOM 3014 CB LYS B 77 -0.692 -2.649 -6.404 1.00 0.75 C ATOM 3015 CG LYS B 77 -1.610 -3.024 -7.560 1.00 0.93 C ATOM 3016 CD LYS B 77 -2.186 -1.794 -8.248 1.00 1.09 C ATOM 3017 CE LYS B 77 -1.252 -1.251 -9.322 1.00 1.34 C ATOM 3018 NZ LYS B 77 -2.008 -0.649 -10.452 1.00 1.68 N ATOM 0 H LYS B 77 -2.571 -3.508 -5.046 1.00 0.72 H new ATOM 0 HA LYS B 77 -0.110 -4.642 -5.879 1.00 0.71 H new ATOM 0 HB2 LYS B 77 -1.091 -1.765 -5.906 1.00 0.75 H new ATOM 0 HB3 LYS B 77 0.286 -2.377 -6.801 1.00 0.75 H new ATOM 0 HG2 LYS B 77 -1.056 -3.620 -8.285 1.00 0.93 H new ATOM 0 HG3 LYS B 77 -2.424 -3.648 -7.190 1.00 0.93 H new ATOM 0 HD2 LYS B 77 -3.147 -2.046 -8.697 1.00 1.09 H new ATOM 0 HD3 LYS B 77 -2.375 -1.018 -7.506 1.00 1.09 H new ATOM 0 HE2 LYS B 77 -0.591 -0.502 -8.886 1.00 1.34 H new ATOM 0 HE3 LYS B 77 -0.619 -2.056 -9.695 1.00 1.34 H new ATOM 0 HZ1 LYS B 77 -1.340 -0.290 -11.164 1.00 1.68 H new ATOM 0 HZ2 LYS B 77 -2.620 -1.371 -10.884 1.00 1.68 H new ATOM 0 HZ3 LYS B 77 -2.593 0.135 -10.100 1.00 1.68 H new ATOM 3032 N ILE B 78 -0.098 -2.652 -3.269 1.00 0.66 N ATOM 3033 CA ILE B 78 0.697 -2.177 -2.144 1.00 0.64 C ATOM 3034 C ILE B 78 1.194 -3.356 -1.317 1.00 0.63 C ATOM 3035 O ILE B 78 2.322 -3.349 -0.825 1.00 0.64 O ATOM 3036 CB ILE B 78 -0.108 -1.223 -1.234 1.00 0.67 C ATOM 3037 CG1 ILE B 78 -0.633 -0.028 -2.028 1.00 0.90 C ATOM 3038 CG2 ILE B 78 0.747 -0.751 -0.069 1.00 0.79 C ATOM 3039 CD1 ILE B 78 0.443 0.953 -2.440 1.00 1.15 C ATOM 0 H ILE B 78 -1.090 -2.420 -3.210 1.00 0.66 H new ATOM 0 HA ILE B 78 1.543 -1.626 -2.555 1.00 0.64 H new ATOM 0 HB ILE B 78 -0.963 -1.772 -0.838 1.00 0.67 H new ATOM 0 HG12 ILE B 78 -1.141 -0.392 -2.921 1.00 0.90 H new ATOM 0 HG13 ILE B 78 -1.378 0.495 -1.429 1.00 0.90 H new ATOM 0 HG21 ILE B 78 0.164 -0.080 0.562 1.00 0.79 H new ATOM 0 HG22 ILE B 78 1.070 -1.611 0.518 1.00 0.79 H new ATOM 0 HG23 ILE B 78 1.621 -0.223 -0.450 1.00 0.79 H new ATOM 0 HD11 ILE B 78 -0.007 1.773 -2.999 1.00 1.15 H new ATOM 0 HD12 ILE B 78 0.936 1.347 -1.551 1.00 1.15 H new ATOM 0 HD13 ILE B 78 1.177 0.446 -3.067 1.00 1.15 H new ATOM 3051 N GLU B 79 0.347 -4.371 -1.176 1.00 0.65 N ATOM 3052 CA GLU B 79 0.706 -5.565 -0.418 1.00 0.67 C ATOM 3053 C GLU B 79 1.940 -6.222 -1.025 1.00 0.67 C ATOM 3054 O GLU B 79 2.840 -6.663 -0.308 1.00 0.70 O ATOM 3055 CB GLU B 79 -0.459 -6.556 -0.390 1.00 0.71 C ATOM 3056 CG GLU B 79 -0.268 -7.681 0.614 1.00 0.77 C ATOM 3057 CD GLU B 79 -1.146 -8.880 0.327 1.00 1.10 C ATOM 3058 OE1 GLU B 79 -0.968 -9.510 -0.736 1.00 1.59 O ATOM 3059 OE2 GLU B 79 -2.003 -9.211 1.171 1.00 1.74 O ATOM 0 H GLU B 79 -0.591 -4.391 -1.576 1.00 0.65 H new ATOM 0 HA GLU B 79 0.931 -5.268 0.606 1.00 0.67 H new ATOM 0 HB2 GLU B 79 -1.378 -6.019 -0.153 1.00 0.71 H new ATOM 0 HB3 GLU B 79 -0.587 -6.984 -1.384 1.00 0.71 H new ATOM 0 HG2 GLU B 79 0.777 -7.992 0.609 1.00 0.77 H new ATOM 0 HG3 GLU B 79 -0.485 -7.309 1.615 1.00 0.77 H new ATOM 3066 N LYS B 80 1.988 -6.248 -2.350 1.00 0.67 N ATOM 3067 CA LYS B 80 3.117 -6.833 -3.064 1.00 0.69 C ATOM 3068 C LYS B 80 4.386 -6.045 -2.773 1.00 0.68 C ATOM 3069 O LYS B 80 5.475 -6.609 -2.646 1.00 0.72 O ATOM 3070 CB LYS B 80 2.850 -6.854 -4.570 1.00 0.72 C ATOM 3071 CG LYS B 80 1.519 -7.484 -4.947 1.00 0.79 C ATOM 3072 CD LYS B 80 1.383 -7.650 -6.450 1.00 1.18 C ATOM 3073 CE LYS B 80 2.337 -8.707 -6.985 1.00 1.78 C ATOM 3074 NZ LYS B 80 2.048 -10.051 -6.423 1.00 2.05 N ATOM 0 H LYS B 80 1.258 -5.870 -2.954 1.00 0.67 H new ATOM 0 HA LYS B 80 3.247 -7.859 -2.720 1.00 0.69 H new ATOM 0 HB2 LYS B 80 2.878 -5.832 -4.949 1.00 0.72 H new ATOM 0 HB3 LYS B 80 3.653 -7.400 -5.065 1.00 0.72 H new ATOM 0 HG2 LYS B 80 1.427 -8.456 -4.463 1.00 0.79 H new ATOM 0 HG3 LYS B 80 0.704 -6.864 -4.574 1.00 0.79 H new ATOM 0 HD2 LYS B 80 0.358 -7.927 -6.695 1.00 1.18 H new ATOM 0 HD3 LYS B 80 1.582 -6.698 -6.941 1.00 1.18 H new ATOM 0 HE2 LYS B 80 2.264 -8.745 -8.072 1.00 1.78 H new ATOM 0 HE3 LYS B 80 3.362 -8.426 -6.744 1.00 1.78 H new ATOM 0 HZ1 LYS B 80 2.494 -10.779 -7.017 1.00 2.05 H new ATOM 0 HZ2 LYS B 80 2.428 -10.112 -5.457 1.00 2.05 H new ATOM 0 HZ3 LYS B 80 1.020 -10.204 -6.401 1.00 2.05 H new ATOM 3088 N LEU B 81 4.229 -4.733 -2.655 1.00 0.65 N ATOM 3089 CA LEU B 81 5.346 -3.845 -2.364 1.00 0.67 C ATOM 3090 C LEU B 81 5.910 -4.169 -0.988 1.00 0.68 C ATOM 3091 O LEU B 81 7.126 -4.193 -0.794 1.00 0.72 O ATOM 3092 CB LEU B 81 4.896 -2.378 -2.419 1.00 0.67 C ATOM 3093 CG LEU B 81 5.776 -1.442 -3.254 1.00 0.78 C ATOM 3094 CD1 LEU B 81 7.163 -1.311 -2.640 1.00 1.02 C ATOM 3095 CD2 LEU B 81 5.866 -1.939 -4.691 1.00 0.97 C ATOM 0 H LEU B 81 3.332 -4.258 -2.757 1.00 0.65 H new ATOM 0 HA LEU B 81 6.121 -3.994 -3.116 1.00 0.67 H new ATOM 0 HB2 LEU B 81 3.882 -2.343 -2.817 1.00 0.67 H new ATOM 0 HB3 LEU B 81 4.852 -1.992 -1.400 1.00 0.67 H new ATOM 0 HG LEU B 81 5.316 -0.454 -3.260 1.00 0.78 H new ATOM 0 HD11 LEU B 81 7.769 -0.642 -3.250 1.00 1.02 H new ATOM 0 HD12 LEU B 81 7.078 -0.905 -1.632 1.00 1.02 H new ATOM 0 HD13 LEU B 81 7.636 -2.292 -2.598 1.00 1.02 H new ATOM 0 HD21 LEU B 81 6.495 -1.263 -5.271 1.00 0.97 H new ATOM 0 HD22 LEU B 81 6.300 -2.939 -4.704 1.00 0.97 H new ATOM 0 HD23 LEU B 81 4.868 -1.971 -5.128 1.00 0.97 H new ATOM 3107 N ILE B 82 5.013 -4.440 -0.045 1.00 0.68 N ATOM 3108 CA ILE B 82 5.401 -4.783 1.317 1.00 0.72 C ATOM 3109 C ILE B 82 6.144 -6.117 1.333 1.00 0.77 C ATOM 3110 O ILE B 82 7.140 -6.281 2.036 1.00 0.81 O ATOM 3111 CB ILE B 82 4.164 -4.861 2.246 1.00 0.72 C ATOM 3112 CG1 ILE B 82 3.360 -3.563 2.156 1.00 0.70 C ATOM 3113 CG2 ILE B 82 4.586 -5.131 3.686 1.00 0.78 C ATOM 3114 CD1 ILE B 82 2.030 -3.605 2.883 1.00 0.72 C ATOM 0 H ILE B 82 4.005 -4.428 -0.202 1.00 0.68 H new ATOM 0 HA ILE B 82 6.060 -3.998 1.687 1.00 0.72 H new ATOM 0 HB ILE B 82 3.534 -5.688 1.918 1.00 0.72 H new ATOM 0 HG12 ILE B 82 3.959 -2.749 2.564 1.00 0.70 H new ATOM 0 HG13 ILE B 82 3.180 -3.332 1.106 1.00 0.70 H new ATOM 0 HG21 ILE B 82 3.701 -5.182 4.321 1.00 0.78 H new ATOM 0 HG22 ILE B 82 5.124 -6.078 3.736 1.00 0.78 H new ATOM 0 HG23 ILE B 82 5.235 -4.327 4.032 1.00 0.78 H new ATOM 0 HD11 ILE B 82 1.523 -2.647 2.770 1.00 0.72 H new ATOM 0 HD12 ILE B 82 1.409 -4.395 2.461 1.00 0.72 H new ATOM 0 HD13 ILE B 82 2.200 -3.803 3.941 1.00 0.72 H new ATOM 3126 N GLU B 83 5.662 -7.057 0.524 1.00 0.78 N ATOM 3127 CA GLU B 83 6.273 -8.379 0.427 1.00 0.85 C ATOM 3128 C GLU B 83 7.664 -8.292 -0.189 1.00 0.87 C ATOM 3129 O GLU B 83 8.511 -9.156 0.036 1.00 0.94 O ATOM 3130 CB GLU B 83 5.387 -9.325 -0.391 1.00 0.88 C ATOM 3131 CG GLU B 83 5.564 -10.794 -0.036 1.00 1.11 C ATOM 3132 CD GLU B 83 5.325 -11.076 1.436 1.00 1.73 C ATOM 3133 OE1 GLU B 83 6.245 -10.845 2.245 1.00 2.41 O ATOM 3134 OE2 GLU B 83 4.220 -11.541 1.790 1.00 2.25 O ATOM 0 H GLU B 83 4.847 -6.926 -0.076 1.00 0.78 H new ATOM 0 HA GLU B 83 6.370 -8.779 1.436 1.00 0.85 H new ATOM 0 HB2 GLU B 83 4.343 -9.048 -0.243 1.00 0.88 H new ATOM 0 HB3 GLU B 83 5.606 -9.188 -1.450 1.00 0.88 H new ATOM 0 HG2 GLU B 83 4.876 -11.393 -0.632 1.00 1.11 H new ATOM 0 HG3 GLU B 83 6.573 -11.108 -0.302 1.00 1.11 H new ATOM 3141 N THR B 84 7.896 -7.247 -0.974 1.00 0.83 N ATOM 3142 CA THR B 84 9.189 -7.042 -1.608 1.00 0.87 C ATOM 3143 C THR B 84 10.222 -6.583 -0.574 1.00 0.91 C ATOM 3144 O THR B 84 11.432 -6.713 -0.782 1.00 0.98 O ATOM 3145 CB THR B 84 9.091 -6.004 -2.749 1.00 0.84 C ATOM 3146 OG1 THR B 84 8.000 -6.340 -3.618 1.00 0.84 O ATOM 3147 CG2 THR B 84 10.374 -5.942 -3.563 1.00 0.87 C ATOM 0 H THR B 84 7.204 -6.529 -1.186 1.00 0.83 H new ATOM 0 HA THR B 84 9.507 -7.993 -2.035 1.00 0.87 H new ATOM 0 HB THR B 84 8.925 -5.027 -2.294 1.00 0.84 H new ATOM 0 HG1 THR B 84 7.157 -6.286 -3.121 1.00 0.84 H new ATOM 0 HG21 THR B 84 10.267 -5.201 -4.356 1.00 0.87 H new ATOM 0 HG22 THR B 84 11.203 -5.661 -2.914 1.00 0.87 H new ATOM 0 HG23 THR B 84 10.573 -6.919 -4.004 1.00 0.87 H new ATOM 3155 N LEU B 85 9.732 -6.080 0.554 1.00 0.90 N ATOM 3156 CA LEU B 85 10.592 -5.600 1.627 1.00 0.98 C ATOM 3157 C LEU B 85 10.965 -6.739 2.569 1.00 1.07 C ATOM 3158 O LEU B 85 12.004 -6.699 3.225 1.00 1.22 O ATOM 3159 CB LEU B 85 9.891 -4.491 2.415 1.00 0.97 C ATOM 3160 CG LEU B 85 9.459 -3.272 1.594 1.00 0.91 C ATOM 3161 CD1 LEU B 85 8.548 -2.370 2.420 1.00 1.03 C ATOM 3162 CD2 LEU B 85 10.681 -2.501 1.105 1.00 1.01 C ATOM 0 H LEU B 85 8.734 -5.994 0.749 1.00 0.90 H new ATOM 0 HA LEU B 85 11.502 -5.201 1.179 1.00 0.98 H new ATOM 0 HB2 LEU B 85 9.010 -4.913 2.898 1.00 0.97 H new ATOM 0 HB3 LEU B 85 10.559 -4.155 3.208 1.00 0.97 H new ATOM 0 HG LEU B 85 8.901 -3.618 0.724 1.00 0.91 H new ATOM 0 HD11 LEU B 85 8.250 -1.509 1.822 1.00 1.03 H new ATOM 0 HD12 LEU B 85 7.661 -2.927 2.722 1.00 1.03 H new ATOM 0 HD13 LEU B 85 9.081 -2.029 3.307 1.00 1.03 H new ATOM 0 HD21 LEU B 85 10.358 -1.638 0.523 1.00 1.01 H new ATOM 0 HD22 LEU B 85 11.265 -2.163 1.961 1.00 1.01 H new ATOM 0 HD23 LEU B 85 11.295 -3.150 0.481 1.00 1.01 H new ATOM 3174 N SER B 86 10.108 -7.753 2.632 1.00 1.08 N ATOM 3175 CA SER B 86 10.340 -8.906 3.494 1.00 1.20 C ATOM 3176 C SER B 86 11.571 -9.689 3.053 1.00 1.59 C ATOM 3177 O SER B 86 11.687 -10.071 1.885 1.00 2.11 O ATOM 3178 CB SER B 86 9.119 -9.828 3.485 1.00 1.48 C ATOM 3179 OG SER B 86 7.924 -9.095 3.266 1.00 1.78 O ATOM 0 H SER B 86 9.243 -7.799 2.094 1.00 1.08 H new ATOM 0 HA SER B 86 10.510 -8.535 4.505 1.00 1.20 H new ATOM 0 HB2 SER B 86 9.235 -10.581 2.706 1.00 1.48 H new ATOM 0 HB3 SER B 86 9.054 -10.359 4.435 1.00 1.48 H new ATOM 0 HG SER B 86 7.174 -9.717 3.159 1.00 1.78 H new