USER MOD reduce.3.24.130724 H: found=0, std=0, add=1344, rem=0, adj=41 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 56 ASN : amide:sc= 0.979 K(o=1.3,f=0.0051) USER MOD Set 1.2: B 57 LYS NZ :NH3+ -130:sc= 0.336 (180deg=-0.221) USER MOD Single : A 6 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 7 THR OG1 : rot 180:sc= 0.0154 USER MOD Single : A 9 ASN : amide:sc= 0 X(o=0,f=-0.16) USER MOD Single : A 10 LYS NZ :NH3+ 149:sc= 1.16 (180deg=-0.45) USER MOD Single : A 15 LYS NZ :NH3+ 158:sc= 1.19 (180deg=1.12) USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 SER OG : rot 86:sc= 1.24 USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 LYS NZ :NH3+ 156:sc= 1.24 (180deg=0.668) USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 SER OG : rot 71:sc= 0.25 USER MOD Single : A 39 ASN : amide:sc= 1.18 K(o=1.2,f=-0.39) USER MOD Single : A 42 SER OG : rot 73:sc= 1.22 USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 LYS NZ :NH3+ 167:sc= 1.25 (180deg=1.12) USER MOD Single : A 47 THR OG1 : rot 180:sc= 0 USER MOD Single : A 50 GLN : amide:sc= -0.16 X(o=-0.16,f=-0.64) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 ASN : amide:sc= 0.736 K(o=0.74,f=-0.91) USER MOD Single : A 57 LYS NZ :NH3+ 132:sc= 1.13 (180deg=0.073) USER MOD Single : A 62 TYR OH : rot 180:sc= 0 USER MOD Single : A 63 THR OG1 : rot 180:sc= 0.0294 USER MOD Single : A 64 TYR OH : rot 180:sc= 0 USER MOD Single : A 69 LYS NZ :NH3+ -172:sc= 1.22 (180deg=1.1) USER MOD Single : A 71 TYR OH : rot 180:sc= 0 USER MOD Single : A 73 SER OG : rot 77:sc= 1.26 USER MOD Single : A 76 SER OG : rot 180:sc= 0.0116 USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 LYS NZ :NH3+ -167:sc= -0.0136 (180deg=-0.192) USER MOD Single : A 84 THR OG1 : rot 55:sc= 0.492 USER MOD Single : A 86 SER OG : rot 180:sc= 0 USER MOD Single : B 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 15 LYS NZ :NH3+ -151:sc= 1.21 (180deg=-0.24) USER MOD Single : B 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 19 SER OG : rot 81:sc= 1.21 USER MOD Single : B 25 LYS NZ :NH3+ -169:sc= -0.0509 (180deg=-0.262) USER MOD Single : B 26 LYS NZ :NH3+ 144:sc= 1.2 (180deg=-0.501) USER MOD Single : B 35 LYS NZ :NH3+ 170:sc= -0.0353 (180deg=-0.184) USER MOD Single : B 37 SER OG : rot 70:sc= 0.275 USER MOD Single : B 39 ASN : amide:sc= 1.13 K(o=1.1,f=-0.61) USER MOD Single : B 42 SER OG : rot 84:sc= 1.31 USER MOD Single : B 44 LYS NZ :NH3+ 161:sc= 2.72 (180deg=2.6) USER MOD Single : B 46 LYS NZ :NH3+ 165:sc= -0.0699 (180deg=-0.392) USER MOD Single : B 47 THR OG1 : rot 87:sc= 1.17 USER MOD Single : B 50 GLN : amide:sc= 0.928 K(o=0.93,f=-0.014) USER MOD Single : B 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 62 TYR OH : rot 180:sc= 0 USER MOD Single : B 63 THR OG1 : rot 56:sc= 1.28 USER MOD Single : B 64 TYR OH : rot 180:sc= 0 USER MOD Single : B 69 LYS NZ :NH3+ -153:sc= 1.27 (180deg=0.371) USER MOD Single : B 71 TYR OH : rot 180:sc= 0 USER MOD Single : B 73 SER OG : rot 67:sc= 1.01 USER MOD Single : B 76 SER OG : rot 75:sc= 0.883 USER MOD Single : B 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 80 LYS NZ :NH3+ 164:sc= -0.0404 (180deg=-0.284) USER MOD Single : B 84 THR OG1 : rot 180:sc= 0.00363 USER MOD Single : B 86 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 77 N GLN A 6 -19.996 14.208 -7.804 1.00 1.91 N ATOM 78 CA GLN A 6 -19.622 12.815 -7.975 1.00 1.87 C ATOM 79 C GLN A 6 -18.321 12.684 -8.753 1.00 1.83 C ATOM 80 O GLN A 6 -17.401 11.997 -8.314 1.00 1.77 O ATOM 81 CB GLN A 6 -20.732 12.038 -8.685 1.00 1.89 C ATOM 82 CG GLN A 6 -20.402 10.566 -8.857 1.00 1.95 C ATOM 83 CD GLN A 6 -21.460 9.810 -9.631 1.00 1.96 C ATOM 84 OE1 GLN A 6 -21.400 9.712 -10.857 1.00 2.22 O ATOM 85 NE2 GLN A 6 -22.424 9.250 -8.917 1.00 2.13 N ATOM 0 HA GLN A 6 -19.474 12.392 -6.981 1.00 1.87 H new ATOM 0 HB2 GLN A 6 -21.657 12.134 -8.117 1.00 1.89 H new ATOM 0 HB3 GLN A 6 -20.911 12.482 -9.664 1.00 1.89 H new ATOM 0 HG2 GLN A 6 -19.446 10.471 -9.372 1.00 1.95 H new ATOM 0 HG3 GLN A 6 -20.282 10.109 -7.875 1.00 1.95 H new ATOM 0 HE21 GLN A 6 -22.435 9.357 -7.903 1.00 2.13 H new ATOM 0 HE22 GLN A 6 -23.156 8.712 -9.381 1.00 2.13 H new ATOM 94 N THR A 7 -18.247 13.346 -9.902 1.00 1.86 N ATOM 95 CA THR A 7 -17.056 13.292 -10.740 1.00 1.83 C ATOM 96 C THR A 7 -15.838 13.870 -10.013 1.00 1.79 C ATOM 97 O THR A 7 -14.720 13.378 -10.170 1.00 1.71 O ATOM 98 CB THR A 7 -17.272 14.052 -12.066 1.00 1.88 C ATOM 99 OG1 THR A 7 -18.620 13.866 -12.518 1.00 2.15 O ATOM 100 CG2 THR A 7 -16.306 13.560 -13.132 1.00 1.95 C ATOM 0 H THR A 7 -18.998 13.927 -10.274 1.00 1.86 H new ATOM 0 HA THR A 7 -16.868 12.241 -10.961 1.00 1.83 H new ATOM 0 HB THR A 7 -17.087 15.112 -11.890 1.00 1.88 H new ATOM 0 HG1 THR A 7 -18.753 14.351 -13.359 1.00 2.15 H new ATOM 0 HG21 THR A 7 -16.476 14.109 -14.058 1.00 1.95 H new ATOM 0 HG22 THR A 7 -15.281 13.721 -12.797 1.00 1.95 H new ATOM 0 HG23 THR A 7 -16.467 12.496 -13.306 1.00 1.95 H new ATOM 108 N ARG A 8 -16.060 14.896 -9.200 1.00 1.84 N ATOM 109 CA ARG A 8 -14.975 15.532 -8.461 1.00 1.82 C ATOM 110 C ARG A 8 -14.434 14.615 -7.367 1.00 1.75 C ATOM 111 O ARG A 8 -13.225 14.535 -7.166 1.00 1.69 O ATOM 112 CB ARG A 8 -15.445 16.862 -7.857 1.00 1.94 C ATOM 113 CG ARG A 8 -14.349 17.657 -7.151 1.00 2.03 C ATOM 114 CD ARG A 8 -13.098 17.797 -8.013 1.00 2.06 C ATOM 115 NE ARG A 8 -13.394 18.324 -9.345 1.00 2.06 N ATOM 116 CZ ARG A 8 -13.073 17.706 -10.485 1.00 2.08 C ATOM 117 NH1 ARG A 8 -12.421 16.543 -10.464 1.00 2.10 N ATOM 118 NH2 ARG A 8 -13.396 18.264 -11.643 1.00 2.22 N ATOM 0 H ARG A 8 -16.980 15.305 -9.036 1.00 1.84 H new ATOM 0 HA ARG A 8 -14.165 15.730 -9.163 1.00 1.82 H new ATOM 0 HB2 ARG A 8 -15.870 17.477 -8.650 1.00 1.94 H new ATOM 0 HB3 ARG A 8 -16.246 16.661 -7.146 1.00 1.94 H new ATOM 0 HG2 ARG A 8 -14.726 18.647 -6.897 1.00 2.03 H new ATOM 0 HG3 ARG A 8 -14.090 17.164 -6.214 1.00 2.03 H new ATOM 0 HD2 ARG A 8 -12.388 18.457 -7.514 1.00 2.06 H new ATOM 0 HD3 ARG A 8 -12.616 16.824 -8.109 1.00 2.06 H new ATOM 0 HE ARG A 8 -13.876 19.221 -9.407 1.00 2.06 H new ATOM 0 HH11 ARG A 8 -12.164 16.119 -9.573 1.00 2.10 H new ATOM 0 HH12 ARG A 8 -12.180 16.078 -11.339 1.00 2.10 H new ATOM 0 HH21 ARG A 8 -13.886 19.159 -11.659 1.00 2.22 H new ATOM 0 HH22 ARG A 8 -13.155 17.799 -12.518 1.00 2.22 H new ATOM 132 N ASN A 9 -15.331 13.934 -6.669 1.00 1.76 N ATOM 133 CA ASN A 9 -14.937 13.019 -5.602 1.00 1.72 C ATOM 134 C ASN A 9 -14.221 11.794 -6.175 1.00 1.61 C ATOM 135 O ASN A 9 -13.123 11.438 -5.738 1.00 1.56 O ATOM 136 CB ASN A 9 -16.174 12.578 -4.802 1.00 1.78 C ATOM 137 CG ASN A 9 -15.850 11.555 -3.724 1.00 1.75 C ATOM 138 OD1 ASN A 9 -15.823 10.356 -3.984 1.00 1.75 O ATOM 139 ND2 ASN A 9 -15.620 12.023 -2.505 1.00 1.84 N ATOM 0 H ASN A 9 -16.338 13.996 -6.821 1.00 1.76 H new ATOM 0 HA ASN A 9 -14.249 13.542 -4.938 1.00 1.72 H new ATOM 0 HB2 ASN A 9 -16.632 13.453 -4.340 1.00 1.78 H new ATOM 0 HB3 ASN A 9 -16.911 12.156 -5.486 1.00 1.78 H new ATOM 0 HD21 ASN A 9 -15.411 11.379 -1.742 1.00 1.84 H new ATOM 0 HD22 ASN A 9 -15.652 13.027 -2.330 1.00 1.84 H new ATOM 146 N LYS A 10 -14.843 11.185 -7.172 1.00 1.60 N ATOM 147 CA LYS A 10 -14.323 9.989 -7.830 1.00 1.52 C ATOM 148 C LYS A 10 -12.919 10.207 -8.398 1.00 1.47 C ATOM 149 O LYS A 10 -12.031 9.368 -8.230 1.00 1.41 O ATOM 150 CB LYS A 10 -15.284 9.588 -8.954 1.00 1.53 C ATOM 151 CG LYS A 10 -15.164 8.141 -9.405 1.00 1.59 C ATOM 152 CD LYS A 10 -16.271 7.782 -10.389 1.00 1.70 C ATOM 153 CE LYS A 10 -16.179 6.336 -10.837 1.00 2.07 C ATOM 154 NZ LYS A 10 -17.212 6.008 -11.855 1.00 2.48 N ATOM 0 H LYS A 10 -15.732 11.508 -7.554 1.00 1.60 H new ATOM 0 HA LYS A 10 -14.249 9.195 -7.087 1.00 1.52 H new ATOM 0 HB2 LYS A 10 -16.306 9.767 -8.621 1.00 1.53 H new ATOM 0 HB3 LYS A 10 -15.110 10.238 -9.812 1.00 1.53 H new ATOM 0 HG2 LYS A 10 -14.192 7.981 -9.872 1.00 1.59 H new ATOM 0 HG3 LYS A 10 -15.214 7.481 -8.539 1.00 1.59 H new ATOM 0 HD2 LYS A 10 -17.241 7.958 -9.924 1.00 1.70 H new ATOM 0 HD3 LYS A 10 -16.211 8.437 -11.259 1.00 1.70 H new ATOM 0 HE2 LYS A 10 -15.188 6.145 -11.250 1.00 2.07 H new ATOM 0 HE3 LYS A 10 -16.297 5.680 -9.975 1.00 2.07 H new ATOM 0 HZ1 LYS A 10 -16.846 5.277 -12.498 1.00 2.48 H new ATOM 0 HZ2 LYS A 10 -18.067 5.655 -11.380 1.00 2.48 H new ATOM 0 HZ3 LYS A 10 -17.446 6.862 -12.400 1.00 2.48 H new ATOM 168 N GLU A 11 -12.728 11.334 -9.067 1.00 1.52 N ATOM 169 CA GLU A 11 -11.445 11.662 -9.678 1.00 1.50 C ATOM 170 C GLU A 11 -10.397 12.035 -8.636 1.00 1.45 C ATOM 171 O GLU A 11 -9.210 11.752 -8.812 1.00 1.38 O ATOM 172 CB GLU A 11 -11.618 12.818 -10.662 1.00 1.58 C ATOM 173 CG GLU A 11 -10.346 13.176 -11.418 1.00 1.63 C ATOM 174 CD GLU A 11 -10.469 14.472 -12.197 1.00 1.77 C ATOM 175 OE1 GLU A 11 -11.610 14.926 -12.434 1.00 1.96 O ATOM 176 OE2 GLU A 11 -9.426 15.044 -12.576 1.00 1.90 O ATOM 0 H GLU A 11 -13.449 12.042 -9.202 1.00 1.52 H new ATOM 0 HA GLU A 11 -11.095 10.773 -10.203 1.00 1.50 H new ATOM 0 HB2 GLU A 11 -12.396 12.558 -11.380 1.00 1.58 H new ATOM 0 HB3 GLU A 11 -11.966 13.696 -10.119 1.00 1.58 H new ATOM 0 HG2 GLU A 11 -9.520 13.259 -10.711 1.00 1.63 H new ATOM 0 HG3 GLU A 11 -10.097 12.367 -12.105 1.00 1.63 H new ATOM 183 N LEU A 12 -10.840 12.660 -7.552 1.00 1.51 N ATOM 184 CA LEU A 12 -9.939 13.088 -6.491 1.00 1.50 C ATOM 185 C LEU A 12 -9.183 11.905 -5.898 1.00 1.40 C ATOM 186 O LEU A 12 -7.949 11.898 -5.863 1.00 1.33 O ATOM 187 CB LEU A 12 -10.717 13.808 -5.388 1.00 1.62 C ATOM 188 CG LEU A 12 -9.852 14.499 -4.335 1.00 1.65 C ATOM 189 CD1 LEU A 12 -9.186 15.732 -4.921 1.00 1.69 C ATOM 190 CD2 LEU A 12 -10.685 14.866 -3.117 1.00 1.82 C ATOM 0 H LEU A 12 -11.821 12.882 -7.385 1.00 1.51 H new ATOM 0 HA LEU A 12 -9.215 13.775 -6.929 1.00 1.50 H new ATOM 0 HB2 LEU A 12 -11.367 14.552 -5.849 1.00 1.62 H new ATOM 0 HB3 LEU A 12 -11.363 13.086 -4.889 1.00 1.62 H new ATOM 0 HG LEU A 12 -9.073 13.806 -4.019 1.00 1.65 H new ATOM 0 HD11 LEU A 12 -8.574 16.212 -4.158 1.00 1.69 H new ATOM 0 HD12 LEU A 12 -8.556 15.441 -5.761 1.00 1.69 H new ATOM 0 HD13 LEU A 12 -9.950 16.429 -5.265 1.00 1.69 H new ATOM 0 HD21 LEU A 12 -10.052 15.357 -2.378 1.00 1.82 H new ATOM 0 HD22 LEU A 12 -11.487 15.542 -3.415 1.00 1.82 H new ATOM 0 HD23 LEU A 12 -11.114 13.962 -2.684 1.00 1.82 H new ATOM 202 N LEU A 13 -9.924 10.901 -5.445 1.00 1.41 N ATOM 203 CA LEU A 13 -9.307 9.721 -4.856 1.00 1.35 C ATOM 204 C LEU A 13 -8.586 8.911 -5.926 1.00 1.23 C ATOM 205 O LEU A 13 -7.611 8.219 -5.638 1.00 1.18 O ATOM 206 CB LEU A 13 -10.344 8.861 -4.115 1.00 1.43 C ATOM 207 CG LEU A 13 -11.620 8.525 -4.891 1.00 1.43 C ATOM 208 CD1 LEU A 13 -11.464 7.209 -5.637 1.00 1.81 C ATOM 209 CD2 LEU A 13 -12.809 8.462 -3.947 1.00 1.76 C ATOM 0 H LEU A 13 -10.943 10.880 -5.474 1.00 1.41 H new ATOM 0 HA LEU A 13 -8.572 10.051 -4.121 1.00 1.35 H new ATOM 0 HB2 LEU A 13 -9.866 7.927 -3.819 1.00 1.43 H new ATOM 0 HB3 LEU A 13 -10.626 9.379 -3.198 1.00 1.43 H new ATOM 0 HG LEU A 13 -11.796 9.314 -5.623 1.00 1.43 H new ATOM 0 HD11 LEU A 13 -12.382 6.989 -6.182 1.00 1.81 H new ATOM 0 HD12 LEU A 13 -10.634 7.285 -6.340 1.00 1.81 H new ATOM 0 HD13 LEU A 13 -11.264 6.409 -4.925 1.00 1.81 H new ATOM 0 HD21 LEU A 13 -13.710 8.222 -4.512 1.00 1.76 H new ATOM 0 HD22 LEU A 13 -12.636 7.692 -3.195 1.00 1.76 H new ATOM 0 HD23 LEU A 13 -12.935 9.427 -3.456 1.00 1.76 H new ATOM 221 N LEU A 14 -9.058 9.022 -7.164 1.00 1.21 N ATOM 222 CA LEU A 14 -8.453 8.314 -8.285 1.00 1.13 C ATOM 223 C LEU A 14 -6.993 8.725 -8.452 1.00 1.11 C ATOM 224 O LEU A 14 -6.099 7.885 -8.463 1.00 1.04 O ATOM 225 CB LEU A 14 -9.227 8.615 -9.575 1.00 1.16 C ATOM 226 CG LEU A 14 -8.532 8.212 -10.881 1.00 1.09 C ATOM 227 CD1 LEU A 14 -8.490 6.700 -11.036 1.00 1.11 C ATOM 228 CD2 LEU A 14 -9.232 8.852 -12.072 1.00 1.23 C ATOM 0 H LEU A 14 -9.861 9.598 -7.416 1.00 1.21 H new ATOM 0 HA LEU A 14 -8.495 7.244 -8.081 1.00 1.13 H new ATOM 0 HB2 LEU A 14 -10.189 8.106 -9.526 1.00 1.16 H new ATOM 0 HB3 LEU A 14 -9.434 9.685 -9.611 1.00 1.16 H new ATOM 0 HG LEU A 14 -7.504 8.573 -10.843 1.00 1.09 H new ATOM 0 HD11 LEU A 14 -7.992 6.444 -11.971 1.00 1.11 H new ATOM 0 HD12 LEU A 14 -7.942 6.264 -10.201 1.00 1.11 H new ATOM 0 HD13 LEU A 14 -9.507 6.307 -11.047 1.00 1.11 H new ATOM 0 HD21 LEU A 14 -8.728 8.557 -12.992 1.00 1.23 H new ATOM 0 HD22 LEU A 14 -10.270 8.521 -12.105 1.00 1.23 H new ATOM 0 HD23 LEU A 14 -9.200 9.937 -11.973 1.00 1.23 H new ATOM 240 N LYS A 15 -6.763 10.028 -8.539 1.00 1.19 N ATOM 241 CA LYS A 15 -5.423 10.567 -8.722 1.00 1.19 C ATOM 242 C LYS A 15 -4.541 10.335 -7.497 1.00 1.14 C ATOM 243 O LYS A 15 -3.350 10.058 -7.628 1.00 1.09 O ATOM 244 CB LYS A 15 -5.504 12.066 -9.018 1.00 1.32 C ATOM 245 CG LYS A 15 -5.134 12.442 -10.441 1.00 1.56 C ATOM 246 CD LYS A 15 -6.352 12.875 -11.249 1.00 1.68 C ATOM 247 CE LYS A 15 -5.937 13.641 -12.489 1.00 1.70 C ATOM 248 NZ LYS A 15 -7.102 14.006 -13.344 1.00 1.93 N ATOM 0 H LYS A 15 -7.495 10.737 -8.485 1.00 1.19 H new ATOM 0 HA LYS A 15 -4.970 10.043 -9.563 1.00 1.19 H new ATOM 0 HB2 LYS A 15 -6.518 12.410 -8.816 1.00 1.32 H new ATOM 0 HB3 LYS A 15 -4.844 12.596 -8.331 1.00 1.32 H new ATOM 0 HG2 LYS A 15 -4.403 13.250 -10.425 1.00 1.56 H new ATOM 0 HG3 LYS A 15 -4.658 11.592 -10.929 1.00 1.56 H new ATOM 0 HD2 LYS A 15 -6.933 11.998 -11.536 1.00 1.68 H new ATOM 0 HD3 LYS A 15 -6.999 13.498 -10.632 1.00 1.68 H new ATOM 0 HE2 LYS A 15 -5.408 14.547 -12.194 1.00 1.70 H new ATOM 0 HE3 LYS A 15 -5.238 13.038 -13.069 1.00 1.70 H new ATOM 0 HZ1 LYS A 15 -6.849 14.812 -13.950 1.00 1.93 H new ATOM 0 HZ2 LYS A 15 -7.363 13.194 -13.939 1.00 1.93 H new ATOM 0 HZ3 LYS A 15 -7.908 14.266 -12.740 1.00 1.93 H new ATOM 262 N LYS A 16 -5.127 10.442 -6.313 1.00 1.17 N ATOM 263 CA LYS A 16 -4.375 10.270 -5.077 1.00 1.16 C ATOM 264 C LYS A 16 -3.918 8.828 -4.885 1.00 1.04 C ATOM 265 O LYS A 16 -2.769 8.587 -4.528 1.00 1.05 O ATOM 266 CB LYS A 16 -5.206 10.721 -3.870 1.00 1.26 C ATOM 267 CG LYS A 16 -5.405 12.227 -3.793 1.00 1.32 C ATOM 268 CD LYS A 16 -4.120 12.957 -3.409 1.00 1.30 C ATOM 269 CE LYS A 16 -3.887 12.943 -1.903 1.00 1.50 C ATOM 270 NZ LYS A 16 -2.670 13.709 -1.511 1.00 1.62 N ATOM 0 H LYS A 16 -6.118 10.646 -6.182 1.00 1.17 H new ATOM 0 HA LYS A 16 -3.486 10.896 -5.153 1.00 1.16 H new ATOM 0 HB2 LYS A 16 -6.181 10.236 -3.910 1.00 1.26 H new ATOM 0 HB3 LYS A 16 -4.718 10.381 -2.957 1.00 1.26 H new ATOM 0 HG2 LYS A 16 -5.757 12.596 -4.757 1.00 1.32 H new ATOM 0 HG3 LYS A 16 -6.182 12.453 -3.063 1.00 1.32 H new ATOM 0 HD2 LYS A 16 -3.273 12.490 -3.912 1.00 1.30 H new ATOM 0 HD3 LYS A 16 -4.170 13.988 -3.759 1.00 1.30 H new ATOM 0 HE2 LYS A 16 -4.757 13.365 -1.399 1.00 1.50 H new ATOM 0 HE3 LYS A 16 -3.790 11.912 -1.562 1.00 1.50 H new ATOM 0 HZ1 LYS A 16 -2.553 13.671 -0.478 1.00 1.62 H new ATOM 0 HZ2 LYS A 16 -1.835 13.292 -1.969 1.00 1.62 H new ATOM 0 HZ3 LYS A 16 -2.772 14.699 -1.811 1.00 1.62 H new ATOM 284 N ILE A 17 -4.803 7.875 -5.140 1.00 0.96 N ATOM 285 CA ILE A 17 -4.466 6.466 -4.970 1.00 0.88 C ATOM 286 C ILE A 17 -3.612 5.954 -6.138 1.00 0.85 C ATOM 287 O ILE A 17 -2.768 5.075 -5.962 1.00 0.83 O ATOM 288 CB ILE A 17 -5.740 5.602 -4.796 1.00 0.85 C ATOM 289 CG1 ILE A 17 -6.516 6.067 -3.558 1.00 1.01 C ATOM 290 CG2 ILE A 17 -5.382 4.129 -4.669 1.00 0.89 C ATOM 291 CD1 ILE A 17 -7.883 5.431 -3.406 1.00 1.02 C ATOM 0 H ILE A 17 -5.755 8.048 -5.464 1.00 0.96 H new ATOM 0 HA ILE A 17 -3.874 6.377 -4.059 1.00 0.88 H new ATOM 0 HB ILE A 17 -6.366 5.724 -5.680 1.00 0.85 H new ATOM 0 HG12 ILE A 17 -5.925 5.848 -2.669 1.00 1.01 H new ATOM 0 HG13 ILE A 17 -6.634 7.150 -3.603 1.00 1.01 H new ATOM 0 HG21 ILE A 17 -6.293 3.542 -4.548 1.00 0.89 H new ATOM 0 HG22 ILE A 17 -4.857 3.803 -5.567 1.00 0.89 H new ATOM 0 HG23 ILE A 17 -4.739 3.984 -3.801 1.00 0.89 H new ATOM 0 HD11 ILE A 17 -8.364 5.814 -2.506 1.00 1.02 H new ATOM 0 HD12 ILE A 17 -8.495 5.672 -4.275 1.00 1.02 H new ATOM 0 HD13 ILE A 17 -7.774 4.349 -3.327 1.00 1.02 H new ATOM 303 N ASP A 18 -3.810 6.520 -7.324 1.00 0.90 N ATOM 304 CA ASP A 18 -3.030 6.116 -8.497 1.00 0.93 C ATOM 305 C ASP A 18 -1.564 6.480 -8.295 1.00 0.93 C ATOM 306 O ASP A 18 -0.667 5.664 -8.485 1.00 0.93 O ATOM 307 CB ASP A 18 -3.567 6.783 -9.765 1.00 1.04 C ATOM 308 CG ASP A 18 -2.694 6.516 -10.979 1.00 1.20 C ATOM 309 OD1 ASP A 18 -2.744 5.390 -11.517 1.00 1.66 O ATOM 310 OD2 ASP A 18 -1.966 7.437 -11.411 1.00 1.62 O ATOM 0 H ASP A 18 -4.496 7.253 -7.502 1.00 0.90 H new ATOM 0 HA ASP A 18 -3.119 5.036 -8.615 1.00 0.93 H new ATOM 0 HB2 ASP A 18 -4.577 6.422 -9.961 1.00 1.04 H new ATOM 0 HB3 ASP A 18 -3.639 7.858 -9.603 1.00 1.04 H new ATOM 315 N SER A 19 -1.345 7.711 -7.871 1.00 0.99 N ATOM 316 CA SER A 19 -0.006 8.210 -7.613 1.00 1.03 C ATOM 317 C SER A 19 0.604 7.509 -6.407 1.00 0.96 C ATOM 318 O SER A 19 1.821 7.371 -6.310 1.00 0.96 O ATOM 319 CB SER A 19 -0.034 9.721 -7.382 1.00 1.17 C ATOM 320 OG SER A 19 -0.758 10.384 -8.407 1.00 1.28 O ATOM 0 H SER A 19 -2.086 8.390 -7.696 1.00 0.99 H new ATOM 0 HA SER A 19 0.610 8.000 -8.487 1.00 1.03 H new ATOM 0 HB2 SER A 19 -0.489 9.935 -6.415 1.00 1.17 H new ATOM 0 HB3 SER A 19 0.986 10.105 -7.347 1.00 1.17 H new ATOM 0 HG SER A 19 -1.711 10.393 -8.181 1.00 1.28 H new ATOM 326 N LEU A 20 -0.260 7.077 -5.492 1.00 0.92 N ATOM 327 CA LEU A 20 0.161 6.407 -4.270 1.00 0.90 C ATOM 328 C LEU A 20 1.065 5.211 -4.572 1.00 0.84 C ATOM 329 O LEU A 20 2.174 5.124 -4.053 1.00 0.86 O ATOM 330 CB LEU A 20 -1.079 5.954 -3.492 1.00 0.92 C ATOM 331 CG LEU A 20 -0.863 5.615 -2.018 1.00 1.01 C ATOM 332 CD1 LEU A 20 -1.256 6.806 -1.159 1.00 1.37 C ATOM 333 CD2 LEU A 20 -1.662 4.374 -1.653 1.00 1.14 C ATOM 0 H LEU A 20 -1.271 7.183 -5.579 1.00 0.92 H new ATOM 0 HA LEU A 20 0.738 7.109 -3.668 1.00 0.90 H new ATOM 0 HB2 LEU A 20 -1.830 6.741 -3.556 1.00 0.92 H new ATOM 0 HB3 LEU A 20 -1.493 5.077 -3.988 1.00 0.92 H new ATOM 0 HG LEU A 20 0.190 5.400 -1.836 1.00 1.01 H new ATOM 0 HD11 LEU A 20 -1.102 6.563 -0.108 1.00 1.37 H new ATOM 0 HD12 LEU A 20 -0.642 7.666 -1.427 1.00 1.37 H new ATOM 0 HD13 LEU A 20 -2.307 7.044 -1.326 1.00 1.37 H new ATOM 0 HD21 LEU A 20 -1.505 4.136 -0.601 1.00 1.14 H new ATOM 0 HD22 LEU A 20 -2.722 4.559 -1.829 1.00 1.14 H new ATOM 0 HD23 LEU A 20 -1.333 3.536 -2.267 1.00 1.14 H new ATOM 345 N ILE A 21 0.611 4.310 -5.442 1.00 0.80 N ATOM 346 CA ILE A 21 1.404 3.130 -5.795 1.00 0.79 C ATOM 347 C ILE A 21 2.652 3.524 -6.587 1.00 0.81 C ATOM 348 O ILE A 21 3.697 2.887 -6.469 1.00 0.83 O ATOM 349 CB ILE A 21 0.582 2.089 -6.598 1.00 0.81 C ATOM 350 CG1 ILE A 21 -0.328 2.771 -7.627 1.00 1.06 C ATOM 351 CG2 ILE A 21 -0.235 1.218 -5.652 1.00 1.04 C ATOM 352 CD1 ILE A 21 -1.102 1.797 -8.492 1.00 1.23 C ATOM 0 H ILE A 21 -0.292 4.371 -5.912 1.00 0.80 H new ATOM 0 HA ILE A 21 1.706 2.667 -4.856 1.00 0.79 H new ATOM 0 HB ILE A 21 1.281 1.455 -7.143 1.00 0.81 H new ATOM 0 HG12 ILE A 21 -1.032 3.419 -7.104 1.00 1.06 H new ATOM 0 HG13 ILE A 21 0.278 3.411 -8.268 1.00 1.06 H new ATOM 0 HG21 ILE A 21 -0.807 0.492 -6.229 1.00 1.04 H new ATOM 0 HG22 ILE A 21 0.435 0.693 -4.971 1.00 1.04 H new ATOM 0 HG23 ILE A 21 -0.918 1.845 -5.079 1.00 1.04 H new ATOM 0 HD11 ILE A 21 -1.724 2.350 -9.196 1.00 1.23 H new ATOM 0 HD12 ILE A 21 -0.405 1.166 -9.043 1.00 1.23 H new ATOM 0 HD13 ILE A 21 -1.735 1.173 -7.861 1.00 1.23 H new ATOM 364 N GLU A 22 2.540 4.586 -7.376 1.00 0.84 N ATOM 365 CA GLU A 22 3.659 5.064 -8.177 1.00 0.90 C ATOM 366 C GLU A 22 4.783 5.593 -7.293 1.00 0.90 C ATOM 367 O GLU A 22 5.958 5.294 -7.514 1.00 0.93 O ATOM 368 CB GLU A 22 3.194 6.158 -9.135 1.00 0.98 C ATOM 369 CG GLU A 22 2.676 5.621 -10.454 1.00 1.29 C ATOM 370 CD GLU A 22 3.773 4.994 -11.287 1.00 1.78 C ATOM 371 OE1 GLU A 22 4.046 3.791 -11.110 1.00 2.22 O ATOM 372 OE2 GLU A 22 4.370 5.710 -12.114 1.00 2.29 O ATOM 0 H GLU A 22 1.685 5.132 -7.478 1.00 0.84 H new ATOM 0 HA GLU A 22 4.043 4.222 -8.752 1.00 0.90 H new ATOM 0 HB2 GLU A 22 2.408 6.742 -8.655 1.00 0.98 H new ATOM 0 HB3 GLU A 22 4.023 6.838 -9.328 1.00 0.98 H new ATOM 0 HG2 GLU A 22 1.899 4.881 -10.263 1.00 1.29 H new ATOM 0 HG3 GLU A 22 2.213 6.431 -11.017 1.00 1.29 H new ATOM 379 N ALA A 23 4.418 6.381 -6.291 1.00 0.89 N ATOM 380 CA ALA A 23 5.392 6.951 -5.373 1.00 0.92 C ATOM 381 C ALA A 23 6.069 5.866 -4.543 1.00 0.88 C ATOM 382 O ALA A 23 7.288 5.876 -4.371 1.00 0.89 O ATOM 383 CB ALA A 23 4.727 7.980 -4.470 1.00 0.94 C ATOM 0 H ALA A 23 3.451 6.640 -6.094 1.00 0.89 H new ATOM 0 HA ALA A 23 6.162 7.448 -5.962 1.00 0.92 H new ATOM 0 HB1 ALA A 23 5.467 8.398 -3.788 1.00 0.94 H new ATOM 0 HB2 ALA A 23 4.302 8.778 -5.079 1.00 0.94 H new ATOM 0 HB3 ALA A 23 3.934 7.501 -3.895 1.00 0.94 H new ATOM 389 N ILE A 24 5.279 4.920 -4.052 1.00 0.86 N ATOM 390 CA ILE A 24 5.809 3.830 -3.243 1.00 0.85 C ATOM 391 C ILE A 24 6.746 2.952 -4.082 1.00 0.83 C ATOM 392 O ILE A 24 7.800 2.512 -3.606 1.00 0.83 O ATOM 393 CB ILE A 24 4.659 2.994 -2.605 1.00 0.87 C ATOM 394 CG1 ILE A 24 4.277 3.557 -1.224 1.00 1.12 C ATOM 395 CG2 ILE A 24 5.038 1.525 -2.482 1.00 1.03 C ATOM 396 CD1 ILE A 24 3.497 4.860 -1.274 1.00 1.05 C ATOM 0 H ILE A 24 4.270 4.885 -4.199 1.00 0.86 H new ATOM 0 HA ILE A 24 6.389 4.256 -2.424 1.00 0.85 H new ATOM 0 HB ILE A 24 3.797 3.067 -3.268 1.00 0.87 H new ATOM 0 HG12 ILE A 24 3.684 2.813 -0.692 1.00 1.12 H new ATOM 0 HG13 ILE A 24 5.187 3.714 -0.644 1.00 1.12 H new ATOM 0 HG21 ILE A 24 4.212 0.973 -2.033 1.00 1.03 H new ATOM 0 HG22 ILE A 24 5.250 1.120 -3.471 1.00 1.03 H new ATOM 0 HG23 ILE A 24 5.923 1.429 -1.853 1.00 1.03 H new ATOM 0 HD11 ILE A 24 3.269 5.186 -0.259 1.00 1.05 H new ATOM 0 HD12 ILE A 24 4.094 5.622 -1.775 1.00 1.05 H new ATOM 0 HD13 ILE A 24 2.568 4.707 -1.824 1.00 1.05 H new ATOM 408 N LYS A 25 6.381 2.737 -5.344 1.00 0.83 N ATOM 409 CA LYS A 25 7.196 1.935 -6.251 1.00 0.84 C ATOM 410 C LYS A 25 8.526 2.635 -6.520 1.00 0.86 C ATOM 411 O LYS A 25 9.554 1.993 -6.741 1.00 0.86 O ATOM 412 CB LYS A 25 6.460 1.693 -7.571 1.00 0.88 C ATOM 413 CG LYS A 25 7.156 0.694 -8.485 1.00 0.96 C ATOM 414 CD LYS A 25 7.014 -0.728 -7.965 1.00 1.13 C ATOM 415 CE LYS A 25 8.254 -1.558 -8.251 1.00 1.39 C ATOM 416 NZ LYS A 25 8.409 -1.857 -9.700 1.00 1.61 N ATOM 0 H LYS A 25 5.527 3.107 -5.761 1.00 0.83 H new ATOM 0 HA LYS A 25 7.387 0.972 -5.778 1.00 0.84 H new ATOM 0 HB2 LYS A 25 5.453 1.335 -7.355 1.00 0.88 H new ATOM 0 HB3 LYS A 25 6.355 2.642 -8.097 1.00 0.88 H new ATOM 0 HG2 LYS A 25 6.733 0.760 -9.487 1.00 0.96 H new ATOM 0 HG3 LYS A 25 8.213 0.949 -8.567 1.00 0.96 H new ATOM 0 HD2 LYS A 25 6.831 -0.706 -6.891 1.00 1.13 H new ATOM 0 HD3 LYS A 25 6.146 -1.199 -8.427 1.00 1.13 H new ATOM 0 HE2 LYS A 25 9.136 -1.025 -7.896 1.00 1.39 H new ATOM 0 HE3 LYS A 25 8.200 -2.493 -7.693 1.00 1.39 H new ATOM 0 HZ1 LYS A 25 9.268 -2.425 -9.847 1.00 1.61 H new ATOM 0 HZ2 LYS A 25 7.581 -2.389 -10.035 1.00 1.61 H new ATOM 0 HZ3 LYS A 25 8.487 -0.967 -10.232 1.00 1.61 H new ATOM 430 N LYS A 26 8.494 3.960 -6.499 1.00 0.87 N ATOM 431 CA LYS A 26 9.685 4.764 -6.730 1.00 0.91 C ATOM 432 C LYS A 26 10.686 4.594 -5.594 1.00 0.90 C ATOM 433 O LYS A 26 11.893 4.497 -5.829 1.00 0.91 O ATOM 434 CB LYS A 26 9.306 6.239 -6.872 1.00 0.97 C ATOM 435 CG LYS A 26 9.223 6.716 -8.314 1.00 1.07 C ATOM 436 CD LYS A 26 10.511 7.391 -8.761 1.00 1.21 C ATOM 437 CE LYS A 26 11.682 6.421 -8.796 1.00 1.35 C ATOM 438 NZ LYS A 26 12.960 7.106 -9.121 1.00 1.42 N ATOM 0 H LYS A 26 7.649 4.504 -6.323 1.00 0.87 H new ATOM 0 HA LYS A 26 10.151 4.422 -7.654 1.00 0.91 H new ATOM 0 HB2 LYS A 26 8.343 6.405 -6.388 1.00 0.97 H new ATOM 0 HB3 LYS A 26 10.039 6.846 -6.340 1.00 0.97 H new ATOM 0 HG2 LYS A 26 9.012 5.868 -8.966 1.00 1.07 H new ATOM 0 HG3 LYS A 26 8.392 7.413 -8.419 1.00 1.07 H new ATOM 0 HD2 LYS A 26 10.369 7.823 -9.752 1.00 1.21 H new ATOM 0 HD3 LYS A 26 10.742 8.214 -8.085 1.00 1.21 H new ATOM 0 HE2 LYS A 26 11.772 5.925 -7.829 1.00 1.35 H new ATOM 0 HE3 LYS A 26 11.488 5.644 -9.536 1.00 1.35 H new ATOM 0 HZ1 LYS A 26 13.756 6.548 -8.752 1.00 1.42 H new ATOM 0 HZ2 LYS A 26 13.051 7.199 -10.153 1.00 1.42 H new ATOM 0 HZ3 LYS A 26 12.968 8.051 -8.686 1.00 1.42 H new ATOM 452 N ILE A 27 10.172 4.539 -4.370 1.00 0.88 N ATOM 453 CA ILE A 27 11.012 4.395 -3.186 1.00 0.89 C ATOM 454 C ILE A 27 11.832 3.101 -3.230 1.00 0.87 C ATOM 455 O ILE A 27 13.044 3.117 -3.002 1.00 0.90 O ATOM 456 CB ILE A 27 10.175 4.422 -1.885 1.00 0.90 C ATOM 457 CG1 ILE A 27 9.315 5.689 -1.822 1.00 0.90 C ATOM 458 CG2 ILE A 27 11.090 4.338 -0.666 1.00 0.93 C ATOM 459 CD1 ILE A 27 8.416 5.756 -0.604 1.00 1.31 C ATOM 0 H ILE A 27 9.173 4.592 -4.171 1.00 0.88 H new ATOM 0 HA ILE A 27 11.692 5.247 -3.187 1.00 0.89 H new ATOM 0 HB ILE A 27 9.511 3.558 -1.884 1.00 0.90 H new ATOM 0 HG12 ILE A 27 9.968 6.561 -1.829 1.00 0.90 H new ATOM 0 HG13 ILE A 27 8.700 5.745 -2.720 1.00 0.90 H new ATOM 0 HG21 ILE A 27 10.488 4.358 0.243 1.00 0.93 H new ATOM 0 HG22 ILE A 27 11.661 3.410 -0.703 1.00 0.93 H new ATOM 0 HG23 ILE A 27 11.775 5.186 -0.666 1.00 0.93 H new ATOM 0 HD11 ILE A 27 7.838 6.680 -0.629 1.00 1.31 H new ATOM 0 HD12 ILE A 27 7.737 4.903 -0.606 1.00 1.31 H new ATOM 0 HD13 ILE A 27 9.025 5.733 0.300 1.00 1.31 H new ATOM 471 N ILE A 28 11.172 1.985 -3.541 1.00 0.83 N ATOM 472 CA ILE A 28 11.846 0.690 -3.598 1.00 0.82 C ATOM 473 C ILE A 28 12.867 0.637 -4.742 1.00 0.83 C ATOM 474 O ILE A 28 13.930 0.016 -4.613 1.00 0.84 O ATOM 475 CB ILE A 28 10.836 -0.484 -3.708 1.00 0.82 C ATOM 476 CG1 ILE A 28 11.510 -1.795 -3.299 1.00 0.88 C ATOM 477 CG2 ILE A 28 10.260 -0.596 -5.116 1.00 0.88 C ATOM 478 CD1 ILE A 28 10.540 -2.875 -2.878 1.00 1.05 C ATOM 0 H ILE A 28 10.176 1.953 -3.756 1.00 0.83 H new ATOM 0 HA ILE A 28 12.386 0.574 -2.658 1.00 0.82 H new ATOM 0 HB ILE A 28 10.008 -0.282 -3.029 1.00 0.82 H new ATOM 0 HG12 ILE A 28 12.107 -2.161 -4.134 1.00 0.88 H new ATOM 0 HG13 ILE A 28 12.198 -1.598 -2.477 1.00 0.88 H new ATOM 0 HG21 ILE A 28 9.557 -1.428 -5.156 1.00 0.88 H new ATOM 0 HG22 ILE A 28 9.743 0.329 -5.372 1.00 0.88 H new ATOM 0 HG23 ILE A 28 11.068 -0.769 -5.827 1.00 0.88 H new ATOM 0 HD11 ILE A 28 11.093 -3.773 -2.603 1.00 1.05 H new ATOM 0 HD12 ILE A 28 9.960 -2.530 -2.022 1.00 1.05 H new ATOM 0 HD13 ILE A 28 9.867 -3.102 -3.705 1.00 1.05 H new ATOM 490 N ALA A 29 12.550 1.307 -5.846 1.00 0.84 N ATOM 491 CA ALA A 29 13.432 1.344 -7.003 1.00 0.87 C ATOM 492 C ALA A 29 14.743 2.023 -6.643 1.00 0.90 C ATOM 493 O ALA A 29 15.817 1.621 -7.098 1.00 0.93 O ATOM 494 CB ALA A 29 12.762 2.069 -8.164 1.00 0.90 C ATOM 0 H ALA A 29 11.684 1.833 -5.962 1.00 0.84 H new ATOM 0 HA ALA A 29 13.641 0.320 -7.311 1.00 0.87 H new ATOM 0 HB1 ALA A 29 13.437 2.087 -9.020 1.00 0.90 H new ATOM 0 HB2 ALA A 29 11.844 1.549 -8.436 1.00 0.90 H new ATOM 0 HB3 ALA A 29 12.526 3.091 -7.867 1.00 0.90 H new ATOM 500 N GLU A 30 14.645 3.050 -5.805 1.00 0.93 N ATOM 501 CA GLU A 30 15.809 3.790 -5.366 1.00 0.99 C ATOM 502 C GLU A 30 16.707 2.918 -4.498 1.00 0.99 C ATOM 503 O GLU A 30 17.932 3.012 -4.580 1.00 1.01 O ATOM 504 CB GLU A 30 15.388 5.039 -4.588 1.00 1.06 C ATOM 505 CG GLU A 30 14.682 6.083 -5.439 1.00 1.10 C ATOM 506 CD GLU A 30 15.368 6.306 -6.766 1.00 1.18 C ATOM 507 OE1 GLU A 30 16.421 6.979 -6.791 1.00 1.46 O ATOM 508 OE2 GLU A 30 14.863 5.815 -7.794 1.00 1.25 O ATOM 0 H GLU A 30 13.763 3.385 -5.418 1.00 0.93 H new ATOM 0 HA GLU A 30 16.368 4.096 -6.250 1.00 0.99 H new ATOM 0 HB2 GLU A 30 14.729 4.742 -3.772 1.00 1.06 H new ATOM 0 HB3 GLU A 30 16.272 5.489 -4.136 1.00 1.06 H new ATOM 0 HG2 GLU A 30 13.653 5.770 -5.614 1.00 1.10 H new ATOM 0 HG3 GLU A 30 14.640 7.025 -4.892 1.00 1.10 H new ATOM 515 N PHE A 31 16.095 2.051 -3.690 1.00 0.97 N ATOM 516 CA PHE A 31 16.853 1.155 -2.810 1.00 1.00 C ATOM 517 C PHE A 31 17.800 0.286 -3.626 1.00 0.97 C ATOM 518 O PHE A 31 18.926 0.008 -3.210 1.00 1.00 O ATOM 519 CB PHE A 31 15.922 0.259 -1.984 1.00 1.02 C ATOM 520 CG PHE A 31 15.127 0.985 -0.936 1.00 1.10 C ATOM 521 CD1 PHE A 31 15.670 2.053 -0.234 1.00 1.79 C ATOM 522 CD2 PHE A 31 13.828 0.593 -0.650 1.00 1.42 C ATOM 523 CE1 PHE A 31 14.930 2.713 0.728 1.00 1.98 C ATOM 524 CE2 PHE A 31 13.084 1.249 0.311 1.00 1.58 C ATOM 525 CZ PHE A 31 13.635 2.311 1.000 1.00 1.54 C ATOM 0 H PHE A 31 15.082 1.949 -3.625 1.00 0.97 H new ATOM 0 HA PHE A 31 17.428 1.779 -2.126 1.00 1.00 H new ATOM 0 HB2 PHE A 31 15.232 -0.247 -2.659 1.00 1.02 H new ATOM 0 HB3 PHE A 31 16.518 -0.514 -1.499 1.00 1.02 H new ATOM 0 HD1 PHE A 31 16.681 2.371 -0.442 1.00 1.79 H new ATOM 0 HD2 PHE A 31 13.392 -0.237 -1.186 1.00 1.42 H new ATOM 0 HE1 PHE A 31 15.363 3.543 1.267 1.00 1.98 H new ATOM 0 HE2 PHE A 31 12.074 0.932 0.523 1.00 1.58 H new ATOM 0 HZ PHE A 31 13.055 2.827 1.751 1.00 1.54 H new ATOM 535 N ASP A 32 17.332 -0.141 -4.791 1.00 0.93 N ATOM 536 CA ASP A 32 18.134 -0.970 -5.687 1.00 0.92 C ATOM 537 C ASP A 32 19.351 -0.194 -6.192 1.00 0.92 C ATOM 538 O ASP A 32 20.470 -0.714 -6.225 1.00 0.93 O ATOM 539 CB ASP A 32 17.285 -1.452 -6.864 1.00 0.94 C ATOM 540 CG ASP A 32 18.097 -2.176 -7.914 1.00 1.15 C ATOM 541 OD1 ASP A 32 18.701 -3.222 -7.589 1.00 1.54 O ATOM 542 OD2 ASP A 32 18.140 -1.696 -9.066 1.00 1.45 O ATOM 0 H ASP A 32 16.398 0.073 -5.141 1.00 0.93 H new ATOM 0 HA ASP A 32 18.487 -1.839 -5.131 1.00 0.92 H new ATOM 0 HB2 ASP A 32 16.503 -2.115 -6.494 1.00 0.94 H new ATOM 0 HB3 ASP A 32 16.788 -0.597 -7.322 1.00 0.94 H new ATOM 547 N VAL A 33 19.130 1.064 -6.555 1.00 0.93 N ATOM 548 CA VAL A 33 20.208 1.917 -7.045 1.00 0.95 C ATOM 549 C VAL A 33 21.234 2.175 -5.943 1.00 0.96 C ATOM 550 O VAL A 33 22.436 2.205 -6.200 1.00 0.97 O ATOM 551 CB VAL A 33 19.671 3.264 -7.573 1.00 0.99 C ATOM 552 CG1 VAL A 33 20.788 4.080 -8.206 1.00 1.06 C ATOM 553 CG2 VAL A 33 18.541 3.035 -8.564 1.00 0.98 C ATOM 0 H VAL A 33 18.216 1.516 -6.520 1.00 0.93 H new ATOM 0 HA VAL A 33 20.687 1.389 -7.870 1.00 0.95 H new ATOM 0 HB VAL A 33 19.277 3.830 -6.729 1.00 0.99 H new ATOM 0 HG11 VAL A 33 20.386 5.025 -8.571 1.00 1.06 H new ATOM 0 HG12 VAL A 33 21.561 4.277 -7.463 1.00 1.06 H new ATOM 0 HG13 VAL A 33 21.219 3.523 -9.038 1.00 1.06 H new ATOM 0 HG21 VAL A 33 18.174 3.996 -8.926 1.00 0.98 H new ATOM 0 HG22 VAL A 33 18.908 2.446 -9.405 1.00 0.98 H new ATOM 0 HG23 VAL A 33 17.729 2.499 -8.073 1.00 0.98 H new ATOM 563 N VAL A 34 20.752 2.358 -4.716 1.00 0.98 N ATOM 564 CA VAL A 34 21.630 2.600 -3.569 1.00 1.02 C ATOM 565 C VAL A 34 22.611 1.441 -3.389 1.00 1.02 C ATOM 566 O VAL A 34 23.783 1.643 -3.074 1.00 1.04 O ATOM 567 CB VAL A 34 20.825 2.804 -2.264 1.00 1.07 C ATOM 568 CG1 VAL A 34 21.756 2.940 -1.064 1.00 1.14 C ATOM 569 CG2 VAL A 34 19.933 4.030 -2.375 1.00 1.08 C ATOM 0 H VAL A 34 19.758 2.344 -4.488 1.00 0.98 H new ATOM 0 HA VAL A 34 22.184 3.516 -3.775 1.00 1.02 H new ATOM 0 HB VAL A 34 20.198 1.925 -2.115 1.00 1.07 H new ATOM 0 HG11 VAL A 34 21.165 3.082 -0.159 1.00 1.14 H new ATOM 0 HG12 VAL A 34 22.358 2.036 -0.966 1.00 1.14 H new ATOM 0 HG13 VAL A 34 22.412 3.799 -1.208 1.00 1.14 H new ATOM 0 HG21 VAL A 34 19.374 4.158 -1.448 1.00 1.08 H new ATOM 0 HG22 VAL A 34 20.548 4.912 -2.553 1.00 1.08 H new ATOM 0 HG23 VAL A 34 19.237 3.900 -3.203 1.00 1.08 H new ATOM 579 N LYS A 35 22.128 0.229 -3.605 1.00 1.00 N ATOM 580 CA LYS A 35 22.960 -0.963 -3.476 1.00 1.02 C ATOM 581 C LYS A 35 24.122 -0.912 -4.467 1.00 1.01 C ATOM 582 O LYS A 35 25.254 -1.270 -4.138 1.00 1.04 O ATOM 583 CB LYS A 35 22.125 -2.219 -3.714 1.00 1.02 C ATOM 584 CG LYS A 35 22.898 -3.507 -3.503 1.00 1.06 C ATOM 585 CD LYS A 35 22.040 -4.723 -3.788 1.00 1.23 C ATOM 586 CE LYS A 35 22.735 -6.000 -3.360 1.00 1.45 C ATOM 587 NZ LYS A 35 21.877 -7.195 -3.564 1.00 1.92 N ATOM 0 H LYS A 35 21.162 0.041 -3.871 1.00 1.00 H new ATOM 0 HA LYS A 35 23.364 -0.994 -2.464 1.00 1.02 H new ATOM 0 HB2 LYS A 35 21.265 -2.207 -3.044 1.00 1.02 H new ATOM 0 HB3 LYS A 35 21.736 -2.200 -4.732 1.00 1.02 H new ATOM 0 HG2 LYS A 35 23.773 -3.518 -4.153 1.00 1.06 H new ATOM 0 HG3 LYS A 35 23.262 -3.550 -2.477 1.00 1.06 H new ATOM 0 HD2 LYS A 35 21.089 -4.631 -3.263 1.00 1.23 H new ATOM 0 HD3 LYS A 35 21.813 -4.769 -4.853 1.00 1.23 H new ATOM 0 HE2 LYS A 35 23.660 -6.117 -3.925 1.00 1.45 H new ATOM 0 HE3 LYS A 35 23.012 -5.927 -2.308 1.00 1.45 H new ATOM 0 HZ1 LYS A 35 22.390 -8.047 -3.259 1.00 1.92 H new ATOM 0 HZ2 LYS A 35 21.006 -7.096 -3.005 1.00 1.92 H new ATOM 0 HZ3 LYS A 35 21.634 -7.280 -4.572 1.00 1.92 H new ATOM 601 N GLU A 36 23.828 -0.471 -5.681 1.00 0.99 N ATOM 602 CA GLU A 36 24.846 -0.359 -6.723 1.00 1.00 C ATOM 603 C GLU A 36 25.776 0.830 -6.470 1.00 0.99 C ATOM 604 O GLU A 36 26.977 0.766 -6.743 1.00 1.01 O ATOM 605 CB GLU A 36 24.181 -0.217 -8.093 1.00 1.03 C ATOM 606 CG GLU A 36 25.115 -0.520 -9.254 1.00 1.31 C ATOM 607 CD GLU A 36 25.516 -1.981 -9.310 1.00 1.41 C ATOM 608 OE1 GLU A 36 24.744 -2.793 -9.859 1.00 1.71 O ATOM 609 OE2 GLU A 36 26.613 -2.325 -8.816 1.00 1.44 O ATOM 0 H GLU A 36 22.893 -0.184 -5.972 1.00 0.99 H new ATOM 0 HA GLU A 36 25.447 -1.268 -6.703 1.00 1.00 H new ATOM 0 HB2 GLU A 36 23.323 -0.887 -8.143 1.00 1.03 H new ATOM 0 HB3 GLU A 36 23.799 0.798 -8.199 1.00 1.03 H new ATOM 0 HG2 GLU A 36 24.628 -0.244 -10.189 1.00 1.31 H new ATOM 0 HG3 GLU A 36 26.010 0.096 -9.167 1.00 1.31 H new ATOM 616 N SER A 37 25.231 1.909 -5.923 1.00 0.00 N ATOM 617 CA SER A 37 26.000 3.121 -5.661 1.00 0.00 C ATOM 618 C SER A 37 27.075 2.868 -4.630 1.00 0.00 C ATOM 619 O SER A 37 28.240 3.269 -4.820 1.00 0.00 O ATOM 620 CB SER A 37 25.069 4.285 -5.238 1.00 0.00 C ATOM 621 OG SER A 37 24.198 4.712 -6.292 1.00 0.00 O ATOM 0 H SER A 37 24.250 1.970 -5.650 1.00 0.00 H new ATOM 0 HA SER A 37 26.496 3.415 -6.586 1.00 0.00 H new ATOM 0 HB2 SER A 37 24.470 3.972 -4.383 1.00 0.00 H new ATOM 0 HB3 SER A 37 25.676 5.129 -4.911 1.00 0.00 H new ATOM 0 HG SER A 37 23.514 4.028 -6.449 1.00 0.00 H new ATOM 627 N VAL A 38 26.754 2.180 -3.530 1.00 1.03 N ATOM 628 CA VAL A 38 27.738 1.889 -2.490 1.00 1.06 C ATOM 629 C VAL A 38 28.793 0.916 -3.010 1.00 1.07 C ATOM 630 O VAL A 38 29.935 0.933 -2.562 1.00 1.09 O ATOM 631 CB VAL A 38 27.097 1.320 -1.203 1.00 1.10 C ATOM 632 CG1 VAL A 38 26.305 2.395 -0.477 1.00 1.12 C ATOM 633 CG2 VAL A 38 26.224 0.113 -1.500 1.00 1.10 C ATOM 0 H VAL A 38 25.821 1.816 -3.339 1.00 1.03 H new ATOM 0 HA VAL A 38 28.206 2.839 -2.231 1.00 1.06 H new ATOM 0 HB VAL A 38 27.905 0.987 -0.551 1.00 1.10 H new ATOM 0 HG11 VAL A 38 25.862 1.974 0.426 1.00 1.12 H new ATOM 0 HG12 VAL A 38 26.969 3.216 -0.206 1.00 1.12 H new ATOM 0 HG13 VAL A 38 25.515 2.767 -1.129 1.00 1.12 H new ATOM 0 HG21 VAL A 38 25.791 -0.260 -0.572 1.00 1.10 H new ATOM 0 HG22 VAL A 38 25.425 0.401 -2.184 1.00 1.10 H new ATOM 0 HG23 VAL A 38 26.829 -0.670 -1.958 1.00 1.10 H new ATOM 643 N ASN A 39 28.396 0.083 -3.962 1.00 1.05 N ATOM 644 CA ASN A 39 29.292 -0.901 -4.565 1.00 1.08 C ATOM 645 C ASN A 39 30.461 -0.201 -5.262 1.00 1.07 C ATOM 646 O ASN A 39 31.632 -0.497 -5.005 1.00 1.10 O ATOM 647 CB ASN A 39 28.500 -1.759 -5.562 1.00 1.10 C ATOM 648 CG ASN A 39 29.352 -2.764 -6.310 1.00 1.41 C ATOM 649 OD1 ASN A 39 30.355 -3.255 -5.795 1.00 1.68 O ATOM 650 ND2 ASN A 39 28.949 -3.084 -7.531 1.00 1.72 N ATOM 0 H ASN A 39 27.448 0.068 -4.339 1.00 1.05 H new ATOM 0 HA ASN A 39 29.703 -1.544 -3.787 1.00 1.08 H new ATOM 0 HB2 ASN A 39 27.713 -2.290 -5.026 1.00 1.10 H new ATOM 0 HB3 ASN A 39 28.009 -1.104 -6.282 1.00 1.10 H new ATOM 0 HD21 ASN A 39 29.477 -3.761 -8.081 1.00 1.72 H new ATOM 0 HD22 ASN A 39 28.111 -2.653 -7.921 1.00 1.72 H new ATOM 657 N GLU A 40 30.131 0.755 -6.122 1.00 1.06 N ATOM 658 CA GLU A 40 31.134 1.511 -6.865 1.00 1.08 C ATOM 659 C GLU A 40 31.942 2.422 -5.946 1.00 1.06 C ATOM 660 O GLU A 40 33.168 2.494 -6.042 1.00 1.09 O ATOM 661 CB GLU A 40 30.446 2.354 -7.939 1.00 1.11 C ATOM 662 CG GLU A 40 29.838 1.537 -9.063 1.00 1.33 C ATOM 663 CD GLU A 40 30.821 1.275 -10.182 1.00 1.77 C ATOM 664 OE1 GLU A 40 31.553 0.264 -10.118 1.00 2.31 O ATOM 665 OE2 GLU A 40 30.857 2.077 -11.142 1.00 2.13 O ATOM 0 H GLU A 40 29.169 1.027 -6.324 1.00 1.06 H new ATOM 0 HA GLU A 40 31.819 0.800 -7.326 1.00 1.08 H new ATOM 0 HB2 GLU A 40 29.663 2.952 -7.472 1.00 1.11 H new ATOM 0 HB3 GLU A 40 31.171 3.051 -8.360 1.00 1.11 H new ATOM 0 HG2 GLU A 40 29.482 0.586 -8.666 1.00 1.33 H new ATOM 0 HG3 GLU A 40 28.970 2.062 -9.461 1.00 1.33 H new ATOM 672 N LEU A 41 31.242 3.112 -5.054 1.00 1.04 N ATOM 673 CA LEU A 41 31.877 4.040 -4.124 1.00 1.05 C ATOM 674 C LEU A 41 32.919 3.353 -3.239 1.00 1.08 C ATOM 675 O LEU A 41 33.988 3.911 -2.981 1.00 1.12 O ATOM 676 CB LEU A 41 30.816 4.719 -3.258 1.00 1.04 C ATOM 677 CG LEU A 41 30.433 6.137 -3.691 1.00 1.04 C ATOM 678 CD1 LEU A 41 29.848 6.137 -5.097 1.00 1.19 C ATOM 679 CD2 LEU A 41 29.443 6.740 -2.711 1.00 1.07 C ATOM 0 H LEU A 41 30.229 3.046 -4.954 1.00 1.04 H new ATOM 0 HA LEU A 41 32.401 4.789 -4.717 1.00 1.05 H new ATOM 0 HB2 LEU A 41 29.918 4.101 -3.259 1.00 1.04 H new ATOM 0 HB3 LEU A 41 31.177 4.755 -2.230 1.00 1.04 H new ATOM 0 HG LEU A 41 31.337 6.745 -3.697 1.00 1.04 H new ATOM 0 HD11 LEU A 41 29.584 7.156 -5.381 1.00 1.19 H new ATOM 0 HD12 LEU A 41 30.585 5.744 -5.798 1.00 1.19 H new ATOM 0 HD13 LEU A 41 28.956 5.511 -5.120 1.00 1.19 H new ATOM 0 HD21 LEU A 41 29.181 7.748 -3.033 1.00 1.07 H new ATOM 0 HD22 LEU A 41 28.544 6.124 -2.677 1.00 1.07 H new ATOM 0 HD23 LEU A 41 29.892 6.781 -1.719 1.00 1.07 H new ATOM 691 N SER A 42 32.619 2.141 -2.787 1.00 1.07 N ATOM 692 CA SER A 42 33.532 1.398 -1.926 1.00 1.12 C ATOM 693 C SER A 42 34.798 0.986 -2.673 1.00 1.16 C ATOM 694 O SER A 42 35.887 0.964 -2.095 1.00 1.20 O ATOM 695 CB SER A 42 32.832 0.167 -1.350 1.00 1.13 C ATOM 696 OG SER A 42 31.689 0.548 -0.600 1.00 1.47 O ATOM 0 H SER A 42 31.750 1.652 -3.002 1.00 1.07 H new ATOM 0 HA SER A 42 33.828 2.056 -1.109 1.00 1.12 H new ATOM 0 HB2 SER A 42 32.537 -0.502 -2.158 1.00 1.13 H new ATOM 0 HB3 SER A 42 33.523 -0.387 -0.714 1.00 1.13 H new ATOM 0 HG SER A 42 30.978 0.835 -1.210 1.00 1.47 H new ATOM 702 N GLU A 43 34.658 0.668 -3.956 1.00 1.16 N ATOM 703 CA GLU A 43 35.806 0.267 -4.761 1.00 1.22 C ATOM 704 C GLU A 43 36.769 1.433 -4.946 1.00 1.21 C ATOM 705 O GLU A 43 37.990 1.253 -4.942 1.00 1.25 O ATOM 706 CB GLU A 43 35.358 -0.270 -6.119 1.00 1.27 C ATOM 707 CG GLU A 43 35.292 -1.789 -6.170 1.00 1.60 C ATOM 708 CD GLU A 43 36.597 -2.434 -5.754 1.00 1.71 C ATOM 709 OE1 GLU A 43 37.574 -2.365 -6.528 1.00 1.98 O ATOM 710 OE2 GLU A 43 36.658 -3.008 -4.649 1.00 1.94 O ATOM 0 H GLU A 43 33.770 0.680 -4.457 1.00 1.16 H new ATOM 0 HA GLU A 43 36.325 -0.531 -4.230 1.00 1.22 H new ATOM 0 HB2 GLU A 43 34.376 0.138 -6.358 1.00 1.27 H new ATOM 0 HB3 GLU A 43 36.046 0.083 -6.887 1.00 1.27 H new ATOM 0 HG2 GLU A 43 34.492 -2.138 -5.517 1.00 1.60 H new ATOM 0 HG3 GLU A 43 35.039 -2.106 -7.182 1.00 1.60 H new ATOM 717 N LYS A 44 36.214 2.630 -5.099 1.00 1.18 N ATOM 718 CA LYS A 44 37.026 3.831 -5.266 1.00 1.20 C ATOM 719 C LYS A 44 37.713 4.192 -3.953 1.00 1.20 C ATOM 720 O LYS A 44 38.883 4.578 -3.935 1.00 1.25 O ATOM 721 CB LYS A 44 36.160 4.999 -5.746 1.00 1.22 C ATOM 722 CG LYS A 44 36.042 5.090 -7.258 1.00 1.25 C ATOM 723 CD LYS A 44 37.381 5.419 -7.895 1.00 1.46 C ATOM 724 CE LYS A 44 37.278 5.492 -9.407 1.00 1.75 C ATOM 725 NZ LYS A 44 38.577 5.850 -10.033 1.00 2.12 N ATOM 0 H LYS A 44 35.208 2.795 -5.111 1.00 1.18 H new ATOM 0 HA LYS A 44 37.789 3.630 -6.018 1.00 1.20 H new ATOM 0 HB2 LYS A 44 35.163 4.900 -5.318 1.00 1.22 H new ATOM 0 HB3 LYS A 44 36.579 5.931 -5.366 1.00 1.22 H new ATOM 0 HG2 LYS A 44 35.671 4.145 -7.654 1.00 1.25 H new ATOM 0 HG3 LYS A 44 35.312 5.855 -7.523 1.00 1.25 H new ATOM 0 HD2 LYS A 44 37.744 6.371 -7.508 1.00 1.46 H new ATOM 0 HD3 LYS A 44 38.113 4.661 -7.616 1.00 1.46 H new ATOM 0 HE2 LYS A 44 36.940 4.531 -9.795 1.00 1.75 H new ATOM 0 HE3 LYS A 44 36.525 6.230 -9.685 1.00 1.75 H new ATOM 0 HZ1 LYS A 44 38.465 5.890 -11.066 1.00 2.12 H new ATOM 0 HZ2 LYS A 44 38.887 6.779 -9.682 1.00 2.12 H new ATOM 0 HZ3 LYS A 44 39.289 5.132 -9.789 1.00 2.12 H new ATOM 739 N ALA A 45 36.982 4.047 -2.855 1.00 1.17 N ATOM 740 CA ALA A 45 37.508 4.343 -1.527 1.00 1.18 C ATOM 741 C ALA A 45 38.669 3.411 -1.188 1.00 1.18 C ATOM 742 O ALA A 45 39.598 3.778 -0.468 1.00 1.19 O ATOM 743 CB ALA A 45 36.391 4.214 -0.501 1.00 1.21 C ATOM 0 H ALA A 45 36.015 3.723 -2.858 1.00 1.17 H new ATOM 0 HA ALA A 45 37.888 5.364 -1.511 1.00 1.18 H new ATOM 0 HB1 ALA A 45 36.782 4.435 0.492 1.00 1.21 H new ATOM 0 HB2 ALA A 45 35.593 4.917 -0.741 1.00 1.21 H new ATOM 0 HB3 ALA A 45 35.997 3.198 -0.518 1.00 1.21 H new ATOM 749 N LYS A 46 38.611 2.210 -1.742 1.00 1.21 N ATOM 750 CA LYS A 46 39.632 1.193 -1.524 1.00 1.24 C ATOM 751 C LYS A 46 40.969 1.590 -2.145 1.00 1.24 C ATOM 752 O LYS A 46 42.001 0.992 -1.837 1.00 1.27 O ATOM 753 CB LYS A 46 39.167 -0.139 -2.115 1.00 1.32 C ATOM 754 CG LYS A 46 39.632 -1.360 -1.336 1.00 1.61 C ATOM 755 CD LYS A 46 38.999 -2.629 -1.876 1.00 2.02 C ATOM 756 CE LYS A 46 39.682 -3.094 -3.153 1.00 2.38 C ATOM 757 NZ LYS A 46 38.907 -4.161 -3.834 1.00 2.75 N ATOM 0 H LYS A 46 37.854 1.911 -2.357 1.00 1.21 H new ATOM 0 HA LYS A 46 39.779 1.094 -0.449 1.00 1.24 H new ATOM 0 HB2 LYS A 46 38.078 -0.144 -2.161 1.00 1.32 H new ATOM 0 HB3 LYS A 46 39.529 -0.216 -3.140 1.00 1.32 H new ATOM 0 HG2 LYS A 46 40.718 -1.439 -1.393 1.00 1.61 H new ATOM 0 HG3 LYS A 46 39.376 -1.242 -0.283 1.00 1.61 H new ATOM 0 HD2 LYS A 46 39.059 -3.415 -1.123 1.00 2.02 H new ATOM 0 HD3 LYS A 46 37.941 -2.454 -2.071 1.00 2.02 H new ATOM 0 HE2 LYS A 46 39.806 -2.247 -3.828 1.00 2.38 H new ATOM 0 HE3 LYS A 46 40.680 -3.463 -2.918 1.00 2.38 H new ATOM 0 HZ1 LYS A 46 39.277 -4.298 -4.796 1.00 2.75 H new ATOM 0 HZ2 LYS A 46 38.995 -5.049 -3.300 1.00 2.75 H new ATOM 0 HZ3 LYS A 46 37.906 -3.885 -3.884 1.00 2.75 H new ATOM 771 N THR A 47 40.957 2.591 -3.014 1.00 1.23 N ATOM 772 CA THR A 47 42.179 3.019 -3.676 1.00 1.26 C ATOM 773 C THR A 47 42.577 4.456 -3.328 1.00 1.21 C ATOM 774 O THR A 47 43.444 5.036 -3.986 1.00 1.30 O ATOM 775 CB THR A 47 42.038 2.896 -5.203 1.00 1.39 C ATOM 776 OG1 THR A 47 40.686 2.540 -5.544 1.00 1.54 O ATOM 777 CG2 THR A 47 42.997 1.848 -5.747 1.00 1.62 C ATOM 0 H THR A 47 40.123 3.117 -3.275 1.00 1.23 H new ATOM 0 HA THR A 47 42.966 2.358 -3.313 1.00 1.26 H new ATOM 0 HB THR A 47 42.283 3.859 -5.651 1.00 1.39 H new ATOM 0 HG1 THR A 47 40.603 2.465 -6.518 1.00 1.54 H new ATOM 0 HG21 THR A 47 42.882 1.776 -6.829 1.00 1.62 H new ATOM 0 HG22 THR A 47 44.022 2.134 -5.509 1.00 1.62 H new ATOM 0 HG23 THR A 47 42.776 0.882 -5.293 1.00 1.62 H new ATOM 785 N ASP A 48 41.974 5.030 -2.291 1.00 1.15 N ATOM 786 CA ASP A 48 42.302 6.402 -1.909 1.00 1.15 C ATOM 787 C ASP A 48 42.014 6.647 -0.433 1.00 1.09 C ATOM 788 O ASP A 48 40.915 6.368 0.040 1.00 1.06 O ATOM 789 CB ASP A 48 41.513 7.397 -2.763 1.00 1.24 C ATOM 790 CG ASP A 48 42.033 8.816 -2.639 1.00 1.32 C ATOM 791 OD1 ASP A 48 43.015 9.157 -3.334 1.00 1.50 O ATOM 792 OD2 ASP A 48 41.452 9.604 -1.864 1.00 1.41 O ATOM 0 H ASP A 48 41.269 4.578 -1.709 1.00 1.15 H new ATOM 0 HA ASP A 48 43.368 6.549 -2.080 1.00 1.15 H new ATOM 0 HB2 ASP A 48 41.557 7.088 -3.807 1.00 1.24 H new ATOM 0 HB3 ASP A 48 40.464 7.372 -2.467 1.00 1.24 H new ATOM 797 N PRO A 49 43.001 7.174 0.309 1.00 1.12 N ATOM 798 CA PRO A 49 42.855 7.452 1.741 1.00 1.13 C ATOM 799 C PRO A 49 41.795 8.512 2.034 1.00 1.17 C ATOM 800 O PRO A 49 41.049 8.407 3.012 1.00 1.18 O ATOM 801 CB PRO A 49 44.242 7.950 2.162 1.00 1.22 C ATOM 802 CG PRO A 49 44.901 8.393 0.900 1.00 1.25 C ATOM 803 CD PRO A 49 44.342 7.525 -0.189 1.00 1.19 C ATOM 0 HA PRO A 49 42.524 6.568 2.285 1.00 1.13 H new ATOM 0 HB2 PRO A 49 44.165 8.771 2.875 1.00 1.22 H new ATOM 0 HB3 PRO A 49 44.813 7.159 2.647 1.00 1.22 H new ATOM 0 HG2 PRO A 49 44.697 9.445 0.703 1.00 1.25 H new ATOM 0 HG3 PRO A 49 45.984 8.285 0.967 1.00 1.25 H new ATOM 0 HD2 PRO A 49 44.291 8.056 -1.140 1.00 1.19 H new ATOM 0 HD3 PRO A 49 44.955 6.639 -0.351 1.00 1.19 H new ATOM 811 N GLN A 50 41.714 9.525 1.180 1.00 1.23 N ATOM 812 CA GLN A 50 40.744 10.593 1.373 1.00 1.30 C ATOM 813 C GLN A 50 39.341 10.078 1.089 1.00 1.21 C ATOM 814 O GLN A 50 38.406 10.317 1.859 1.00 1.22 O ATOM 815 CB GLN A 50 41.059 11.791 0.470 1.00 1.43 C ATOM 816 CG GLN A 50 42.153 12.706 1.007 1.00 1.59 C ATOM 817 CD GLN A 50 43.526 12.063 0.998 1.00 1.77 C ATOM 818 OE1 GLN A 50 43.949 11.463 1.984 1.00 2.00 O ATOM 819 NE2 GLN A 50 44.225 12.175 -0.120 1.00 1.96 N ATOM 0 H GLN A 50 42.303 9.628 0.354 1.00 1.23 H new ATOM 0 HA GLN A 50 40.801 10.925 2.410 1.00 1.30 H new ATOM 0 HB2 GLN A 50 41.358 11.423 -0.512 1.00 1.43 H new ATOM 0 HB3 GLN A 50 40.149 12.375 0.329 1.00 1.43 H new ATOM 0 HG2 GLN A 50 42.182 13.617 0.410 1.00 1.59 H new ATOM 0 HG3 GLN A 50 41.903 13.001 2.026 1.00 1.59 H new ATOM 0 HE21 GLN A 50 43.837 12.682 -0.916 1.00 1.96 H new ATOM 0 HE22 GLN A 50 45.152 11.755 -0.186 1.00 1.96 H new ATOM 828 N ALA A 51 39.208 9.353 -0.017 1.00 1.16 N ATOM 829 CA ALA A 51 37.928 8.783 -0.415 1.00 1.11 C ATOM 830 C ALA A 51 37.470 7.741 0.594 1.00 1.02 C ATOM 831 O ALA A 51 36.275 7.585 0.836 1.00 1.00 O ATOM 832 CB ALA A 51 38.019 8.173 -1.807 1.00 1.15 C ATOM 0 H ALA A 51 39.976 9.146 -0.656 1.00 1.16 H new ATOM 0 HA ALA A 51 37.191 9.586 -0.441 1.00 1.11 H new ATOM 0 HB1 ALA A 51 37.052 7.753 -2.084 1.00 1.15 H new ATOM 0 HB2 ALA A 51 38.299 8.944 -2.525 1.00 1.15 H new ATOM 0 HB3 ALA A 51 38.771 7.384 -1.810 1.00 1.15 H new ATOM 838 N ALA A 52 38.428 7.043 1.195 1.00 1.01 N ATOM 839 CA ALA A 52 38.125 6.022 2.186 1.00 1.01 C ATOM 840 C ALA A 52 37.454 6.628 3.406 1.00 1.04 C ATOM 841 O ALA A 52 36.525 6.049 3.961 1.00 1.05 O ATOM 842 CB ALA A 52 39.383 5.278 2.590 1.00 1.07 C ATOM 0 H ALA A 52 39.423 7.168 1.011 1.00 1.01 H new ATOM 0 HA ALA A 52 37.432 5.312 1.734 1.00 1.01 H new ATOM 0 HB1 ALA A 52 39.134 4.519 3.332 1.00 1.07 H new ATOM 0 HB2 ALA A 52 39.820 4.800 1.714 1.00 1.07 H new ATOM 0 HB3 ALA A 52 40.100 5.980 3.016 1.00 1.07 H new ATOM 848 N GLU A 53 37.921 7.800 3.813 1.00 1.10 N ATOM 849 CA GLU A 53 37.350 8.478 4.968 1.00 1.20 C ATOM 850 C GLU A 53 35.993 9.078 4.612 1.00 1.18 C ATOM 851 O GLU A 53 35.097 9.158 5.452 1.00 1.23 O ATOM 852 CB GLU A 53 38.308 9.552 5.483 1.00 1.32 C ATOM 853 CG GLU A 53 37.832 10.259 6.746 1.00 1.52 C ATOM 854 CD GLU A 53 37.232 9.318 7.780 1.00 1.64 C ATOM 855 OE1 GLU A 53 37.697 8.163 7.893 1.00 1.87 O ATOM 856 OE2 GLU A 53 36.285 9.734 8.487 1.00 1.65 O ATOM 0 H GLU A 53 38.689 8.299 3.364 1.00 1.10 H new ATOM 0 HA GLU A 53 37.200 7.750 5.765 1.00 1.20 H new ATOM 0 HB2 GLU A 53 39.277 9.094 5.680 1.00 1.32 H new ATOM 0 HB3 GLU A 53 38.459 10.294 4.699 1.00 1.32 H new ATOM 0 HG2 GLU A 53 38.672 10.790 7.194 1.00 1.52 H new ATOM 0 HG3 GLU A 53 37.089 11.009 6.475 1.00 1.52 H new ATOM 863 N LYS A 54 35.840 9.490 3.362 1.00 1.14 N ATOM 864 CA LYS A 54 34.579 10.057 2.906 1.00 1.15 C ATOM 865 C LYS A 54 33.493 8.991 2.947 1.00 1.06 C ATOM 866 O LYS A 54 32.382 9.229 3.419 1.00 1.08 O ATOM 867 CB LYS A 54 34.717 10.608 1.487 1.00 1.20 C ATOM 868 CG LYS A 54 35.582 11.854 1.403 1.00 1.43 C ATOM 869 CD LYS A 54 35.768 12.320 -0.032 1.00 1.56 C ATOM 870 CE LYS A 54 34.454 12.759 -0.660 1.00 1.86 C ATOM 871 NZ LYS A 54 34.666 13.546 -1.901 1.00 2.25 N ATOM 0 H LYS A 54 36.568 9.443 2.649 1.00 1.14 H new ATOM 0 HA LYS A 54 34.305 10.878 3.568 1.00 1.15 H new ATOM 0 HB2 LYS A 54 35.142 9.836 0.846 1.00 1.20 H new ATOM 0 HB3 LYS A 54 33.725 10.837 1.096 1.00 1.20 H new ATOM 0 HG2 LYS A 54 35.126 12.653 1.988 1.00 1.43 H new ATOM 0 HG3 LYS A 54 36.556 11.650 1.848 1.00 1.43 H new ATOM 0 HD2 LYS A 54 36.476 13.148 -0.056 1.00 1.56 H new ATOM 0 HD3 LYS A 54 36.201 11.513 -0.623 1.00 1.56 H new ATOM 0 HE2 LYS A 54 33.849 11.881 -0.886 1.00 1.86 H new ATOM 0 HE3 LYS A 54 33.892 13.357 0.057 1.00 1.86 H new ATOM 0 HZ1 LYS A 54 33.746 13.825 -2.297 1.00 2.25 H new ATOM 0 HZ2 LYS A 54 35.221 14.398 -1.681 1.00 2.25 H new ATOM 0 HZ3 LYS A 54 35.180 12.967 -2.596 1.00 2.25 H new ATOM 885 N LEU A 55 33.837 7.805 2.461 1.00 0.98 N ATOM 886 CA LEU A 55 32.910 6.686 2.446 1.00 0.95 C ATOM 887 C LEU A 55 32.701 6.150 3.856 1.00 0.98 C ATOM 888 O LEU A 55 31.670 5.558 4.157 1.00 1.00 O ATOM 889 CB LEU A 55 33.430 5.569 1.536 1.00 0.93 C ATOM 890 CG LEU A 55 32.634 5.366 0.242 1.00 1.05 C ATOM 891 CD1 LEU A 55 31.197 4.969 0.555 1.00 1.34 C ATOM 892 CD2 LEU A 55 32.674 6.629 -0.615 1.00 1.22 C ATOM 0 H LEU A 55 34.756 7.595 2.071 1.00 0.98 H new ATOM 0 HA LEU A 55 31.955 7.040 2.057 1.00 0.95 H new ATOM 0 HB2 LEU A 55 34.467 5.784 1.277 1.00 0.93 H new ATOM 0 HB3 LEU A 55 33.429 4.634 2.096 1.00 0.93 H new ATOM 0 HG LEU A 55 33.095 4.556 -0.324 1.00 1.05 H new ATOM 0 HD11 LEU A 55 30.647 4.829 -0.376 1.00 1.34 H new ATOM 0 HD12 LEU A 55 31.192 4.038 1.123 1.00 1.34 H new ATOM 0 HD13 LEU A 55 30.722 5.755 1.142 1.00 1.34 H new ATOM 0 HD21 LEU A 55 32.104 6.466 -1.530 1.00 1.22 H new ATOM 0 HD22 LEU A 55 32.239 7.460 -0.059 1.00 1.22 H new ATOM 0 HD23 LEU A 55 33.708 6.864 -0.869 1.00 1.22 H new ATOM 904 N ASN A 56 33.684 6.376 4.716 1.00 1.04 N ATOM 905 CA ASN A 56 33.630 5.920 6.100 1.00 1.14 C ATOM 906 C ASN A 56 32.453 6.570 6.834 1.00 1.19 C ATOM 907 O ASN A 56 31.632 5.885 7.447 1.00 1.25 O ATOM 908 CB ASN A 56 34.954 6.238 6.804 1.00 1.25 C ATOM 909 CG ASN A 56 35.059 5.624 8.184 1.00 1.42 C ATOM 910 OD1 ASN A 56 34.424 4.610 8.474 1.00 1.48 O ATOM 911 ND2 ASN A 56 35.865 6.230 9.047 1.00 1.57 N ATOM 0 H ASN A 56 34.539 6.878 4.477 1.00 1.04 H new ATOM 0 HA ASN A 56 33.479 4.841 6.112 1.00 1.14 H new ATOM 0 HB2 ASN A 56 35.780 5.879 6.190 1.00 1.25 H new ATOM 0 HB3 ASN A 56 35.064 7.319 6.885 1.00 1.25 H new ATOM 0 HD21 ASN A 56 35.976 5.857 9.990 1.00 1.57 H new ATOM 0 HD22 ASN A 56 36.374 7.069 8.767 1.00 1.57 H new ATOM 918 N LYS A 57 32.369 7.892 6.755 1.00 1.20 N ATOM 919 CA LYS A 57 31.290 8.633 7.402 1.00 1.28 C ATOM 920 C LYS A 57 29.993 8.549 6.590 1.00 1.22 C ATOM 921 O LYS A 57 28.897 8.608 7.151 1.00 1.27 O ATOM 922 CB LYS A 57 31.677 10.095 7.635 1.00 1.39 C ATOM 923 CG LYS A 57 32.487 10.724 6.510 1.00 1.52 C ATOM 924 CD LYS A 57 32.741 12.207 6.761 1.00 1.63 C ATOM 925 CE LYS A 57 33.623 12.423 7.985 1.00 1.74 C ATOM 926 NZ LYS A 57 35.046 12.069 7.730 1.00 1.86 N ATOM 0 H LYS A 57 33.035 8.475 6.249 1.00 1.20 H new ATOM 0 HA LYS A 57 31.118 8.168 8.373 1.00 1.28 H new ATOM 0 HB2 LYS A 57 30.768 10.679 7.781 1.00 1.39 H new ATOM 0 HB3 LYS A 57 32.251 10.162 8.559 1.00 1.39 H new ATOM 0 HG2 LYS A 57 33.439 10.203 6.411 1.00 1.52 H new ATOM 0 HG3 LYS A 57 31.957 10.600 5.566 1.00 1.52 H new ATOM 0 HD2 LYS A 57 33.217 12.649 5.886 1.00 1.63 H new ATOM 0 HD3 LYS A 57 31.790 12.722 6.901 1.00 1.63 H new ATOM 0 HE2 LYS A 57 33.561 13.466 8.294 1.00 1.74 H new ATOM 0 HE3 LYS A 57 33.245 11.822 8.812 1.00 1.74 H new ATOM 0 HZ1 LYS A 57 35.661 12.835 8.072 1.00 1.86 H new ATOM 0 HZ2 LYS A 57 35.280 11.188 8.231 1.00 1.86 H new ATOM 0 HZ3 LYS A 57 35.193 11.936 6.709 1.00 1.86 H new ATOM 940 N LEU A 58 30.129 8.436 5.269 1.00 1.12 N ATOM 941 CA LEU A 58 28.976 8.347 4.373 1.00 1.10 C ATOM 942 C LEU A 58 28.152 7.098 4.693 1.00 1.08 C ATOM 943 O LEU A 58 26.943 7.183 4.922 1.00 1.11 O ATOM 944 CB LEU A 58 29.443 8.308 2.910 1.00 1.06 C ATOM 945 CG LEU A 58 28.778 9.320 1.964 1.00 1.22 C ATOM 946 CD1 LEU A 58 27.280 9.075 1.865 1.00 1.35 C ATOM 947 CD2 LEU A 58 29.053 10.750 2.415 1.00 1.39 C ATOM 0 H LEU A 58 31.031 8.404 4.794 1.00 1.12 H new ATOM 0 HA LEU A 58 28.351 9.228 4.521 1.00 1.10 H new ATOM 0 HB2 LEU A 58 30.520 8.474 2.889 1.00 1.06 H new ATOM 0 HB3 LEU A 58 29.267 7.306 2.520 1.00 1.06 H new ATOM 0 HG LEU A 58 29.213 9.182 0.974 1.00 1.22 H new ATOM 0 HD11 LEU A 58 26.836 9.806 1.189 1.00 1.35 H new ATOM 0 HD12 LEU A 58 27.100 8.070 1.482 1.00 1.35 H new ATOM 0 HD13 LEU A 58 26.829 9.173 2.853 1.00 1.35 H new ATOM 0 HD21 LEU A 58 28.572 11.447 1.729 1.00 1.39 H new ATOM 0 HD22 LEU A 58 28.656 10.897 3.420 1.00 1.39 H new ATOM 0 HD23 LEU A 58 30.128 10.930 2.419 1.00 1.39 H new ATOM 959 N ILE A 59 28.815 5.947 4.717 1.00 1.07 N ATOM 960 CA ILE A 59 28.149 4.683 5.015 1.00 1.12 C ATOM 961 C ILE A 59 27.590 4.698 6.433 1.00 1.22 C ATOM 962 O ILE A 59 26.532 4.126 6.701 1.00 1.28 O ATOM 963 CB ILE A 59 29.091 3.465 4.821 1.00 1.15 C ATOM 964 CG1 ILE A 59 28.287 2.165 4.793 1.00 1.28 C ATOM 965 CG2 ILE A 59 30.158 3.403 5.909 1.00 1.26 C ATOM 966 CD1 ILE A 59 27.460 1.991 3.538 1.00 1.39 C ATOM 0 H ILE A 59 29.815 5.863 4.533 1.00 1.07 H new ATOM 0 HA ILE A 59 27.328 4.576 4.306 1.00 1.12 H new ATOM 0 HB ILE A 59 29.597 3.589 3.864 1.00 1.15 H new ATOM 0 HG12 ILE A 59 28.972 1.322 4.887 1.00 1.28 H new ATOM 0 HG13 ILE A 59 27.627 2.137 5.660 1.00 1.28 H new ATOM 0 HG21 ILE A 59 30.799 2.538 5.741 1.00 1.26 H new ATOM 0 HG22 ILE A 59 30.760 4.311 5.881 1.00 1.26 H new ATOM 0 HG23 ILE A 59 29.679 3.316 6.884 1.00 1.26 H new ATOM 0 HD11 ILE A 59 26.917 1.047 3.588 1.00 1.39 H new ATOM 0 HD12 ILE A 59 26.750 2.814 3.453 1.00 1.39 H new ATOM 0 HD13 ILE A 59 28.116 1.986 2.668 1.00 1.39 H new ATOM 978 N GLU A 60 28.304 5.370 7.326 1.00 1.27 N ATOM 979 CA GLU A 60 27.889 5.489 8.713 1.00 1.41 C ATOM 980 C GLU A 60 26.511 6.136 8.792 1.00 1.39 C ATOM 981 O GLU A 60 25.673 5.736 9.600 1.00 1.49 O ATOM 982 CB GLU A 60 28.914 6.321 9.480 1.00 1.52 C ATOM 983 CG GLU A 60 28.626 6.444 10.968 1.00 1.73 C ATOM 984 CD GLU A 60 29.617 7.342 11.679 1.00 2.09 C ATOM 985 OE1 GLU A 60 30.718 6.861 12.027 1.00 2.28 O ATOM 986 OE2 GLU A 60 29.302 8.533 11.893 1.00 2.61 O ATOM 0 H GLU A 60 29.181 5.844 7.109 1.00 1.27 H new ATOM 0 HA GLU A 60 27.830 4.497 9.161 1.00 1.41 H new ATOM 0 HB2 GLU A 60 29.900 5.876 9.347 1.00 1.52 H new ATOM 0 HB3 GLU A 60 28.954 7.320 9.045 1.00 1.52 H new ATOM 0 HG2 GLU A 60 27.619 6.837 11.108 1.00 1.73 H new ATOM 0 HG3 GLU A 60 28.648 5.453 11.422 1.00 1.73 H new ATOM 993 N GLY A 61 26.285 7.128 7.929 1.00 1.30 N ATOM 994 CA GLY A 61 25.006 7.819 7.900 1.00 1.30 C ATOM 995 C GLY A 61 23.863 6.897 7.527 1.00 1.26 C ATOM 996 O GLY A 61 22.746 7.054 8.017 1.00 1.27 O ATOM 0 H GLY A 61 26.967 7.465 7.249 1.00 1.30 H new ATOM 0 HA2 GLY A 61 24.811 8.259 8.878 1.00 1.30 H new ATOM 0 HA3 GLY A 61 25.055 8.640 7.185 1.00 1.30 H new ATOM 1000 N TYR A 62 24.152 5.921 6.671 1.00 1.25 N ATOM 1001 CA TYR A 62 23.144 4.962 6.231 1.00 1.31 C ATOM 1002 C TYR A 62 22.771 4.029 7.374 1.00 1.43 C ATOM 1003 O TYR A 62 21.604 3.685 7.546 1.00 1.47 O ATOM 1004 CB TYR A 62 23.631 4.154 5.023 1.00 1.39 C ATOM 1005 CG TYR A 62 23.395 4.851 3.700 1.00 1.59 C ATOM 1006 CD1 TYR A 62 22.148 4.818 3.085 1.00 2.03 C ATOM 1007 CD2 TYR A 62 24.421 5.543 3.068 1.00 2.27 C ATOM 1008 CE1 TYR A 62 21.931 5.455 1.878 1.00 2.60 C ATOM 1009 CE2 TYR A 62 24.212 6.182 1.862 1.00 2.80 C ATOM 1010 CZ TYR A 62 22.966 6.136 1.272 1.00 2.80 C ATOM 1011 OH TYR A 62 22.755 6.771 0.069 1.00 3.54 O ATOM 0 H TYR A 62 25.077 5.773 6.268 1.00 1.25 H new ATOM 0 HA TYR A 62 22.260 5.521 5.925 1.00 1.31 H new ATOM 0 HB2 TYR A 62 24.697 3.954 5.135 1.00 1.39 H new ATOM 0 HB3 TYR A 62 23.124 3.189 5.012 1.00 1.39 H new ATOM 0 HD1 TYR A 62 21.336 4.286 3.558 1.00 2.03 H new ATOM 0 HD2 TYR A 62 25.398 5.582 3.528 1.00 2.27 H new ATOM 0 HE1 TYR A 62 20.957 5.420 1.412 1.00 2.60 H new ATOM 0 HE2 TYR A 62 25.020 6.715 1.383 1.00 2.80 H new ATOM 0 HH TYR A 62 23.584 7.204 -0.222 1.00 3.54 H new ATOM 1021 N THR A 63 23.765 3.631 8.159 1.00 1.55 N ATOM 1022 CA THR A 63 23.529 2.749 9.294 1.00 1.74 C ATOM 1023 C THR A 63 22.695 3.459 10.365 1.00 1.68 C ATOM 1024 O THR A 63 21.926 2.831 11.096 1.00 1.81 O ATOM 1025 CB THR A 63 24.857 2.273 9.915 1.00 1.96 C ATOM 1026 OG1 THR A 63 25.867 2.175 8.901 1.00 2.00 O ATOM 1027 CG2 THR A 63 24.687 0.922 10.589 1.00 2.37 C ATOM 0 H THR A 63 24.739 3.904 8.031 1.00 1.55 H new ATOM 0 HA THR A 63 22.982 1.881 8.925 1.00 1.74 H new ATOM 0 HB THR A 63 25.160 3.003 10.665 1.00 1.96 H new ATOM 0 HG1 THR A 63 26.708 1.874 9.305 1.00 2.00 H new ATOM 0 HG21 THR A 63 25.638 0.608 11.019 1.00 2.37 H new ATOM 0 HG22 THR A 63 23.940 1.001 11.379 1.00 2.37 H new ATOM 0 HG23 THR A 63 24.361 0.187 9.853 1.00 2.37 H new ATOM 1035 N TYR A 64 22.846 4.777 10.440 1.00 1.56 N ATOM 1036 CA TYR A 64 22.108 5.586 11.403 1.00 1.61 C ATOM 1037 C TYR A 64 20.818 6.104 10.786 1.00 1.32 C ATOM 1038 O TYR A 64 20.249 7.097 11.251 1.00 1.40 O ATOM 1039 CB TYR A 64 22.964 6.761 11.882 1.00 1.89 C ATOM 1040 CG TYR A 64 24.018 6.373 12.890 1.00 2.36 C ATOM 1041 CD1 TYR A 64 23.668 5.752 14.078 1.00 2.88 C ATOM 1042 CD2 TYR A 64 25.364 6.626 12.653 1.00 2.94 C ATOM 1043 CE1 TYR A 64 24.625 5.392 15.003 1.00 3.56 C ATOM 1044 CE2 TYR A 64 26.328 6.268 13.576 1.00 3.61 C ATOM 1045 CZ TYR A 64 25.954 5.654 14.749 1.00 3.79 C ATOM 1046 OH TYR A 64 26.910 5.290 15.668 1.00 4.61 O ATOM 0 H TYR A 64 23.477 5.310 9.841 1.00 1.56 H new ATOM 0 HA TYR A 64 21.861 4.957 12.259 1.00 1.61 H new ATOM 0 HB2 TYR A 64 23.449 7.220 11.021 1.00 1.89 H new ATOM 0 HB3 TYR A 64 22.314 7.517 12.322 1.00 1.89 H new ATOM 0 HD1 TYR A 64 22.628 5.546 14.283 1.00 2.88 H new ATOM 0 HD2 TYR A 64 25.661 7.109 11.734 1.00 2.94 H new ATOM 0 HE1 TYR A 64 24.334 4.907 15.923 1.00 3.56 H new ATOM 0 HE2 TYR A 64 27.370 6.469 13.377 1.00 3.61 H new ATOM 0 HH TYR A 64 27.796 5.545 15.336 1.00 4.61 H new ATOM 1056 N GLY A 65 20.356 5.423 9.745 1.00 1.16 N ATOM 1057 CA GLY A 65 19.142 5.817 9.073 1.00 1.08 C ATOM 1058 C GLY A 65 17.894 5.438 9.844 1.00 1.03 C ATOM 1059 O GLY A 65 17.084 4.639 9.375 1.00 1.02 O ATOM 0 H GLY A 65 20.809 4.597 9.354 1.00 1.16 H new ATOM 0 HA2 GLY A 65 19.153 6.896 8.916 1.00 1.08 H new ATOM 0 HA3 GLY A 65 19.110 5.352 8.088 1.00 1.08 H new ATOM 1063 N GLU A 66 17.743 6.006 11.033 1.00 1.04 N ATOM 1064 CA GLU A 66 16.576 5.742 11.862 1.00 1.03 C ATOM 1065 C GLU A 66 15.324 6.225 11.143 1.00 0.98 C ATOM 1066 O GLU A 66 14.280 5.572 11.173 1.00 0.98 O ATOM 1067 CB GLU A 66 16.715 6.443 13.214 1.00 1.10 C ATOM 1068 CG GLU A 66 15.620 6.082 14.205 1.00 1.55 C ATOM 1069 CD GLU A 66 15.726 4.655 14.697 1.00 1.48 C ATOM 1070 OE1 GLU A 66 15.421 3.722 13.928 1.00 1.79 O ATOM 1071 OE2 GLU A 66 16.112 4.459 15.868 1.00 1.73 O ATOM 0 H GLU A 66 18.415 6.653 11.445 1.00 1.04 H new ATOM 0 HA GLU A 66 16.497 4.669 12.039 1.00 1.03 H new ATOM 0 HB2 GLU A 66 17.683 6.189 13.647 1.00 1.10 H new ATOM 0 HB3 GLU A 66 16.709 7.522 13.056 1.00 1.10 H new ATOM 0 HG2 GLU A 66 15.668 6.760 15.057 1.00 1.55 H new ATOM 0 HG3 GLU A 66 14.647 6.229 13.735 1.00 1.55 H new ATOM 1078 N GLU A 67 15.453 7.364 10.476 1.00 0.98 N ATOM 1079 CA GLU A 67 14.354 7.943 9.719 1.00 0.98 C ATOM 1080 C GLU A 67 13.956 6.999 8.592 1.00 0.95 C ATOM 1081 O GLU A 67 12.783 6.878 8.253 1.00 0.93 O ATOM 1082 CB GLU A 67 14.765 9.295 9.149 1.00 1.05 C ATOM 1083 CG GLU A 67 15.401 10.214 10.175 1.00 1.33 C ATOM 1084 CD GLU A 67 16.302 11.246 9.538 1.00 1.79 C ATOM 1085 OE1 GLU A 67 17.279 10.852 8.865 1.00 2.37 O ATOM 1086 OE2 GLU A 67 16.041 12.454 9.705 1.00 2.46 O ATOM 0 H GLU A 67 16.315 7.908 10.445 1.00 0.98 H new ATOM 0 HA GLU A 67 13.501 8.089 10.382 1.00 0.98 H new ATOM 0 HB2 GLU A 67 15.466 9.137 8.329 1.00 1.05 H new ATOM 0 HB3 GLU A 67 13.887 9.785 8.728 1.00 1.05 H new ATOM 0 HG2 GLU A 67 14.619 10.718 10.743 1.00 1.33 H new ATOM 0 HG3 GLU A 67 15.977 9.620 10.884 1.00 1.33 H new ATOM 1093 N ARG A 68 14.951 6.319 8.030 1.00 0.97 N ATOM 1094 CA ARG A 68 14.723 5.365 6.952 1.00 0.99 C ATOM 1095 C ARG A 68 13.829 4.230 7.445 1.00 0.96 C ATOM 1096 O ARG A 68 12.918 3.782 6.742 1.00 0.97 O ATOM 1097 CB ARG A 68 16.069 4.830 6.447 1.00 1.06 C ATOM 1098 CG ARG A 68 15.963 3.804 5.329 1.00 1.17 C ATOM 1099 CD ARG A 68 16.029 2.379 5.870 1.00 1.27 C ATOM 1100 NE ARG A 68 15.737 1.382 4.842 1.00 1.43 N ATOM 1101 CZ ARG A 68 14.508 1.081 4.421 1.00 1.40 C ATOM 1102 NH1 ARG A 68 13.462 1.750 4.887 1.00 1.41 N ATOM 1103 NH2 ARG A 68 14.324 0.126 3.517 1.00 1.70 N ATOM 0 H ARG A 68 15.928 6.413 8.306 1.00 0.97 H new ATOM 0 HA ARG A 68 14.216 5.860 6.123 1.00 0.99 H new ATOM 0 HB2 ARG A 68 16.670 5.669 6.097 1.00 1.06 H new ATOM 0 HB3 ARG A 68 16.604 4.382 7.284 1.00 1.06 H new ATOM 0 HG2 ARG A 68 15.026 3.947 4.790 1.00 1.17 H new ATOM 0 HG3 ARG A 68 16.770 3.960 4.613 1.00 1.17 H new ATOM 0 HD2 ARG A 68 17.022 2.194 6.281 1.00 1.27 H new ATOM 0 HD3 ARG A 68 15.319 2.271 6.690 1.00 1.27 H new ATOM 0 HE ARG A 68 16.522 0.886 4.420 1.00 1.43 H new ATOM 0 HH11 ARG A 68 13.597 2.497 5.569 1.00 1.41 H new ATOM 0 HH12 ARG A 68 12.523 1.518 4.564 1.00 1.41 H new ATOM 0 HH21 ARG A 68 15.125 -0.382 3.141 1.00 1.70 H new ATOM 0 HH22 ARG A 68 13.382 -0.100 3.199 1.00 1.70 H new ATOM 1117 N LYS A 69 14.091 3.782 8.662 1.00 0.95 N ATOM 1118 CA LYS A 69 13.304 2.723 9.274 1.00 0.97 C ATOM 1119 C LYS A 69 11.900 3.229 9.559 1.00 0.91 C ATOM 1120 O LYS A 69 10.930 2.475 9.493 1.00 0.92 O ATOM 1121 CB LYS A 69 13.961 2.247 10.569 1.00 1.04 C ATOM 1122 CG LYS A 69 13.386 0.947 11.108 1.00 1.31 C ATOM 1123 CD LYS A 69 13.890 0.657 12.508 1.00 1.43 C ATOM 1124 CE LYS A 69 13.119 1.450 13.553 1.00 1.48 C ATOM 1125 NZ LYS A 69 13.929 1.685 14.775 1.00 1.54 N ATOM 0 H LYS A 69 14.846 4.137 9.248 1.00 0.95 H new ATOM 0 HA LYS A 69 13.251 1.881 8.584 1.00 0.97 H new ATOM 0 HB2 LYS A 69 15.029 2.117 10.397 1.00 1.04 H new ATOM 0 HB3 LYS A 69 13.853 3.023 11.327 1.00 1.04 H new ATOM 0 HG2 LYS A 69 12.298 1.005 11.116 1.00 1.31 H new ATOM 0 HG3 LYS A 69 13.657 0.125 10.445 1.00 1.31 H new ATOM 0 HD2 LYS A 69 13.796 -0.409 12.716 1.00 1.43 H new ATOM 0 HD3 LYS A 69 14.950 0.902 12.572 1.00 1.43 H new ATOM 0 HE2 LYS A 69 12.813 2.407 13.130 1.00 1.48 H new ATOM 0 HE3 LYS A 69 12.208 0.913 13.818 1.00 1.48 H new ATOM 0 HZ1 LYS A 69 13.330 2.107 15.513 1.00 1.54 H new ATOM 0 HZ2 LYS A 69 14.313 0.781 15.116 1.00 1.54 H new ATOM 0 HZ3 LYS A 69 14.712 2.332 14.553 1.00 1.54 H new ATOM 1139 N LEU A 70 11.806 4.516 9.878 1.00 0.90 N ATOM 1140 CA LEU A 70 10.530 5.152 10.158 1.00 0.88 C ATOM 1141 C LEU A 70 9.647 5.130 8.912 1.00 0.85 C ATOM 1142 O LEU A 70 8.431 4.987 9.008 1.00 0.85 O ATOM 1143 CB LEU A 70 10.749 6.592 10.631 1.00 0.93 C ATOM 1144 CG LEU A 70 9.477 7.417 10.836 1.00 1.01 C ATOM 1145 CD1 LEU A 70 8.771 7.019 12.127 1.00 1.14 C ATOM 1146 CD2 LEU A 70 9.807 8.902 10.838 1.00 1.15 C ATOM 0 H LEU A 70 12.609 5.141 9.949 1.00 0.90 H new ATOM 0 HA LEU A 70 10.028 4.598 10.951 1.00 0.88 H new ATOM 0 HB2 LEU A 70 11.301 6.568 11.571 1.00 0.93 H new ATOM 0 HB3 LEU A 70 11.380 7.103 9.904 1.00 0.93 H new ATOM 0 HG LEU A 70 8.798 7.213 10.008 1.00 1.01 H new ATOM 0 HD11 LEU A 70 7.870 7.620 12.249 1.00 1.14 H new ATOM 0 HD12 LEU A 70 8.500 5.964 12.083 1.00 1.14 H new ATOM 0 HD13 LEU A 70 9.437 7.188 12.973 1.00 1.14 H new ATOM 0 HD21 LEU A 70 8.893 9.478 10.985 1.00 1.15 H new ATOM 0 HD22 LEU A 70 10.506 9.118 11.646 1.00 1.15 H new ATOM 0 HD23 LEU A 70 10.259 9.176 9.885 1.00 1.15 H new ATOM 1158 N TYR A 71 10.269 5.263 7.741 1.00 0.84 N ATOM 1159 CA TYR A 71 9.533 5.245 6.479 1.00 0.86 C ATOM 1160 C TYR A 71 8.897 3.876 6.269 1.00 0.85 C ATOM 1161 O TYR A 71 7.717 3.770 5.936 1.00 0.85 O ATOM 1162 CB TYR A 71 10.450 5.584 5.296 1.00 0.91 C ATOM 1163 CG TYR A 71 11.221 6.877 5.462 1.00 0.92 C ATOM 1164 CD1 TYR A 71 10.668 7.976 6.115 1.00 0.94 C ATOM 1165 CD2 TYR A 71 12.513 6.995 4.966 1.00 0.99 C ATOM 1166 CE1 TYR A 71 11.386 9.147 6.272 1.00 1.01 C ATOM 1167 CE2 TYR A 71 13.232 8.162 5.117 1.00 1.05 C ATOM 1168 CZ TYR A 71 12.664 9.232 5.772 1.00 1.05 C ATOM 1169 OH TYR A 71 13.384 10.391 5.934 1.00 1.16 O ATOM 0 H TYR A 71 11.277 5.384 7.641 1.00 0.84 H new ATOM 0 HA TYR A 71 8.752 6.004 6.530 1.00 0.86 H new ATOM 0 HB2 TYR A 71 11.158 4.767 5.153 1.00 0.91 H new ATOM 0 HB3 TYR A 71 9.848 5.646 4.390 1.00 0.91 H new ATOM 0 HD1 TYR A 71 9.663 7.912 6.505 1.00 0.94 H new ATOM 0 HD2 TYR A 71 12.963 6.158 4.453 1.00 0.99 H new ATOM 0 HE1 TYR A 71 10.946 9.990 6.784 1.00 1.01 H new ATOM 0 HE2 TYR A 71 14.235 8.236 4.724 1.00 1.05 H new ATOM 0 HH TYR A 71 14.268 10.287 5.524 1.00 1.16 H new ATOM 1179 N ASP A 72 9.687 2.825 6.481 1.00 0.86 N ATOM 1180 CA ASP A 72 9.190 1.456 6.333 1.00 0.90 C ATOM 1181 C ASP A 72 8.104 1.180 7.366 1.00 0.87 C ATOM 1182 O ASP A 72 7.165 0.428 7.114 1.00 0.87 O ATOM 1183 CB ASP A 72 10.326 0.433 6.480 1.00 0.98 C ATOM 1184 CG ASP A 72 10.962 0.056 5.150 1.00 1.21 C ATOM 1185 OD1 ASP A 72 11.066 0.934 4.269 1.00 1.48 O ATOM 1186 OD2 ASP A 72 11.394 -1.109 4.996 1.00 1.47 O ATOM 0 H ASP A 72 10.667 2.893 6.754 1.00 0.86 H new ATOM 0 HA ASP A 72 8.770 1.355 5.332 1.00 0.90 H new ATOM 0 HB2 ASP A 72 11.092 0.841 7.140 1.00 0.98 H new ATOM 0 HB3 ASP A 72 9.938 -0.466 6.959 1.00 0.98 H new ATOM 1191 N SER A 73 8.228 1.818 8.527 1.00 0.85 N ATOM 1192 CA SER A 73 7.255 1.659 9.599 1.00 0.85 C ATOM 1193 C SER A 73 5.921 2.283 9.194 1.00 0.81 C ATOM 1194 O SER A 73 4.855 1.826 9.610 1.00 0.80 O ATOM 1195 CB SER A 73 7.777 2.303 10.886 1.00 0.90 C ATOM 1196 OG SER A 73 9.032 1.752 11.258 1.00 0.96 O ATOM 0 H SER A 73 8.996 2.452 8.748 1.00 0.85 H new ATOM 0 HA SER A 73 7.101 0.595 9.781 1.00 0.85 H new ATOM 0 HB2 SER A 73 7.876 3.379 10.744 1.00 0.90 H new ATOM 0 HB3 SER A 73 7.057 2.152 11.690 1.00 0.90 H new ATOM 0 HG SER A 73 9.737 2.134 10.695 1.00 0.96 H new ATOM 1202 N ALA A 74 5.989 3.333 8.378 1.00 0.80 N ATOM 1203 CA ALA A 74 4.793 3.999 7.898 1.00 0.79 C ATOM 1204 C ALA A 74 4.071 3.093 6.916 1.00 0.76 C ATOM 1205 O ALA A 74 2.850 3.144 6.781 1.00 0.75 O ATOM 1206 CB ALA A 74 5.138 5.337 7.259 1.00 0.82 C ATOM 0 H ALA A 74 6.862 3.736 8.039 1.00 0.80 H new ATOM 0 HA ALA A 74 4.133 4.202 8.741 1.00 0.79 H new ATOM 0 HB1 ALA A 74 4.226 5.818 6.907 1.00 0.82 H new ATOM 0 HB2 ALA A 74 5.625 5.977 7.995 1.00 0.82 H new ATOM 0 HB3 ALA A 74 5.811 5.175 6.417 1.00 0.82 H new ATOM 1212 N LEU A 75 4.849 2.253 6.243 1.00 0.77 N ATOM 1213 CA LEU A 75 4.307 1.300 5.292 1.00 0.78 C ATOM 1214 C LEU A 75 3.531 0.232 6.056 1.00 0.77 C ATOM 1215 O LEU A 75 2.498 -0.250 5.597 1.00 0.77 O ATOM 1216 CB LEU A 75 5.436 0.673 4.465 1.00 0.83 C ATOM 1217 CG LEU A 75 5.083 0.300 3.019 1.00 0.92 C ATOM 1218 CD1 LEU A 75 4.173 -0.914 2.975 1.00 1.13 C ATOM 1219 CD2 LEU A 75 4.443 1.472 2.293 1.00 1.15 C ATOM 0 H LEU A 75 5.863 2.216 6.342 1.00 0.77 H new ATOM 0 HA LEU A 75 3.634 1.807 4.601 1.00 0.78 H new ATOM 0 HB2 LEU A 75 6.275 1.369 4.445 1.00 0.83 H new ATOM 0 HB3 LEU A 75 5.779 -0.226 4.978 1.00 0.83 H new ATOM 0 HG LEU A 75 6.012 0.048 2.507 1.00 0.92 H new ATOM 0 HD11 LEU A 75 3.939 -1.156 1.938 1.00 1.13 H new ATOM 0 HD12 LEU A 75 4.675 -1.762 3.441 1.00 1.13 H new ATOM 0 HD13 LEU A 75 3.251 -0.697 3.514 1.00 1.13 H new ATOM 0 HD21 LEU A 75 4.203 1.180 1.271 1.00 1.15 H new ATOM 0 HD22 LEU A 75 3.530 1.765 2.810 1.00 1.15 H new ATOM 0 HD23 LEU A 75 5.137 2.313 2.277 1.00 1.15 H new ATOM 1231 N SER A 76 4.025 -0.107 7.242 1.00 0.78 N ATOM 1232 CA SER A 76 3.372 -1.093 8.091 1.00 0.80 C ATOM 1233 C SER A 76 1.999 -0.586 8.529 1.00 0.76 C ATOM 1234 O SER A 76 1.084 -1.366 8.794 1.00 0.77 O ATOM 1235 CB SER A 76 4.245 -1.386 9.312 1.00 0.85 C ATOM 1236 OG SER A 76 5.612 -1.455 8.949 1.00 0.88 O ATOM 0 H SER A 76 4.878 0.289 7.637 1.00 0.78 H new ATOM 0 HA SER A 76 3.236 -2.015 7.525 1.00 0.80 H new ATOM 0 HB2 SER A 76 4.102 -0.608 10.062 1.00 0.85 H new ATOM 0 HB3 SER A 76 3.937 -2.327 9.767 1.00 0.85 H new ATOM 0 HG SER A 76 6.153 -1.641 9.745 1.00 0.88 H new ATOM 1242 N LYS A 77 1.863 0.737 8.596 1.00 0.75 N ATOM 1243 CA LYS A 77 0.603 1.358 8.980 1.00 0.74 C ATOM 1244 C LYS A 77 -0.425 1.156 7.873 1.00 0.71 C ATOM 1245 O LYS A 77 -1.605 0.937 8.140 1.00 0.70 O ATOM 1246 CB LYS A 77 0.801 2.851 9.266 1.00 0.76 C ATOM 1247 CG LYS A 77 1.769 3.124 10.410 1.00 0.90 C ATOM 1248 CD LYS A 77 1.991 4.614 10.627 1.00 0.98 C ATOM 1249 CE LYS A 77 0.737 5.298 11.145 1.00 1.35 C ATOM 1250 NZ LYS A 77 1.046 6.298 12.199 1.00 1.61 N ATOM 0 H LYS A 77 2.612 1.397 8.389 1.00 0.75 H new ATOM 0 HA LYS A 77 0.239 0.886 9.893 1.00 0.74 H new ATOM 0 HB2 LYS A 77 1.168 3.341 8.364 1.00 0.76 H new ATOM 0 HB3 LYS A 77 -0.164 3.299 9.502 1.00 0.76 H new ATOM 0 HG2 LYS A 77 1.382 2.678 11.326 1.00 0.90 H new ATOM 0 HG3 LYS A 77 2.724 2.642 10.200 1.00 0.90 H new ATOM 0 HD2 LYS A 77 2.806 4.761 11.336 1.00 0.98 H new ATOM 0 HD3 LYS A 77 2.297 5.077 9.689 1.00 0.98 H new ATOM 0 HE2 LYS A 77 0.224 5.789 10.318 1.00 1.35 H new ATOM 0 HE3 LYS A 77 0.054 4.549 11.545 1.00 1.35 H new ATOM 0 HZ1 LYS A 77 0.164 6.742 12.526 1.00 1.61 H new ATOM 0 HZ2 LYS A 77 1.513 5.826 12.999 1.00 1.61 H new ATOM 0 HZ3 LYS A 77 1.678 7.027 11.811 1.00 1.61 H new ATOM 1264 N ILE A 78 0.040 1.204 6.630 1.00 0.71 N ATOM 1265 CA ILE A 78 -0.831 1.009 5.483 1.00 0.71 C ATOM 1266 C ILE A 78 -1.309 -0.442 5.446 1.00 0.70 C ATOM 1267 O ILE A 78 -2.436 -0.721 5.036 1.00 0.69 O ATOM 1268 CB ILE A 78 -0.140 1.421 4.151 1.00 0.77 C ATOM 1269 CG1 ILE A 78 -1.061 2.339 3.338 1.00 1.04 C ATOM 1270 CG2 ILE A 78 0.285 0.217 3.312 1.00 0.84 C ATOM 1271 CD1 ILE A 78 -2.318 1.665 2.821 1.00 1.33 C ATOM 0 H ILE A 78 1.017 1.377 6.393 1.00 0.71 H new ATOM 0 HA ILE A 78 -1.697 1.662 5.591 1.00 0.71 H new ATOM 0 HB ILE A 78 0.770 1.960 4.416 1.00 0.77 H new ATOM 0 HG12 ILE A 78 -1.347 3.188 3.958 1.00 1.04 H new ATOM 0 HG13 ILE A 78 -0.502 2.737 2.491 1.00 1.04 H new ATOM 0 HG21 ILE A 78 0.761 0.563 2.395 1.00 0.84 H new ATOM 0 HG22 ILE A 78 0.989 -0.392 3.879 1.00 0.84 H new ATOM 0 HG23 ILE A 78 -0.592 -0.380 3.063 1.00 0.84 H new ATOM 0 HD11 ILE A 78 -2.911 2.385 2.258 1.00 1.33 H new ATOM 0 HD12 ILE A 78 -2.044 0.833 2.172 1.00 1.33 H new ATOM 0 HD13 ILE A 78 -2.903 1.292 3.662 1.00 1.33 H new ATOM 1283 N GLU A 79 -0.449 -1.354 5.896 1.00 0.72 N ATOM 1284 CA GLU A 79 -0.789 -2.771 5.941 1.00 0.74 C ATOM 1285 C GLU A 79 -1.982 -2.979 6.875 1.00 0.73 C ATOM 1286 O GLU A 79 -2.849 -3.817 6.622 1.00 0.74 O ATOM 1287 CB GLU A 79 0.433 -3.595 6.384 1.00 0.79 C ATOM 1288 CG GLU A 79 0.208 -4.467 7.614 1.00 1.00 C ATOM 1289 CD GLU A 79 0.209 -5.950 7.298 1.00 1.32 C ATOM 1290 OE1 GLU A 79 1.293 -6.568 7.335 1.00 1.95 O ATOM 1291 OE2 GLU A 79 -0.880 -6.503 7.031 1.00 1.93 O ATOM 0 H GLU A 79 0.488 -1.135 6.234 1.00 0.72 H new ATOM 0 HA GLU A 79 -1.072 -3.115 4.946 1.00 0.74 H new ATOM 0 HB2 GLU A 79 0.742 -4.233 5.556 1.00 0.79 H new ATOM 0 HB3 GLU A 79 1.259 -2.913 6.586 1.00 0.79 H new ATOM 0 HG2 GLU A 79 0.986 -4.257 8.348 1.00 1.00 H new ATOM 0 HG3 GLU A 79 -0.744 -4.200 8.073 1.00 1.00 H new ATOM 1298 N LYS A 80 -2.029 -2.182 7.945 1.00 0.72 N ATOM 1299 CA LYS A 80 -3.118 -2.257 8.907 1.00 0.73 C ATOM 1300 C LYS A 80 -4.411 -1.793 8.256 1.00 0.72 C ATOM 1301 O LYS A 80 -5.473 -2.370 8.480 1.00 0.75 O ATOM 1302 CB LYS A 80 -2.824 -1.386 10.133 1.00 0.74 C ATOM 1303 CG LYS A 80 -1.556 -1.767 10.874 1.00 0.81 C ATOM 1304 CD LYS A 80 -1.434 -1.003 12.181 1.00 0.96 C ATOM 1305 CE LYS A 80 -0.208 -1.433 12.964 1.00 1.35 C ATOM 1306 NZ LYS A 80 -0.301 -2.846 13.414 1.00 1.71 N ATOM 0 H LYS A 80 -1.323 -1.479 8.162 1.00 0.72 H new ATOM 0 HA LYS A 80 -3.219 -3.293 9.231 1.00 0.73 H new ATOM 0 HB2 LYS A 80 -2.748 -0.346 9.817 1.00 0.74 H new ATOM 0 HB3 LYS A 80 -3.667 -1.449 10.821 1.00 0.74 H new ATOM 0 HG2 LYS A 80 -1.557 -2.838 11.075 1.00 0.81 H new ATOM 0 HG3 LYS A 80 -0.689 -1.561 10.247 1.00 0.81 H new ATOM 0 HD2 LYS A 80 -1.379 0.066 11.975 1.00 0.96 H new ATOM 0 HD3 LYS A 80 -2.328 -1.166 12.784 1.00 0.96 H new ATOM 0 HE2 LYS A 80 0.680 -1.308 12.344 1.00 1.35 H new ATOM 0 HE3 LYS A 80 -0.086 -0.784 13.831 1.00 1.35 H new ATOM 0 HZ1 LYS A 80 0.438 -3.034 14.121 1.00 1.71 H new ATOM 0 HZ2 LYS A 80 -1.236 -3.015 13.837 1.00 1.71 H new ATOM 0 HZ3 LYS A 80 -0.170 -3.479 12.599 1.00 1.71 H new ATOM 1320 N LEU A 81 -4.302 -0.757 7.427 1.00 0.69 N ATOM 1321 CA LEU A 81 -5.451 -0.207 6.725 1.00 0.71 C ATOM 1322 C LEU A 81 -6.089 -1.273 5.843 1.00 0.72 C ATOM 1323 O LEU A 81 -7.315 -1.358 5.744 1.00 0.76 O ATOM 1324 CB LEU A 81 -5.034 0.998 5.873 1.00 0.71 C ATOM 1325 CG LEU A 81 -5.439 2.374 6.418 1.00 0.78 C ATOM 1326 CD1 LEU A 81 -6.951 2.476 6.557 1.00 1.00 C ATOM 1327 CD2 LEU A 81 -4.757 2.646 7.750 1.00 0.94 C ATOM 0 H LEU A 81 -3.422 -0.282 7.227 1.00 0.69 H new ATOM 0 HA LEU A 81 -6.180 0.124 7.464 1.00 0.71 H new ATOM 0 HB2 LEU A 81 -3.950 0.979 5.757 1.00 0.71 H new ATOM 0 HB3 LEU A 81 -5.464 0.882 4.878 1.00 0.71 H new ATOM 0 HG LEU A 81 -5.112 3.132 5.706 1.00 0.78 H new ATOM 0 HD11 LEU A 81 -7.215 3.460 6.945 1.00 1.00 H new ATOM 0 HD12 LEU A 81 -7.416 2.334 5.582 1.00 1.00 H new ATOM 0 HD13 LEU A 81 -7.306 1.708 7.244 1.00 1.00 H new ATOM 0 HD21 LEU A 81 -5.058 3.627 8.119 1.00 0.94 H new ATOM 0 HD22 LEU A 81 -5.048 1.882 8.471 1.00 0.94 H new ATOM 0 HD23 LEU A 81 -3.675 2.625 7.616 1.00 0.94 H new ATOM 1339 N ILE A 82 -5.253 -2.102 5.225 1.00 0.72 N ATOM 1340 CA ILE A 82 -5.734 -3.171 4.363 1.00 0.76 C ATOM 1341 C ILE A 82 -6.585 -4.152 5.170 1.00 0.80 C ATOM 1342 O ILE A 82 -7.625 -4.622 4.702 1.00 0.84 O ATOM 1343 CB ILE A 82 -4.569 -3.932 3.686 1.00 0.75 C ATOM 1344 CG1 ILE A 82 -3.562 -2.942 3.087 1.00 0.74 C ATOM 1345 CG2 ILE A 82 -5.110 -4.860 2.605 1.00 0.80 C ATOM 1346 CD1 ILE A 82 -2.360 -3.598 2.434 1.00 0.77 C ATOM 0 H ILE A 82 -4.238 -2.052 5.307 1.00 0.72 H new ATOM 0 HA ILE A 82 -6.338 -2.714 3.580 1.00 0.76 H new ATOM 0 HB ILE A 82 -4.056 -4.532 4.438 1.00 0.75 H new ATOM 0 HG12 ILE A 82 -4.072 -2.325 2.347 1.00 0.74 H new ATOM 0 HG13 ILE A 82 -3.214 -2.273 3.874 1.00 0.74 H new ATOM 0 HG21 ILE A 82 -4.283 -5.391 2.134 1.00 0.80 H new ATOM 0 HG22 ILE A 82 -5.795 -5.580 3.053 1.00 0.80 H new ATOM 0 HG23 ILE A 82 -5.639 -4.274 1.854 1.00 0.80 H new ATOM 0 HD11 ILE A 82 -1.698 -2.829 2.036 1.00 0.77 H new ATOM 0 HD12 ILE A 82 -1.823 -4.192 3.174 1.00 0.77 H new ATOM 0 HD13 ILE A 82 -2.694 -4.244 1.623 1.00 0.77 H new ATOM 1358 N GLU A 83 -6.146 -4.432 6.396 1.00 0.80 N ATOM 1359 CA GLU A 83 -6.866 -5.344 7.286 1.00 0.86 C ATOM 1360 C GLU A 83 -8.157 -4.705 7.777 1.00 0.85 C ATOM 1361 O GLU A 83 -9.130 -5.390 8.072 1.00 0.90 O ATOM 1362 CB GLU A 83 -5.993 -5.745 8.480 1.00 0.90 C ATOM 1363 CG GLU A 83 -6.500 -6.981 9.210 1.00 1.24 C ATOM 1364 CD GLU A 83 -6.583 -6.789 10.712 1.00 1.70 C ATOM 1365 OE1 GLU A 83 -5.580 -6.352 11.318 1.00 2.36 O ATOM 1366 OE2 GLU A 83 -7.643 -7.090 11.300 1.00 2.18 O ATOM 0 H GLU A 83 -5.294 -4.040 6.797 1.00 0.80 H new ATOM 0 HA GLU A 83 -7.111 -6.242 6.719 1.00 0.86 H new ATOM 0 HB2 GLU A 83 -4.976 -5.929 8.132 1.00 0.90 H new ATOM 0 HB3 GLU A 83 -5.944 -4.912 9.181 1.00 0.90 H new ATOM 0 HG2 GLU A 83 -7.487 -7.243 8.828 1.00 1.24 H new ATOM 0 HG3 GLU A 83 -5.840 -7.821 8.992 1.00 1.24 H new ATOM 1373 N THR A 84 -8.164 -3.384 7.861 1.00 0.82 N ATOM 1374 CA THR A 84 -9.347 -2.665 8.307 1.00 0.84 C ATOM 1375 C THR A 84 -10.413 -2.689 7.211 1.00 0.89 C ATOM 1376 O THR A 84 -11.614 -2.669 7.487 1.00 0.92 O ATOM 1377 CB THR A 84 -9.019 -1.205 8.671 1.00 0.83 C ATOM 1378 OG1 THR A 84 -7.734 -1.122 9.313 1.00 0.84 O ATOM 1379 CG2 THR A 84 -10.077 -0.618 9.593 1.00 0.85 C ATOM 0 H THR A 84 -7.368 -2.790 7.628 1.00 0.82 H new ATOM 0 HA THR A 84 -9.721 -3.163 9.202 1.00 0.84 H new ATOM 0 HB THR A 84 -9.001 -0.632 7.744 1.00 0.83 H new ATOM 0 HG1 THR A 84 -7.054 -1.529 8.737 1.00 0.84 H new ATOM 0 HG21 THR A 84 -9.819 0.413 9.833 1.00 0.85 H new ATOM 0 HG22 THR A 84 -11.047 -0.643 9.096 1.00 0.85 H new ATOM 0 HG23 THR A 84 -10.124 -1.203 10.511 1.00 0.85 H new ATOM 1387 N LEU A 85 -9.957 -2.719 5.962 1.00 0.93 N ATOM 1388 CA LEU A 85 -10.855 -2.775 4.818 1.00 1.01 C ATOM 1389 C LEU A 85 -11.330 -4.206 4.610 1.00 1.08 C ATOM 1390 O LEU A 85 -12.509 -4.454 4.364 1.00 1.17 O ATOM 1391 CB LEU A 85 -10.141 -2.283 3.555 1.00 1.04 C ATOM 1392 CG LEU A 85 -9.791 -0.791 3.534 1.00 1.05 C ATOM 1393 CD1 LEU A 85 -8.721 -0.512 2.492 1.00 1.22 C ATOM 1394 CD2 LEU A 85 -11.030 0.042 3.246 1.00 1.13 C ATOM 0 H LEU A 85 -8.967 -2.705 5.718 1.00 0.93 H new ATOM 0 HA LEU A 85 -11.712 -2.130 5.013 1.00 1.01 H new ATOM 0 HB2 LEU A 85 -9.222 -2.856 3.432 1.00 1.04 H new ATOM 0 HB3 LEU A 85 -10.771 -2.503 2.693 1.00 1.04 H new ATOM 0 HG LEU A 85 -9.405 -0.515 4.515 1.00 1.05 H new ATOM 0 HD11 LEU A 85 -8.484 0.552 2.490 1.00 1.22 H new ATOM 0 HD12 LEU A 85 -7.824 -1.083 2.730 1.00 1.22 H new ATOM 0 HD13 LEU A 85 -9.087 -0.804 1.508 1.00 1.22 H new ATOM 0 HD21 LEU A 85 -10.763 1.099 3.235 1.00 1.13 H new ATOM 0 HD22 LEU A 85 -11.440 -0.239 2.276 1.00 1.13 H new ATOM 0 HD23 LEU A 85 -11.776 -0.136 4.021 1.00 1.13 H new ATOM 1406 N SER A 86 -10.400 -5.142 4.729 1.00 1.18 N ATOM 1407 CA SER A 86 -10.707 -6.553 4.555 1.00 1.31 C ATOM 1408 C SER A 86 -10.216 -7.358 5.754 1.00 1.73 C ATOM 1409 O SER A 86 -9.111 -7.905 5.739 1.00 2.31 O ATOM 1410 CB SER A 86 -10.067 -7.065 3.264 1.00 1.71 C ATOM 1411 OG SER A 86 -9.551 -5.986 2.496 1.00 1.97 O ATOM 0 H SER A 86 -9.422 -4.948 4.946 1.00 1.18 H new ATOM 0 HA SER A 86 -11.788 -6.675 4.485 1.00 1.31 H new ATOM 0 HB2 SER A 86 -9.265 -7.764 3.502 1.00 1.71 H new ATOM 0 HB3 SER A 86 -10.805 -7.614 2.679 1.00 1.71 H new ATOM 0 HG SER A 86 -9.144 -6.334 1.675 1.00 1.97 H new ATOM 1914 N LYS B 10 15.157 15.404 3.582 1.00 1.52 N ATOM 1915 CA LYS B 10 14.484 14.641 4.626 1.00 1.44 C ATOM 1916 C LYS B 10 13.066 15.145 4.859 1.00 1.38 C ATOM 1917 O LYS B 10 12.139 14.352 5.005 1.00 1.32 O ATOM 1918 CB LYS B 10 15.278 14.699 5.931 1.00 1.48 C ATOM 1919 CG LYS B 10 15.804 13.349 6.386 1.00 1.54 C ATOM 1920 CD LYS B 10 16.594 12.661 5.285 1.00 1.71 C ATOM 1921 CE LYS B 10 17.192 11.347 5.757 1.00 2.08 C ATOM 1922 NZ LYS B 10 18.647 11.471 6.035 1.00 2.41 N ATOM 0 HA LYS B 10 14.426 13.606 4.289 1.00 1.44 H new ATOM 0 HB2 LYS B 10 16.118 15.382 5.805 1.00 1.48 H new ATOM 0 HB3 LYS B 10 14.644 15.114 6.714 1.00 1.48 H new ATOM 0 HG2 LYS B 10 16.438 13.481 7.263 1.00 1.54 H new ATOM 0 HG3 LYS B 10 14.970 12.715 6.688 1.00 1.54 H new ATOM 0 HD2 LYS B 10 15.943 12.478 4.430 1.00 1.71 H new ATOM 0 HD3 LYS B 10 17.391 13.321 4.943 1.00 1.71 H new ATOM 0 HE2 LYS B 10 16.677 11.016 6.659 1.00 2.08 H new ATOM 0 HE3 LYS B 10 17.031 10.581 4.998 1.00 2.08 H new ATOM 0 HZ1 LYS B 10 19.019 10.554 6.355 1.00 2.41 H new ATOM 0 HZ2 LYS B 10 19.142 11.762 5.168 1.00 2.41 H new ATOM 0 HZ3 LYS B 10 18.799 12.184 6.777 1.00 2.41 H new ATOM 1936 N GLU B 11 12.905 16.461 4.881 1.00 1.42 N ATOM 1937 CA GLU B 11 11.600 17.068 5.093 1.00 1.39 C ATOM 1938 C GLU B 11 10.659 16.753 3.929 1.00 1.36 C ATOM 1939 O GLU B 11 9.450 16.613 4.116 1.00 1.30 O ATOM 1940 CB GLU B 11 11.737 18.584 5.256 1.00 1.47 C ATOM 1941 CG GLU B 11 10.583 19.215 6.013 1.00 1.48 C ATOM 1942 CD GLU B 11 10.310 20.640 5.581 1.00 1.62 C ATOM 1943 OE1 GLU B 11 9.748 20.839 4.482 1.00 1.90 O ATOM 1944 OE2 GLU B 11 10.659 21.570 6.332 1.00 1.72 O ATOM 0 H GLU B 11 13.665 17.130 4.754 1.00 1.42 H new ATOM 0 HA GLU B 11 11.176 16.649 6.006 1.00 1.39 H new ATOM 0 HB2 GLU B 11 12.668 18.803 5.779 1.00 1.47 H new ATOM 0 HB3 GLU B 11 11.809 19.043 4.270 1.00 1.47 H new ATOM 0 HG2 GLU B 11 9.685 18.616 5.863 1.00 1.48 H new ATOM 0 HG3 GLU B 11 10.802 19.199 7.081 1.00 1.48 H new ATOM 1951 N LEU B 12 11.228 16.592 2.738 1.00 1.43 N ATOM 1952 CA LEU B 12 10.441 16.324 1.542 1.00 1.45 C ATOM 1953 C LEU B 12 9.739 14.966 1.599 1.00 1.36 C ATOM 1954 O LEU B 12 8.513 14.910 1.628 1.00 1.32 O ATOM 1955 CB LEU B 12 11.327 16.408 0.295 1.00 1.57 C ATOM 1956 CG LEU B 12 10.603 16.197 -1.035 1.00 1.73 C ATOM 1957 CD1 LEU B 12 9.706 17.385 -1.353 1.00 1.89 C ATOM 1958 CD2 LEU B 12 11.606 15.968 -2.153 1.00 1.89 C ATOM 0 H LEU B 12 12.234 16.643 2.577 1.00 1.43 H new ATOM 0 HA LEU B 12 9.665 17.087 1.490 1.00 1.45 H new ATOM 0 HB2 LEU B 12 11.809 17.386 0.277 1.00 1.57 H new ATOM 0 HB3 LEU B 12 12.119 15.664 0.381 1.00 1.57 H new ATOM 0 HG LEU B 12 9.974 15.311 -0.949 1.00 1.73 H new ATOM 0 HD11 LEU B 12 9.200 17.215 -2.303 1.00 1.89 H new ATOM 0 HD12 LEU B 12 8.964 17.503 -0.563 1.00 1.89 H new ATOM 0 HD13 LEU B 12 10.310 18.289 -1.421 1.00 1.89 H new ATOM 0 HD21 LEU B 12 11.075 15.819 -3.093 1.00 1.89 H new ATOM 0 HD22 LEU B 12 12.260 16.836 -2.239 1.00 1.89 H new ATOM 0 HD23 LEU B 12 12.204 15.084 -1.930 1.00 1.89 H new ATOM 1970 N LEU B 13 10.504 13.877 1.664 1.00 1.35 N ATOM 1971 CA LEU B 13 9.904 12.542 1.681 1.00 1.30 C ATOM 1972 C LEU B 13 9.119 12.283 2.964 1.00 1.18 C ATOM 1973 O LEU B 13 8.168 11.502 2.961 1.00 1.15 O ATOM 1974 CB LEU B 13 10.947 11.436 1.455 1.00 1.35 C ATOM 1975 CG LEU B 13 12.415 11.814 1.679 1.00 1.32 C ATOM 1976 CD1 LEU B 13 12.763 11.731 3.156 1.00 1.48 C ATOM 1977 CD2 LEU B 13 13.323 10.897 0.868 1.00 1.50 C ATOM 0 H LEU B 13 11.523 13.890 1.705 1.00 1.35 H new ATOM 0 HA LEU B 13 9.202 12.514 0.847 1.00 1.30 H new ATOM 0 HB2 LEU B 13 10.706 10.602 2.115 1.00 1.35 H new ATOM 0 HB3 LEU B 13 10.842 11.074 0.432 1.00 1.35 H new ATOM 0 HG LEU B 13 12.567 12.841 1.345 1.00 1.32 H new ATOM 0 HD11 LEU B 13 13.809 12.002 3.299 1.00 1.48 H new ATOM 0 HD12 LEU B 13 12.130 12.417 3.718 1.00 1.48 H new ATOM 0 HD13 LEU B 13 12.600 10.714 3.512 1.00 1.48 H new ATOM 0 HD21 LEU B 13 14.364 11.175 1.035 1.00 1.50 H new ATOM 0 HD22 LEU B 13 13.169 9.864 1.180 1.00 1.50 H new ATOM 0 HD23 LEU B 13 13.087 10.995 -0.192 1.00 1.50 H new ATOM 1989 N LEU B 14 9.503 12.940 4.057 1.00 1.15 N ATOM 1990 CA LEU B 14 8.804 12.767 5.323 1.00 1.07 C ATOM 1991 C LEU B 14 7.369 13.262 5.194 1.00 1.07 C ATOM 1992 O LEU B 14 6.423 12.549 5.517 1.00 1.02 O ATOM 1993 CB LEU B 14 9.518 13.518 6.449 1.00 1.08 C ATOM 1994 CG LEU B 14 8.964 13.265 7.851 1.00 1.04 C ATOM 1995 CD1 LEU B 14 9.441 11.922 8.382 1.00 1.06 C ATOM 1996 CD2 LEU B 14 9.372 14.391 8.787 1.00 1.14 C ATOM 0 H LEU B 14 10.288 13.591 4.089 1.00 1.15 H new ATOM 0 HA LEU B 14 8.799 11.706 5.571 1.00 1.07 H new ATOM 0 HB2 LEU B 14 10.572 13.242 6.437 1.00 1.08 H new ATOM 0 HB3 LEU B 14 9.466 14.587 6.242 1.00 1.08 H new ATOM 0 HG LEU B 14 7.876 13.238 7.796 1.00 1.04 H new ATOM 0 HD11 LEU B 14 9.036 11.761 9.381 1.00 1.06 H new ATOM 0 HD12 LEU B 14 9.100 11.127 7.719 1.00 1.06 H new ATOM 0 HD13 LEU B 14 10.530 11.914 8.427 1.00 1.06 H new ATOM 0 HD21 LEU B 14 8.972 14.200 9.783 1.00 1.14 H new ATOM 0 HD22 LEU B 14 10.459 14.446 8.838 1.00 1.14 H new ATOM 0 HD23 LEU B 14 8.978 15.336 8.413 1.00 1.14 H new ATOM 2008 N LYS B 15 7.220 14.481 4.688 1.00 1.15 N ATOM 2009 CA LYS B 15 5.906 15.082 4.503 1.00 1.18 C ATOM 2010 C LYS B 15 5.119 14.347 3.418 1.00 1.13 C ATOM 2011 O LYS B 15 3.892 14.286 3.470 1.00 1.11 O ATOM 2012 CB LYS B 15 6.044 16.563 4.147 1.00 1.32 C ATOM 2013 CG LYS B 15 6.414 17.434 5.335 1.00 1.46 C ATOM 2014 CD LYS B 15 7.248 18.635 4.917 1.00 1.55 C ATOM 2015 CE LYS B 15 6.477 19.576 4.008 1.00 1.76 C ATOM 2016 NZ LYS B 15 7.363 20.597 3.388 1.00 1.80 N ATOM 0 H LYS B 15 7.997 15.074 4.398 1.00 1.15 H new ATOM 0 HA LYS B 15 5.357 14.996 5.441 1.00 1.18 H new ATOM 0 HB2 LYS B 15 6.803 16.674 3.373 1.00 1.32 H new ATOM 0 HB3 LYS B 15 5.104 16.917 3.724 1.00 1.32 H new ATOM 0 HG2 LYS B 15 5.506 17.777 5.831 1.00 1.46 H new ATOM 0 HG3 LYS B 15 6.969 16.841 6.062 1.00 1.46 H new ATOM 0 HD2 LYS B 15 7.575 19.176 5.805 1.00 1.55 H new ATOM 0 HD3 LYS B 15 8.147 18.291 4.404 1.00 1.55 H new ATOM 0 HE2 LYS B 15 5.983 19.001 3.225 1.00 1.76 H new ATOM 0 HE3 LYS B 15 5.694 20.074 4.580 1.00 1.76 H new ATOM 0 HZ1 LYS B 15 6.818 21.463 3.201 1.00 1.80 H new ATOM 0 HZ2 LYS B 15 8.148 20.815 4.035 1.00 1.80 H new ATOM 0 HZ3 LYS B 15 7.744 20.228 2.493 1.00 1.80 H new ATOM 2030 N LYS B 16 5.830 13.788 2.441 1.00 1.14 N ATOM 2031 CA LYS B 16 5.187 13.054 1.356 1.00 1.14 C ATOM 2032 C LYS B 16 4.556 11.761 1.872 1.00 1.03 C ATOM 2033 O LYS B 16 3.371 11.512 1.657 1.00 1.01 O ATOM 2034 CB LYS B 16 6.196 12.719 0.247 1.00 1.22 C ATOM 2035 CG LYS B 16 6.731 13.934 -0.499 1.00 1.31 C ATOM 2036 CD LYS B 16 5.684 14.556 -1.406 1.00 1.30 C ATOM 2037 CE LYS B 16 5.421 13.707 -2.633 1.00 1.45 C ATOM 2038 NZ LYS B 16 4.869 14.515 -3.754 1.00 1.65 N ATOM 0 H LYS B 16 6.847 13.829 2.379 1.00 1.14 H new ATOM 0 HA LYS B 16 4.406 13.694 0.946 1.00 1.14 H new ATOM 0 HB2 LYS B 16 7.034 12.178 0.686 1.00 1.22 H new ATOM 0 HB3 LYS B 16 5.722 12.047 -0.469 1.00 1.22 H new ATOM 0 HG2 LYS B 16 7.075 14.678 0.220 1.00 1.31 H new ATOM 0 HG3 LYS B 16 7.597 13.641 -1.093 1.00 1.31 H new ATOM 0 HD2 LYS B 16 4.755 14.688 -0.851 1.00 1.30 H new ATOM 0 HD3 LYS B 16 6.015 15.548 -1.715 1.00 1.30 H new ATOM 0 HE2 LYS B 16 6.348 13.230 -2.951 1.00 1.45 H new ATOM 0 HE3 LYS B 16 4.722 12.910 -2.381 1.00 1.45 H new ATOM 0 HZ1 LYS B 16 4.702 13.900 -4.576 1.00 1.65 H new ATOM 0 HZ2 LYS B 16 3.972 14.950 -3.459 1.00 1.65 H new ATOM 0 HZ3 LYS B 16 5.547 15.260 -4.012 1.00 1.65 H new ATOM 2052 N ILE B 17 5.353 10.952 2.568 1.00 0.98 N ATOM 2053 CA ILE B 17 4.876 9.678 3.097 1.00 0.92 C ATOM 2054 C ILE B 17 3.874 9.896 4.231 1.00 0.89 C ATOM 2055 O ILE B 17 2.943 9.111 4.407 1.00 0.86 O ATOM 2056 CB ILE B 17 6.047 8.776 3.565 1.00 0.94 C ATOM 2057 CG1 ILE B 17 7.052 8.587 2.418 1.00 1.00 C ATOM 2058 CG2 ILE B 17 5.531 7.419 4.036 1.00 1.00 C ATOM 2059 CD1 ILE B 17 8.202 7.654 2.744 1.00 0.96 C ATOM 0 H ILE B 17 6.330 11.157 2.778 1.00 0.98 H new ATOM 0 HA ILE B 17 4.367 9.160 2.284 1.00 0.92 H new ATOM 0 HB ILE B 17 6.545 9.264 4.403 1.00 0.94 H new ATOM 0 HG12 ILE B 17 6.523 8.202 1.546 1.00 1.00 H new ATOM 0 HG13 ILE B 17 7.457 9.560 2.141 1.00 1.00 H new ATOM 0 HG21 ILE B 17 6.370 6.803 4.360 1.00 1.00 H new ATOM 0 HG22 ILE B 17 4.842 7.561 4.869 1.00 1.00 H new ATOM 0 HG23 ILE B 17 5.012 6.923 3.216 1.00 1.00 H new ATOM 0 HD11 ILE B 17 8.864 7.577 1.881 1.00 0.96 H new ATOM 0 HD12 ILE B 17 8.759 8.047 3.595 1.00 0.96 H new ATOM 0 HD13 ILE B 17 7.811 6.667 2.991 1.00 0.96 H new ATOM 2071 N ASP B 18 4.049 10.974 4.986 1.00 0.94 N ATOM 2072 CA ASP B 18 3.129 11.288 6.076 1.00 0.99 C ATOM 2073 C ASP B 18 1.750 11.608 5.509 1.00 0.96 C ATOM 2074 O ASP B 18 0.720 11.289 6.107 1.00 0.94 O ATOM 2075 CB ASP B 18 3.649 12.465 6.900 1.00 1.14 C ATOM 2076 CG ASP B 18 2.746 12.801 8.066 1.00 1.29 C ATOM 2077 OD1 ASP B 18 2.413 11.885 8.849 1.00 1.88 O ATOM 2078 OD2 ASP B 18 2.374 13.983 8.214 1.00 1.59 O ATOM 0 H ASP B 18 4.812 11.641 4.867 1.00 0.94 H new ATOM 0 HA ASP B 18 3.054 10.421 6.732 1.00 0.99 H new ATOM 0 HB2 ASP B 18 4.646 12.231 7.273 1.00 1.14 H new ATOM 0 HB3 ASP B 18 3.747 13.339 6.257 1.00 1.14 H new ATOM 2083 N SER B 19 1.746 12.232 4.336 1.00 0.98 N ATOM 2084 CA SER B 19 0.515 12.583 3.650 1.00 0.99 C ATOM 2085 C SER B 19 -0.167 11.329 3.103 1.00 0.91 C ATOM 2086 O SER B 19 -1.396 11.278 2.989 1.00 0.90 O ATOM 2087 CB SER B 19 0.797 13.567 2.514 1.00 1.10 C ATOM 2088 OG SER B 19 1.230 14.821 3.021 1.00 1.21 O ATOM 0 H SER B 19 2.593 12.506 3.839 1.00 0.98 H new ATOM 0 HA SER B 19 -0.153 13.060 4.367 1.00 0.99 H new ATOM 0 HB2 SER B 19 1.560 13.155 1.853 1.00 1.10 H new ATOM 0 HB3 SER B 19 -0.104 13.704 1.915 1.00 1.10 H new ATOM 0 HG SER B 19 2.182 14.771 3.247 1.00 1.21 H new ATOM 2094 N LEU B 20 0.644 10.329 2.749 1.00 0.87 N ATOM 2095 CA LEU B 20 0.137 9.063 2.217 1.00 0.84 C ATOM 2096 C LEU B 20 -0.827 8.415 3.199 1.00 0.80 C ATOM 2097 O LEU B 20 -1.956 8.077 2.843 1.00 0.79 O ATOM 2098 CB LEU B 20 1.299 8.098 1.921 1.00 0.86 C ATOM 2099 CG LEU B 20 1.777 8.023 0.459 1.00 0.91 C ATOM 2100 CD1 LEU B 20 1.364 9.261 -0.320 1.00 1.07 C ATOM 2101 CD2 LEU B 20 3.284 7.856 0.405 1.00 1.35 C ATOM 0 H LEU B 20 1.660 10.373 2.822 1.00 0.87 H new ATOM 0 HA LEU B 20 -0.394 9.277 1.289 1.00 0.84 H new ATOM 0 HB2 LEU B 20 2.147 8.385 2.543 1.00 0.86 H new ATOM 0 HB3 LEU B 20 0.999 7.098 2.233 1.00 0.86 H new ATOM 0 HG LEU B 20 1.304 7.156 -0.003 1.00 0.91 H new ATOM 0 HD11 LEU B 20 1.716 9.178 -1.348 1.00 1.07 H new ATOM 0 HD12 LEU B 20 0.278 9.349 -0.314 1.00 1.07 H new ATOM 0 HD13 LEU B 20 1.802 10.145 0.143 1.00 1.07 H new ATOM 0 HD21 LEU B 20 3.607 7.804 -0.635 1.00 1.35 H new ATOM 0 HD22 LEU B 20 3.762 8.706 0.892 1.00 1.35 H new ATOM 0 HD23 LEU B 20 3.567 6.937 0.919 1.00 1.35 H new ATOM 2113 N ILE B 21 -0.395 8.268 4.443 1.00 0.81 N ATOM 2114 CA ILE B 21 -1.233 7.652 5.463 1.00 0.82 C ATOM 2115 C ILE B 21 -2.396 8.557 5.860 1.00 0.81 C ATOM 2116 O ILE B 21 -3.466 8.072 6.208 1.00 0.81 O ATOM 2117 CB ILE B 21 -0.436 7.262 6.726 1.00 0.88 C ATOM 2118 CG1 ILE B 21 0.525 8.386 7.132 1.00 1.19 C ATOM 2119 CG2 ILE B 21 0.322 5.963 6.483 1.00 1.21 C ATOM 2120 CD1 ILE B 21 1.306 8.096 8.393 1.00 1.38 C ATOM 0 H ILE B 21 0.525 8.564 4.770 1.00 0.81 H new ATOM 0 HA ILE B 21 -1.626 6.741 5.012 1.00 0.82 H new ATOM 0 HB ILE B 21 -1.136 7.109 7.547 1.00 0.88 H new ATOM 0 HG12 ILE B 21 1.225 8.565 6.316 1.00 1.19 H new ATOM 0 HG13 ILE B 21 -0.044 9.305 7.272 1.00 1.19 H new ATOM 0 HG21 ILE B 21 0.882 5.695 7.379 1.00 1.21 H new ATOM 0 HG22 ILE B 21 -0.385 5.168 6.246 1.00 1.21 H new ATOM 0 HG23 ILE B 21 1.013 6.095 5.650 1.00 1.21 H new ATOM 0 HD11 ILE B 21 1.963 8.937 8.615 1.00 1.38 H new ATOM 0 HD12 ILE B 21 0.615 7.946 9.223 1.00 1.38 H new ATOM 0 HD13 ILE B 21 1.904 7.195 8.252 1.00 1.38 H new ATOM 2132 N GLU B 22 -2.184 9.869 5.793 1.00 0.83 N ATOM 2133 CA GLU B 22 -3.224 10.838 6.141 1.00 0.86 C ATOM 2134 C GLU B 22 -4.447 10.688 5.238 1.00 0.83 C ATOM 2135 O GLU B 22 -5.561 10.467 5.709 1.00 0.84 O ATOM 2136 CB GLU B 22 -2.697 12.268 6.011 1.00 0.94 C ATOM 2137 CG GLU B 22 -1.925 12.772 7.216 1.00 1.11 C ATOM 2138 CD GLU B 22 -1.740 14.275 7.172 1.00 1.55 C ATOM 2139 OE1 GLU B 22 -1.108 14.771 6.215 1.00 1.98 O ATOM 2140 OE2 GLU B 22 -2.253 14.972 8.070 1.00 1.95 O ATOM 0 H GLU B 22 -1.301 10.288 5.501 1.00 0.83 H new ATOM 0 HA GLU B 22 -3.512 10.641 7.174 1.00 0.86 H new ATOM 0 HB2 GLU B 22 -2.052 12.325 5.134 1.00 0.94 H new ATOM 0 HB3 GLU B 22 -3.539 12.936 5.831 1.00 0.94 H new ATOM 0 HG2 GLU B 22 -2.454 12.497 8.129 1.00 1.11 H new ATOM 0 HG3 GLU B 22 -0.950 12.286 7.253 1.00 1.11 H new ATOM 2147 N ALA B 23 -4.214 10.796 3.934 1.00 0.82 N ATOM 2148 CA ALA B 23 -5.281 10.707 2.945 1.00 0.83 C ATOM 2149 C ALA B 23 -6.015 9.371 3.018 1.00 0.79 C ATOM 2150 O ALA B 23 -7.244 9.333 3.064 1.00 0.80 O ATOM 2151 CB ALA B 23 -4.718 10.922 1.549 1.00 0.86 C ATOM 0 H ALA B 23 -3.287 10.947 3.536 1.00 0.82 H new ATOM 0 HA ALA B 23 -6.005 11.491 3.168 1.00 0.83 H new ATOM 0 HB1 ALA B 23 -5.523 10.854 0.817 1.00 0.86 H new ATOM 0 HB2 ALA B 23 -4.257 11.908 1.490 1.00 0.86 H new ATOM 0 HB3 ALA B 23 -3.969 10.159 1.337 1.00 0.86 H new ATOM 2157 N ILE B 24 -5.259 8.278 3.051 1.00 0.78 N ATOM 2158 CA ILE B 24 -5.849 6.941 3.098 1.00 0.78 C ATOM 2159 C ILE B 24 -6.652 6.727 4.384 1.00 0.74 C ATOM 2160 O ILE B 24 -7.728 6.124 4.362 1.00 0.74 O ATOM 2161 CB ILE B 24 -4.762 5.855 2.955 1.00 0.83 C ATOM 2162 CG1 ILE B 24 -4.044 6.018 1.609 1.00 0.99 C ATOM 2163 CG2 ILE B 24 -5.370 4.461 3.071 1.00 1.03 C ATOM 2164 CD1 ILE B 24 -2.812 5.153 1.462 1.00 0.89 C ATOM 0 H ILE B 24 -4.239 8.290 3.046 1.00 0.78 H new ATOM 0 HA ILE B 24 -6.536 6.858 2.256 1.00 0.78 H new ATOM 0 HB ILE B 24 -4.039 5.973 3.762 1.00 0.83 H new ATOM 0 HG12 ILE B 24 -4.741 5.780 0.806 1.00 0.99 H new ATOM 0 HG13 ILE B 24 -3.759 7.063 1.485 1.00 0.99 H new ATOM 0 HG21 ILE B 24 -4.585 3.712 2.967 1.00 1.03 H new ATOM 0 HG22 ILE B 24 -5.848 4.353 4.044 1.00 1.03 H new ATOM 0 HG23 ILE B 24 -6.112 4.321 2.285 1.00 1.03 H new ATOM 0 HD11 ILE B 24 -2.361 5.325 0.485 1.00 0.89 H new ATOM 0 HD12 ILE B 24 -2.094 5.406 2.242 1.00 0.89 H new ATOM 0 HD13 ILE B 24 -3.091 4.103 1.553 1.00 0.89 H new ATOM 2176 N LYS B 25 -6.140 7.242 5.496 1.00 0.74 N ATOM 2177 CA LYS B 25 -6.818 7.113 6.781 1.00 0.75 C ATOM 2178 C LYS B 25 -8.164 7.828 6.738 1.00 0.78 C ATOM 2179 O LYS B 25 -9.154 7.351 7.288 1.00 0.80 O ATOM 2180 CB LYS B 25 -5.953 7.689 7.904 1.00 0.79 C ATOM 2181 CG LYS B 25 -6.571 7.567 9.289 1.00 0.88 C ATOM 2182 CD LYS B 25 -6.502 6.146 9.824 1.00 1.17 C ATOM 2183 CE LYS B 25 -7.195 6.027 11.175 1.00 1.48 C ATOM 2184 NZ LYS B 25 -6.634 6.974 12.176 1.00 1.72 N ATOM 0 H LYS B 25 -5.258 7.753 5.534 1.00 0.74 H new ATOM 0 HA LYS B 25 -6.985 6.054 6.980 1.00 0.75 H new ATOM 0 HB2 LYS B 25 -4.989 7.181 7.902 1.00 0.79 H new ATOM 0 HB3 LYS B 25 -5.759 8.741 7.696 1.00 0.79 H new ATOM 0 HG2 LYS B 25 -6.055 8.238 9.976 1.00 0.88 H new ATOM 0 HG3 LYS B 25 -7.612 7.889 9.251 1.00 0.88 H new ATOM 0 HD2 LYS B 25 -6.969 5.465 9.113 1.00 1.17 H new ATOM 0 HD3 LYS B 25 -5.460 5.842 9.920 1.00 1.17 H new ATOM 0 HE2 LYS B 25 -8.261 6.218 11.053 1.00 1.48 H new ATOM 0 HE3 LYS B 25 -7.094 5.007 11.545 1.00 1.48 H new ATOM 0 HZ1 LYS B 25 -6.998 6.736 13.121 1.00 1.72 H new ATOM 0 HZ2 LYS B 25 -5.596 6.904 12.177 1.00 1.72 H new ATOM 0 HZ3 LYS B 25 -6.915 7.945 11.931 1.00 1.72 H new ATOM 2198 N LYS B 26 -8.188 8.968 6.067 1.00 0.80 N ATOM 2199 CA LYS B 26 -9.403 9.752 5.938 1.00 0.85 C ATOM 2200 C LYS B 26 -10.397 9.052 5.021 1.00 0.83 C ATOM 2201 O LYS B 26 -11.600 9.092 5.264 1.00 0.86 O ATOM 2202 CB LYS B 26 -9.087 11.151 5.403 1.00 0.91 C ATOM 2203 CG LYS B 26 -9.458 12.272 6.364 1.00 1.01 C ATOM 2204 CD LYS B 26 -10.965 12.401 6.512 1.00 1.13 C ATOM 2205 CE LYS B 26 -11.335 13.543 7.441 1.00 1.38 C ATOM 2206 NZ LYS B 26 -12.804 13.639 7.651 1.00 1.39 N ATOM 0 H LYS B 26 -7.375 9.372 5.602 1.00 0.80 H new ATOM 0 HA LYS B 26 -9.851 9.850 6.927 1.00 0.85 H new ATOM 0 HB2 LYS B 26 -8.022 11.213 5.180 1.00 0.91 H new ATOM 0 HB3 LYS B 26 -9.618 11.299 4.463 1.00 0.91 H new ATOM 0 HG2 LYS B 26 -9.010 12.080 7.339 1.00 1.01 H new ATOM 0 HG3 LYS B 26 -9.045 13.214 6.003 1.00 1.01 H new ATOM 0 HD2 LYS B 26 -11.415 12.566 5.533 1.00 1.13 H new ATOM 0 HD3 LYS B 26 -11.375 11.468 6.899 1.00 1.13 H new ATOM 0 HE2 LYS B 26 -10.840 13.403 8.402 1.00 1.38 H new ATOM 0 HE3 LYS B 26 -10.966 14.481 7.026 1.00 1.38 H new ATOM 0 HZ1 LYS B 26 -12.996 13.930 8.631 1.00 1.39 H new ATOM 0 HZ2 LYS B 26 -13.203 14.342 6.996 1.00 1.39 H new ATOM 0 HZ3 LYS B 26 -13.241 12.712 7.473 1.00 1.39 H new ATOM 2220 N ILE B 27 -9.885 8.397 3.982 1.00 0.80 N ATOM 2221 CA ILE B 27 -10.726 7.687 3.019 1.00 0.81 C ATOM 2222 C ILE B 27 -11.648 6.679 3.715 1.00 0.80 C ATOM 2223 O ILE B 27 -12.861 6.674 3.492 1.00 0.82 O ATOM 2224 CB ILE B 27 -9.864 6.949 1.958 1.00 0.81 C ATOM 2225 CG1 ILE B 27 -9.195 7.951 1.011 1.00 0.79 C ATOM 2226 CG2 ILE B 27 -10.708 5.954 1.169 1.00 0.90 C ATOM 2227 CD1 ILE B 27 -8.298 7.306 -0.025 1.00 1.04 C ATOM 0 H ILE B 27 -8.886 8.343 3.784 1.00 0.80 H new ATOM 0 HA ILE B 27 -11.339 8.438 2.521 1.00 0.81 H new ATOM 0 HB ILE B 27 -9.085 6.396 2.483 1.00 0.81 H new ATOM 0 HG12 ILE B 27 -9.967 8.527 0.501 1.00 0.79 H new ATOM 0 HG13 ILE B 27 -8.607 8.656 1.599 1.00 0.79 H new ATOM 0 HG21 ILE B 27 -10.082 5.450 0.432 1.00 0.90 H new ATOM 0 HG22 ILE B 27 -11.133 5.217 1.850 1.00 0.90 H new ATOM 0 HG23 ILE B 27 -11.513 6.483 0.660 1.00 0.90 H new ATOM 0 HD11 ILE B 27 -7.860 8.078 -0.658 1.00 1.04 H new ATOM 0 HD12 ILE B 27 -7.503 6.753 0.476 1.00 1.04 H new ATOM 0 HD13 ILE B 27 -8.884 6.622 -0.639 1.00 1.04 H new ATOM 2239 N ILE B 28 -11.068 5.847 4.574 1.00 0.78 N ATOM 2240 CA ILE B 28 -11.836 4.832 5.290 1.00 0.78 C ATOM 2241 C ILE B 28 -12.766 5.463 6.331 1.00 0.81 C ATOM 2242 O ILE B 28 -13.875 4.974 6.568 1.00 0.84 O ATOM 2243 CB ILE B 28 -10.919 3.776 5.957 1.00 0.77 C ATOM 2244 CG1 ILE B 28 -11.743 2.577 6.421 1.00 0.80 C ATOM 2245 CG2 ILE B 28 -10.140 4.367 7.124 1.00 0.82 C ATOM 2246 CD1 ILE B 28 -10.913 1.362 6.780 1.00 0.97 C ATOM 0 H ILE B 28 -10.071 5.855 4.792 1.00 0.78 H new ATOM 0 HA ILE B 28 -12.448 4.322 4.547 1.00 0.78 H new ATOM 0 HB ILE B 28 -10.197 3.444 5.211 1.00 0.77 H new ATOM 0 HG12 ILE B 28 -12.335 2.869 7.288 1.00 0.80 H new ATOM 0 HG13 ILE B 28 -12.445 2.305 5.633 1.00 0.80 H new ATOM 0 HG21 ILE B 28 -9.508 3.597 7.567 1.00 0.82 H new ATOM 0 HG22 ILE B 28 -9.517 5.187 6.767 1.00 0.82 H new ATOM 0 HG23 ILE B 28 -10.837 4.740 7.875 1.00 0.82 H new ATOM 0 HD11 ILE B 28 -11.571 0.554 7.100 1.00 0.97 H new ATOM 0 HD12 ILE B 28 -10.341 1.042 5.909 1.00 0.97 H new ATOM 0 HD13 ILE B 28 -10.229 1.615 7.590 1.00 0.97 H new ATOM 2258 N ALA B 29 -12.316 6.552 6.941 1.00 0.82 N ATOM 2259 CA ALA B 29 -13.104 7.246 7.949 1.00 0.87 C ATOM 2260 C ALA B 29 -14.392 7.788 7.342 1.00 0.90 C ATOM 2261 O ALA B 29 -15.474 7.647 7.921 1.00 0.93 O ATOM 2262 CB ALA B 29 -12.289 8.370 8.568 1.00 0.90 C ATOM 0 H ALA B 29 -11.406 6.974 6.754 1.00 0.82 H new ATOM 0 HA ALA B 29 -13.370 6.537 8.733 1.00 0.87 H new ATOM 0 HB1 ALA B 29 -12.888 8.882 9.321 1.00 0.90 H new ATOM 0 HB2 ALA B 29 -11.395 7.957 9.036 1.00 0.90 H new ATOM 0 HB3 ALA B 29 -11.998 9.078 7.792 1.00 0.90 H new ATOM 2268 N GLU B 30 -14.265 8.388 6.163 1.00 0.91 N ATOM 2269 CA GLU B 30 -15.404 8.952 5.451 1.00 0.95 C ATOM 2270 C GLU B 30 -16.368 7.858 5.023 1.00 0.95 C ATOM 2271 O GLU B 30 -17.574 8.068 5.003 1.00 0.96 O ATOM 2272 CB GLU B 30 -14.942 9.733 4.221 1.00 1.00 C ATOM 2273 CG GLU B 30 -14.012 10.890 4.540 1.00 1.02 C ATOM 2274 CD GLU B 30 -14.565 11.811 5.603 1.00 1.13 C ATOM 2275 OE1 GLU B 30 -15.319 12.741 5.255 1.00 1.38 O ATOM 2276 OE2 GLU B 30 -14.238 11.620 6.793 1.00 1.18 O ATOM 0 H GLU B 30 -13.375 8.496 5.677 1.00 0.91 H new ATOM 0 HA GLU B 30 -15.917 9.631 6.132 1.00 0.95 H new ATOM 0 HB2 GLU B 30 -14.436 9.050 3.538 1.00 1.00 H new ATOM 0 HB3 GLU B 30 -15.817 10.117 3.697 1.00 1.00 H new ATOM 0 HG2 GLU B 30 -13.051 10.497 4.871 1.00 1.02 H new ATOM 0 HG3 GLU B 30 -13.826 11.462 3.631 1.00 1.02 H new ATOM 2283 N PHE B 31 -15.827 6.691 4.678 1.00 0.96 N ATOM 2284 CA PHE B 31 -16.653 5.561 4.256 1.00 0.99 C ATOM 2285 C PHE B 31 -17.684 5.228 5.326 1.00 0.97 C ATOM 2286 O PHE B 31 -18.853 4.996 5.023 1.00 1.01 O ATOM 2287 CB PHE B 31 -15.793 4.332 3.958 1.00 1.01 C ATOM 2288 CG PHE B 31 -15.507 4.132 2.494 1.00 1.04 C ATOM 2289 CD1 PHE B 31 -16.542 4.069 1.571 1.00 1.50 C ATOM 2290 CD2 PHE B 31 -14.202 4.002 2.043 1.00 1.68 C ATOM 2291 CE1 PHE B 31 -16.279 3.884 0.226 1.00 1.59 C ATOM 2292 CE2 PHE B 31 -13.936 3.815 0.702 1.00 1.83 C ATOM 2293 CZ PHE B 31 -14.975 3.757 -0.207 1.00 1.37 C ATOM 0 H PHE B 31 -14.824 6.503 4.682 1.00 0.96 H new ATOM 0 HA PHE B 31 -17.171 5.848 3.341 1.00 0.99 H new ATOM 0 HB2 PHE B 31 -14.848 4.422 4.494 1.00 1.01 H new ATOM 0 HB3 PHE B 31 -16.296 3.446 4.345 1.00 1.01 H new ATOM 0 HD1 PHE B 31 -17.564 4.166 1.907 1.00 1.50 H new ATOM 0 HD2 PHE B 31 -13.386 4.048 2.749 1.00 1.68 H new ATOM 0 HE1 PHE B 31 -17.092 3.839 -0.484 1.00 1.59 H new ATOM 0 HE2 PHE B 31 -12.916 3.714 0.363 1.00 1.83 H new ATOM 0 HZ PHE B 31 -14.766 3.612 -1.257 1.00 1.37 H new ATOM 2303 N ASP B 32 -17.246 5.229 6.582 1.00 0.94 N ATOM 2304 CA ASP B 32 -18.139 4.940 7.701 1.00 0.93 C ATOM 2305 C ASP B 32 -19.173 6.058 7.843 1.00 0.93 C ATOM 2306 O ASP B 32 -20.355 5.807 8.100 1.00 0.96 O ATOM 2307 CB ASP B 32 -17.343 4.780 9.000 1.00 0.94 C ATOM 2308 CG ASP B 32 -18.228 4.826 10.229 1.00 1.20 C ATOM 2309 OD1 ASP B 32 -19.028 3.887 10.433 1.00 1.64 O ATOM 2310 OD2 ASP B 32 -18.119 5.804 10.999 1.00 1.54 O ATOM 0 H ASP B 32 -16.282 5.426 6.850 1.00 0.94 H new ATOM 0 HA ASP B 32 -18.657 4.002 7.502 1.00 0.93 H new ATOM 0 HB2 ASP B 32 -16.805 3.833 8.979 1.00 0.94 H new ATOM 0 HB3 ASP B 32 -16.595 5.570 9.064 1.00 0.94 H new ATOM 2315 N VAL B 33 -18.727 7.294 7.647 1.00 0.92 N ATOM 2316 CA VAL B 33 -19.613 8.452 7.734 1.00 0.93 C ATOM 2317 C VAL B 33 -20.687 8.368 6.657 1.00 0.94 C ATOM 2318 O VAL B 33 -21.879 8.529 6.933 1.00 0.95 O ATOM 2319 CB VAL B 33 -18.828 9.771 7.576 1.00 0.94 C ATOM 2320 CG1 VAL B 33 -19.754 10.975 7.683 1.00 1.00 C ATOM 2321 CG2 VAL B 33 -17.714 9.858 8.610 1.00 0.92 C ATOM 0 H VAL B 33 -17.757 7.521 7.427 1.00 0.92 H new ATOM 0 HA VAL B 33 -20.078 8.444 8.720 1.00 0.93 H new ATOM 0 HB VAL B 33 -18.379 9.779 6.583 1.00 0.94 H new ATOM 0 HG11 VAL B 33 -19.175 11.891 7.568 1.00 1.00 H new ATOM 0 HG12 VAL B 33 -20.510 10.923 6.900 1.00 1.00 H new ATOM 0 HG13 VAL B 33 -20.241 10.974 8.658 1.00 1.00 H new ATOM 0 HG21 VAL B 33 -17.172 10.795 8.483 1.00 0.92 H new ATOM 0 HG22 VAL B 33 -18.143 9.820 9.611 1.00 0.92 H new ATOM 0 HG23 VAL B 33 -17.028 9.021 8.477 1.00 0.92 H new ATOM 2331 N VAL B 34 -20.248 8.084 5.436 1.00 0.96 N ATOM 2332 CA VAL B 34 -21.143 7.954 4.295 1.00 0.99 C ATOM 2333 C VAL B 34 -22.160 6.847 4.533 1.00 1.00 C ATOM 2334 O VAL B 34 -23.302 6.944 4.086 1.00 1.02 O ATOM 2335 CB VAL B 34 -20.359 7.671 2.993 1.00 1.02 C ATOM 2336 CG1 VAL B 34 -21.297 7.316 1.848 1.00 1.21 C ATOM 2337 CG2 VAL B 34 -19.512 8.871 2.625 1.00 1.13 C ATOM 0 H VAL B 34 -19.264 7.938 5.211 1.00 0.96 H new ATOM 0 HA VAL B 34 -21.667 8.903 4.182 1.00 0.99 H new ATOM 0 HB VAL B 34 -19.708 6.815 3.170 1.00 1.02 H new ATOM 0 HG11 VAL B 34 -20.715 7.123 0.947 1.00 1.21 H new ATOM 0 HG12 VAL B 34 -21.868 6.425 2.109 1.00 1.21 H new ATOM 0 HG13 VAL B 34 -21.981 8.146 1.667 1.00 1.21 H new ATOM 0 HG21 VAL B 34 -18.964 8.661 1.707 1.00 1.13 H new ATOM 0 HG22 VAL B 34 -20.155 9.738 2.474 1.00 1.13 H new ATOM 0 HG23 VAL B 34 -18.806 9.079 3.429 1.00 1.13 H new ATOM 2347 N LYS B 35 -21.750 5.807 5.257 1.00 1.01 N ATOM 2348 CA LYS B 35 -22.640 4.694 5.566 1.00 1.05 C ATOM 2349 C LYS B 35 -23.860 5.190 6.334 1.00 1.03 C ATOM 2350 O LYS B 35 -24.998 4.823 6.033 1.00 1.05 O ATOM 2351 CB LYS B 35 -21.915 3.630 6.391 1.00 1.08 C ATOM 2352 CG LYS B 35 -21.045 2.693 5.566 1.00 1.13 C ATOM 2353 CD LYS B 35 -20.370 1.642 6.433 1.00 1.32 C ATOM 2354 CE LYS B 35 -21.385 0.791 7.182 1.00 1.51 C ATOM 2355 NZ LYS B 35 -22.362 0.139 6.262 1.00 1.86 N ATOM 0 H LYS B 35 -20.809 5.714 5.639 1.00 1.01 H new ATOM 0 HA LYS B 35 -22.962 4.249 4.624 1.00 1.05 H new ATOM 0 HB2 LYS B 35 -21.293 4.125 7.136 1.00 1.08 H new ATOM 0 HB3 LYS B 35 -22.654 3.040 6.933 1.00 1.08 H new ATOM 0 HG2 LYS B 35 -21.656 2.202 4.808 1.00 1.13 H new ATOM 0 HG3 LYS B 35 -20.286 3.271 5.038 1.00 1.13 H new ATOM 0 HD2 LYS B 35 -19.748 1.001 5.809 1.00 1.32 H new ATOM 0 HD3 LYS B 35 -19.708 2.131 7.147 1.00 1.32 H new ATOM 0 HE2 LYS B 35 -20.862 0.026 7.756 1.00 1.51 H new ATOM 0 HE3 LYS B 35 -21.922 1.414 7.897 1.00 1.51 H new ATOM 0 HZ1 LYS B 35 -22.924 -0.559 6.790 1.00 1.86 H new ATOM 0 HZ2 LYS B 35 -22.994 0.860 5.860 1.00 1.86 H new ATOM 0 HZ3 LYS B 35 -21.850 -0.339 5.494 1.00 1.86 H new ATOM 2369 N GLU B 36 -23.618 6.033 7.327 1.00 1.00 N ATOM 2370 CA GLU B 36 -24.701 6.591 8.126 1.00 1.00 C ATOM 2371 C GLU B 36 -25.483 7.634 7.321 1.00 0.96 C ATOM 2372 O GLU B 36 -26.701 7.754 7.451 1.00 0.97 O ATOM 2373 CB GLU B 36 -24.152 7.222 9.409 1.00 1.01 C ATOM 2374 CG GLU B 36 -25.213 7.425 10.480 1.00 1.15 C ATOM 2375 CD GLU B 36 -25.817 6.118 10.949 1.00 1.29 C ATOM 2376 OE1 GLU B 36 -25.198 5.450 11.803 1.00 1.57 O ATOM 2377 OE2 GLU B 36 -26.905 5.750 10.465 1.00 1.40 O ATOM 0 H GLU B 36 -22.686 6.345 7.599 1.00 1.00 H new ATOM 0 HA GLU B 36 -25.377 5.780 8.396 1.00 1.00 H new ATOM 0 HB2 GLU B 36 -23.360 6.588 9.807 1.00 1.01 H new ATOM 0 HB3 GLU B 36 -23.700 8.184 9.168 1.00 1.01 H new ATOM 0 HG2 GLU B 36 -24.772 7.944 11.331 1.00 1.15 H new ATOM 0 HG3 GLU B 36 -26.002 8.067 10.089 1.00 1.15 H new ATOM 2384 N SER B 37 -24.786 8.369 6.472 1.00 0.00 N ATOM 2385 CA SER B 37 -25.368 9.412 5.632 1.00 0.00 C ATOM 2386 C SER B 37 -26.464 8.852 4.757 1.00 0.00 C ATOM 2387 O SER B 37 -27.572 9.393 4.693 1.00 0.00 O ATOM 2388 CB SER B 37 -24.274 10.118 4.793 1.00 0.00 C ATOM 2389 OG SER B 37 -23.354 10.867 5.595 1.00 0.00 O ATOM 0 H SER B 37 -23.780 8.259 6.342 1.00 0.00 H new ATOM 0 HA SER B 37 -25.819 10.161 6.282 1.00 0.00 H new ATOM 0 HB2 SER B 37 -23.724 9.371 4.220 1.00 0.00 H new ATOM 0 HB3 SER B 37 -24.749 10.786 4.074 1.00 0.00 H new ATOM 0 HG SER B 37 -22.799 10.251 6.118 1.00 0.00 H new ATOM 2395 N VAL B 38 -26.144 7.798 4.005 1.00 0.96 N ATOM 2396 CA VAL B 38 -27.094 7.181 3.086 1.00 1.00 C ATOM 2397 C VAL B 38 -28.229 6.512 3.846 1.00 1.02 C ATOM 2398 O VAL B 38 -29.339 6.399 3.335 1.00 1.04 O ATOM 2399 CB VAL B 38 -26.419 6.154 2.146 1.00 1.05 C ATOM 2400 CG1 VAL B 38 -25.455 6.855 1.202 1.00 1.05 C ATOM 2401 CG2 VAL B 38 -25.700 5.064 2.936 1.00 1.07 C ATOM 0 H VAL B 38 -25.226 7.353 4.017 1.00 0.96 H new ATOM 0 HA VAL B 38 -27.497 7.985 2.470 1.00 1.00 H new ATOM 0 HB VAL B 38 -27.201 5.674 1.557 1.00 1.05 H new ATOM 0 HG11 VAL B 38 -24.988 6.120 0.547 1.00 1.05 H new ATOM 0 HG12 VAL B 38 -25.999 7.583 0.600 1.00 1.05 H new ATOM 0 HG13 VAL B 38 -24.686 7.366 1.781 1.00 1.05 H new ATOM 0 HG21 VAL B 38 -25.237 4.359 2.245 1.00 1.07 H new ATOM 0 HG22 VAL B 38 -24.931 5.516 3.563 1.00 1.07 H new ATOM 0 HG23 VAL B 38 -26.418 4.537 3.565 1.00 1.07 H new ATOM 2411 N ASN B 39 -27.941 6.074 5.064 1.00 1.03 N ATOM 2412 CA ASN B 39 -28.943 5.434 5.903 1.00 1.07 C ATOM 2413 C ASN B 39 -30.052 6.430 6.226 1.00 1.05 C ATOM 2414 O ASN B 39 -31.245 6.132 6.094 1.00 1.08 O ATOM 2415 CB ASN B 39 -28.295 4.916 7.193 1.00 1.11 C ATOM 2416 CG ASN B 39 -29.293 4.292 8.144 1.00 1.20 C ATOM 2417 OD1 ASN B 39 -30.327 3.766 7.728 1.00 1.25 O ATOM 2418 ND2 ASN B 39 -28.996 4.349 9.431 1.00 1.25 N ATOM 0 H ASN B 39 -27.019 6.151 5.493 1.00 1.03 H new ATOM 0 HA ASN B 39 -29.374 4.587 5.369 1.00 1.07 H new ATOM 0 HB2 ASN B 39 -27.532 4.180 6.940 1.00 1.11 H new ATOM 0 HB3 ASN B 39 -27.788 5.740 7.695 1.00 1.11 H new ATOM 0 HD21 ASN B 39 -29.633 3.949 10.120 1.00 1.25 H new ATOM 0 HD22 ASN B 39 -28.130 4.793 9.735 1.00 1.25 H new ATOM 2425 N GLU B 40 -29.640 7.629 6.617 1.00 1.02 N ATOM 2426 CA GLU B 40 -30.566 8.697 6.954 1.00 1.02 C ATOM 2427 C GLU B 40 -31.300 9.205 5.716 1.00 0.98 C ATOM 2428 O GLU B 40 -32.514 9.432 5.747 1.00 1.01 O ATOM 2429 CB GLU B 40 -29.805 9.854 7.604 1.00 1.04 C ATOM 2430 CG GLU B 40 -29.513 9.645 9.079 1.00 1.24 C ATOM 2431 CD GLU B 40 -30.701 9.985 9.948 1.00 1.46 C ATOM 2432 OE1 GLU B 40 -31.827 9.584 9.603 1.00 2.04 O ATOM 2433 OE2 GLU B 40 -30.520 10.672 10.974 1.00 1.92 O ATOM 0 H GLU B 40 -28.657 7.886 6.709 1.00 1.02 H new ATOM 0 HA GLU B 40 -31.303 8.298 7.651 1.00 1.02 H new ATOM 0 HB2 GLU B 40 -28.864 10.000 7.074 1.00 1.04 H new ATOM 0 HB3 GLU B 40 -30.384 10.770 7.484 1.00 1.04 H new ATOM 0 HG2 GLU B 40 -29.226 8.607 9.248 1.00 1.24 H new ATOM 0 HG3 GLU B 40 -28.663 10.262 9.371 1.00 1.24 H new ATOM 2440 N LEU B 41 -30.553 9.377 4.631 1.00 0.95 N ATOM 2441 CA LEU B 41 -31.100 9.879 3.372 1.00 0.94 C ATOM 2442 C LEU B 41 -32.178 8.961 2.804 1.00 0.95 C ATOM 2443 O LEU B 41 -33.226 9.430 2.372 1.00 0.97 O ATOM 2444 CB LEU B 41 -29.972 10.055 2.352 1.00 0.92 C ATOM 2445 CG LEU B 41 -30.379 10.709 1.026 1.00 0.97 C ATOM 2446 CD1 LEU B 41 -31.045 12.057 1.264 1.00 1.08 C ATOM 2447 CD2 LEU B 41 -29.165 10.867 0.124 1.00 1.01 C ATOM 0 H LEU B 41 -29.554 9.174 4.597 1.00 0.95 H new ATOM 0 HA LEU B 41 -31.569 10.841 3.577 1.00 0.94 H new ATOM 0 HB2 LEU B 41 -29.184 10.656 2.807 1.00 0.92 H new ATOM 0 HB3 LEU B 41 -29.543 9.076 2.138 1.00 0.92 H new ATOM 0 HG LEU B 41 -31.102 10.059 0.532 1.00 0.97 H new ATOM 0 HD11 LEU B 41 -31.324 12.499 0.307 1.00 1.08 H new ATOM 0 HD12 LEU B 41 -31.938 11.919 1.874 1.00 1.08 H new ATOM 0 HD13 LEU B 41 -30.351 12.719 1.781 1.00 1.08 H new ATOM 0 HD21 LEU B 41 -29.467 11.332 -0.814 1.00 1.01 H new ATOM 0 HD22 LEU B 41 -28.424 11.495 0.618 1.00 1.01 H new ATOM 0 HD23 LEU B 41 -28.733 9.887 -0.080 1.00 1.01 H new ATOM 2459 N SER B 42 -31.924 7.659 2.815 1.00 0.97 N ATOM 2460 CA SER B 42 -32.876 6.687 2.285 1.00 1.01 C ATOM 2461 C SER B 42 -34.216 6.765 3.010 1.00 1.02 C ATOM 2462 O SER B 42 -35.272 6.733 2.383 1.00 1.03 O ATOM 2463 CB SER B 42 -32.308 5.270 2.399 1.00 1.07 C ATOM 2464 OG SER B 42 -31.053 5.171 1.746 1.00 1.56 O ATOM 0 H SER B 42 -31.066 7.250 3.185 1.00 0.97 H new ATOM 0 HA SER B 42 -33.042 6.927 1.235 1.00 1.01 H new ATOM 0 HB2 SER B 42 -32.197 5.002 3.450 1.00 1.07 H new ATOM 0 HB3 SER B 42 -33.007 4.558 1.961 1.00 1.07 H new ATOM 0 HG SER B 42 -30.345 5.483 2.348 1.00 1.56 H new ATOM 2470 N GLU B 43 -34.163 6.891 4.329 1.00 1.04 N ATOM 2471 CA GLU B 43 -35.372 6.961 5.146 1.00 1.07 C ATOM 2472 C GLU B 43 -36.229 8.181 4.789 1.00 1.05 C ATOM 2473 O GLU B 43 -37.455 8.141 4.884 1.00 1.10 O ATOM 2474 CB GLU B 43 -34.988 7.015 6.622 1.00 1.12 C ATOM 2475 CG GLU B 43 -36.161 6.850 7.575 1.00 1.24 C ATOM 2476 CD GLU B 43 -35.826 7.298 8.978 1.00 1.41 C ATOM 2477 OE1 GLU B 43 -35.285 8.412 9.136 1.00 1.56 O ATOM 2478 OE2 GLU B 43 -36.084 6.540 9.929 1.00 1.92 O ATOM 0 H GLU B 43 -33.294 6.947 4.860 1.00 1.04 H new ATOM 0 HA GLU B 43 -35.965 6.068 4.947 1.00 1.07 H new ATOM 0 HB2 GLU B 43 -34.256 6.233 6.825 1.00 1.12 H new ATOM 0 HB3 GLU B 43 -34.500 7.968 6.825 1.00 1.12 H new ATOM 0 HG2 GLU B 43 -37.010 7.425 7.205 1.00 1.24 H new ATOM 0 HG3 GLU B 43 -36.467 5.804 7.593 1.00 1.24 H new ATOM 2485 N LYS B 44 -35.580 9.263 4.382 1.00 1.00 N ATOM 2486 CA LYS B 44 -36.296 10.490 4.031 1.00 1.00 C ATOM 2487 C LYS B 44 -36.842 10.429 2.601 1.00 0.98 C ATOM 2488 O LYS B 44 -37.983 10.815 2.345 1.00 1.03 O ATOM 2489 CB LYS B 44 -35.375 11.710 4.181 1.00 1.01 C ATOM 2490 CG LYS B 44 -34.545 11.716 5.458 1.00 1.06 C ATOM 2491 CD LYS B 44 -35.419 11.735 6.701 1.00 1.17 C ATOM 2492 CE LYS B 44 -34.582 11.718 7.971 1.00 1.32 C ATOM 2493 NZ LYS B 44 -33.892 10.413 8.168 1.00 1.35 N ATOM 0 H LYS B 44 -34.566 9.321 4.286 1.00 1.00 H new ATOM 0 HA LYS B 44 -37.138 10.587 4.716 1.00 1.00 H new ATOM 0 HB2 LYS B 44 -34.702 11.750 3.324 1.00 1.01 H new ATOM 0 HB3 LYS B 44 -35.982 12.615 4.152 1.00 1.01 H new ATOM 0 HG2 LYS B 44 -33.904 10.835 5.478 1.00 1.06 H new ATOM 0 HG3 LYS B 44 -33.890 12.587 5.461 1.00 1.06 H new ATOM 0 HD2 LYS B 44 -36.049 12.625 6.691 1.00 1.17 H new ATOM 0 HD3 LYS B 44 -36.086 10.873 6.692 1.00 1.17 H new ATOM 0 HE2 LYS B 44 -33.841 12.517 7.928 1.00 1.32 H new ATOM 0 HE3 LYS B 44 -35.222 11.923 8.829 1.00 1.32 H new ATOM 0 HZ1 LYS B 44 -33.103 10.535 8.835 1.00 1.35 H new ATOM 0 HZ2 LYS B 44 -34.565 9.719 8.551 1.00 1.35 H new ATOM 0 HZ3 LYS B 44 -33.525 10.073 7.256 1.00 1.35 H new ATOM 2507 N ALA B 45 -36.029 9.917 1.686 1.00 0.98 N ATOM 2508 CA ALA B 45 -36.390 9.806 0.275 1.00 0.99 C ATOM 2509 C ALA B 45 -37.494 8.774 0.033 1.00 1.01 C ATOM 2510 O ALA B 45 -38.152 8.795 -1.004 1.00 1.03 O ATOM 2511 CB ALA B 45 -35.148 9.474 -0.541 1.00 1.01 C ATOM 0 H ALA B 45 -35.096 9.565 1.901 1.00 0.98 H new ATOM 0 HA ALA B 45 -36.792 10.767 -0.045 1.00 0.99 H new ATOM 0 HB1 ALA B 45 -35.416 9.391 -1.594 1.00 1.01 H new ATOM 0 HB2 ALA B 45 -34.408 10.265 -0.416 1.00 1.01 H new ATOM 0 HB3 ALA B 45 -34.729 8.528 -0.198 1.00 1.01 H new ATOM 2517 N LYS B 46 -37.717 7.900 1.002 1.00 1.04 N ATOM 2518 CA LYS B 46 -38.746 6.860 0.884 1.00 1.10 C ATOM 2519 C LYS B 46 -40.147 7.451 0.827 1.00 1.12 C ATOM 2520 O LYS B 46 -41.102 6.767 0.476 1.00 1.18 O ATOM 2521 CB LYS B 46 -38.668 5.896 2.063 1.00 1.18 C ATOM 2522 CG LYS B 46 -38.110 4.516 1.734 1.00 1.46 C ATOM 2523 CD LYS B 46 -36.895 4.581 0.825 1.00 1.98 C ATOM 2524 CE LYS B 46 -36.344 3.195 0.540 1.00 2.66 C ATOM 2525 NZ LYS B 46 -37.380 2.294 -0.028 1.00 3.40 N ATOM 0 H LYS B 46 -37.203 7.884 1.883 1.00 1.04 H new ATOM 0 HA LYS B 46 -38.553 6.329 -0.048 1.00 1.10 H new ATOM 0 HB2 LYS B 46 -38.049 6.345 2.839 1.00 1.18 H new ATOM 0 HB3 LYS B 46 -39.667 5.776 2.481 1.00 1.18 H new ATOM 0 HG2 LYS B 46 -37.841 4.007 2.659 1.00 1.46 H new ATOM 0 HG3 LYS B 46 -38.886 3.919 1.256 1.00 1.46 H new ATOM 0 HD2 LYS B 46 -37.165 5.067 -0.112 1.00 1.98 H new ATOM 0 HD3 LYS B 46 -36.122 5.193 1.290 1.00 1.98 H new ATOM 0 HE2 LYS B 46 -35.509 3.272 -0.156 1.00 2.66 H new ATOM 0 HE3 LYS B 46 -35.953 2.763 1.461 1.00 2.66 H new ATOM 0 HZ1 LYS B 46 -36.923 1.456 -0.441 1.00 3.40 H new ATOM 0 HZ2 LYS B 46 -38.032 1.996 0.725 1.00 3.40 H new ATOM 0 HZ3 LYS B 46 -37.911 2.798 -0.766 1.00 3.40 H new ATOM 2539 N THR B 47 -40.277 8.717 1.194 1.00 1.10 N ATOM 2540 CA THR B 47 -41.570 9.377 1.179 1.00 1.16 C ATOM 2541 C THR B 47 -41.979 9.782 -0.241 1.00 1.17 C ATOM 2542 O THR B 47 -43.090 10.285 -0.457 1.00 1.27 O ATOM 2543 CB THR B 47 -41.536 10.621 2.074 1.00 1.24 C ATOM 2544 OG1 THR B 47 -40.584 10.425 3.135 1.00 1.54 O ATOM 2545 CG2 THR B 47 -42.906 10.903 2.663 1.00 1.41 C ATOM 0 H THR B 47 -39.504 9.305 1.505 1.00 1.10 H new ATOM 0 HA THR B 47 -42.306 8.669 1.558 1.00 1.16 H new ATOM 0 HB THR B 47 -41.241 11.476 1.466 1.00 1.24 H new ATOM 0 HG1 THR B 47 -39.694 10.698 2.830 1.00 1.54 H new ATOM 0 HG21 THR B 47 -42.855 11.790 3.294 1.00 1.41 H new ATOM 0 HG22 THR B 47 -43.621 11.071 1.857 1.00 1.41 H new ATOM 0 HG23 THR B 47 -43.227 10.050 3.261 1.00 1.41 H new ATOM 2553 N ASP B 48 -41.101 9.550 -1.206 1.00 1.14 N ATOM 2554 CA ASP B 48 -41.383 9.912 -2.585 1.00 1.18 C ATOM 2555 C ASP B 48 -40.948 8.808 -3.548 1.00 1.14 C ATOM 2556 O ASP B 48 -39.825 8.310 -3.473 1.00 1.10 O ATOM 2557 CB ASP B 48 -40.684 11.230 -2.923 1.00 1.23 C ATOM 2558 CG ASP B 48 -40.833 11.620 -4.381 1.00 1.28 C ATOM 2559 OD1 ASP B 48 -41.949 11.979 -4.801 1.00 1.39 O ATOM 2560 OD2 ASP B 48 -39.830 11.580 -5.115 1.00 1.43 O ATOM 0 H ASP B 48 -40.191 9.114 -1.059 1.00 1.14 H new ATOM 0 HA ASP B 48 -42.460 10.038 -2.697 1.00 1.18 H new ATOM 0 HB2 ASP B 48 -41.092 12.023 -2.296 1.00 1.23 H new ATOM 0 HB3 ASP B 48 -39.625 11.146 -2.681 1.00 1.23 H new ATOM 2565 N PRO B 49 -41.851 8.410 -4.460 1.00 1.20 N ATOM 2566 CA PRO B 49 -41.584 7.353 -5.447 1.00 1.22 C ATOM 2567 C PRO B 49 -40.496 7.738 -6.453 1.00 1.24 C ATOM 2568 O PRO B 49 -39.730 6.885 -6.912 1.00 1.24 O ATOM 2569 CB PRO B 49 -42.928 7.174 -6.159 1.00 1.33 C ATOM 2570 CG PRO B 49 -43.656 8.454 -5.934 1.00 1.36 C ATOM 2571 CD PRO B 49 -43.211 8.961 -4.594 1.00 1.29 C ATOM 0 HA PRO B 49 -41.214 6.447 -4.968 1.00 1.22 H new ATOM 0 HB2 PRO B 49 -42.789 6.981 -7.223 1.00 1.33 H new ATOM 0 HB3 PRO B 49 -43.481 6.328 -5.751 1.00 1.33 H new ATOM 0 HG2 PRO B 49 -43.426 9.175 -6.718 1.00 1.36 H new ATOM 0 HG3 PRO B 49 -44.734 8.296 -5.952 1.00 1.36 H new ATOM 0 HD2 PRO B 49 -43.210 10.050 -4.556 1.00 1.29 H new ATOM 0 HD3 PRO B 49 -43.866 8.615 -3.795 1.00 1.29 H new ATOM 2579 N GLN B 50 -40.423 9.022 -6.785 1.00 1.28 N ATOM 2580 CA GLN B 50 -39.431 9.508 -7.738 1.00 1.33 C ATOM 2581 C GLN B 50 -38.051 9.437 -7.109 1.00 1.22 C ATOM 2582 O GLN B 50 -37.090 8.997 -7.737 1.00 1.22 O ATOM 2583 CB GLN B 50 -39.752 10.942 -8.163 1.00 1.45 C ATOM 2584 CG GLN B 50 -41.236 11.181 -8.390 1.00 1.58 C ATOM 2585 CD GLN B 50 -41.591 12.651 -8.425 1.00 1.65 C ATOM 2586 OE1 GLN B 50 -41.698 13.257 -9.490 1.00 1.81 O ATOM 2587 NE2 GLN B 50 -41.790 13.236 -7.256 1.00 1.66 N ATOM 0 H GLN B 50 -41.037 9.744 -6.409 1.00 1.28 H new ATOM 0 HA GLN B 50 -39.453 8.879 -8.628 1.00 1.33 H new ATOM 0 HB2 GLN B 50 -39.393 11.630 -7.398 1.00 1.45 H new ATOM 0 HB3 GLN B 50 -39.209 11.173 -9.080 1.00 1.45 H new ATOM 0 HG2 GLN B 50 -41.535 10.717 -9.330 1.00 1.58 H new ATOM 0 HG3 GLN B 50 -41.804 10.693 -7.598 1.00 1.58 H new ATOM 0 HE21 GLN B 50 -41.692 12.700 -6.394 1.00 1.66 H new ATOM 0 HE22 GLN B 50 -42.042 14.224 -7.216 1.00 1.66 H new ATOM 2596 N ALA B 51 -37.967 9.871 -5.858 1.00 1.15 N ATOM 2597 CA ALA B 51 -36.722 9.834 -5.111 1.00 1.08 C ATOM 2598 C ALA B 51 -36.272 8.393 -4.929 1.00 1.00 C ATOM 2599 O ALA B 51 -35.078 8.098 -4.937 1.00 0.98 O ATOM 2600 CB ALA B 51 -36.887 10.514 -3.762 1.00 1.09 C ATOM 0 H ALA B 51 -38.756 10.256 -5.338 1.00 1.15 H new ATOM 0 HA ALA B 51 -35.960 10.374 -5.672 1.00 1.08 H new ATOM 0 HB1 ALA B 51 -35.944 10.476 -3.217 1.00 1.09 H new ATOM 0 HB2 ALA B 51 -37.178 11.554 -3.912 1.00 1.09 H new ATOM 0 HB3 ALA B 51 -37.658 10.001 -3.188 1.00 1.09 H new ATOM 2606 N ALA B 52 -37.243 7.501 -4.779 1.00 0.99 N ATOM 2607 CA ALA B 52 -36.969 6.083 -4.620 1.00 0.98 C ATOM 2608 C ALA B 52 -36.338 5.529 -5.892 1.00 1.02 C ATOM 2609 O ALA B 52 -35.423 4.711 -5.836 1.00 1.03 O ATOM 2610 CB ALA B 52 -38.246 5.326 -4.284 1.00 1.03 C ATOM 0 H ALA B 52 -38.235 7.740 -4.764 1.00 0.99 H new ATOM 0 HA ALA B 52 -36.269 5.952 -3.795 1.00 0.98 H new ATOM 0 HB1 ALA B 52 -38.021 4.266 -4.169 1.00 1.03 H new ATOM 0 HB2 ALA B 52 -38.663 5.712 -3.354 1.00 1.03 H new ATOM 0 HB3 ALA B 52 -38.970 5.458 -5.089 1.00 1.03 H new ATOM 2616 N GLU B 53 -36.827 5.985 -7.044 1.00 1.09 N ATOM 2617 CA GLU B 53 -36.284 5.548 -8.326 1.00 1.18 C ATOM 2618 C GLU B 53 -34.871 6.100 -8.503 1.00 1.17 C ATOM 2619 O GLU B 53 -34.004 5.442 -9.074 1.00 1.23 O ATOM 2620 CB GLU B 53 -37.184 5.994 -9.483 1.00 1.28 C ATOM 2621 CG GLU B 53 -36.762 5.447 -10.841 1.00 1.45 C ATOM 2622 CD GLU B 53 -36.723 3.929 -10.889 1.00 1.51 C ATOM 2623 OE1 GLU B 53 -37.782 3.296 -10.700 1.00 1.66 O ATOM 2624 OE2 GLU B 53 -35.633 3.361 -11.119 1.00 1.58 O ATOM 0 H GLU B 53 -37.594 6.653 -7.115 1.00 1.09 H new ATOM 0 HA GLU B 53 -36.245 4.459 -8.335 1.00 1.18 H new ATOM 0 HB2 GLU B 53 -38.207 5.678 -9.277 1.00 1.28 H new ATOM 0 HB3 GLU B 53 -37.189 7.083 -9.527 1.00 1.28 H new ATOM 0 HG2 GLU B 53 -37.452 5.811 -11.602 1.00 1.45 H new ATOM 0 HG3 GLU B 53 -35.776 5.837 -11.092 1.00 1.45 H new ATOM 2631 N LYS B 54 -34.647 7.310 -8.000 1.00 1.13 N ATOM 2632 CA LYS B 54 -33.332 7.929 -8.084 1.00 1.14 C ATOM 2633 C LYS B 54 -32.332 7.129 -7.256 1.00 1.05 C ATOM 2634 O LYS B 54 -31.212 6.882 -7.692 1.00 1.09 O ATOM 2635 CB LYS B 54 -33.381 9.379 -7.602 1.00 1.16 C ATOM 2636 CG LYS B 54 -33.945 10.345 -8.635 1.00 1.32 C ATOM 2637 CD LYS B 54 -33.694 11.797 -8.253 1.00 1.48 C ATOM 2638 CE LYS B 54 -32.259 12.211 -8.544 1.00 1.68 C ATOM 2639 NZ LYS B 54 -32.044 13.661 -8.314 1.00 2.09 N ATOM 0 H LYS B 54 -35.355 7.877 -7.533 1.00 1.13 H new ATOM 0 HA LYS B 54 -33.014 7.931 -9.127 1.00 1.14 H new ATOM 0 HB2 LYS B 54 -33.987 9.432 -6.698 1.00 1.16 H new ATOM 0 HB3 LYS B 54 -32.374 9.697 -7.330 1.00 1.16 H new ATOM 0 HG2 LYS B 54 -33.493 10.142 -9.606 1.00 1.32 H new ATOM 0 HG3 LYS B 54 -35.017 10.178 -8.741 1.00 1.32 H new ATOM 0 HD2 LYS B 54 -34.379 12.442 -8.803 1.00 1.48 H new ATOM 0 HD3 LYS B 54 -33.906 11.937 -7.193 1.00 1.48 H new ATOM 0 HE2 LYS B 54 -31.581 11.639 -7.911 1.00 1.68 H new ATOM 0 HE3 LYS B 54 -32.013 11.967 -9.578 1.00 1.68 H new ATOM 0 HZ1 LYS B 54 -31.054 13.903 -8.523 1.00 2.09 H new ATOM 0 HZ2 LYS B 54 -32.673 14.208 -8.936 1.00 2.09 H new ATOM 0 HZ3 LYS B 54 -32.254 13.890 -7.321 1.00 2.09 H new ATOM 2653 N LEU B 55 -32.750 6.725 -6.059 1.00 0.98 N ATOM 2654 CA LEU B 55 -31.907 5.927 -5.177 1.00 0.95 C ATOM 2655 C LEU B 55 -31.607 4.590 -5.847 1.00 0.99 C ATOM 2656 O LEU B 55 -30.496 4.073 -5.766 1.00 0.99 O ATOM 2657 CB LEU B 55 -32.618 5.697 -3.835 1.00 0.94 C ATOM 2658 CG LEU B 55 -31.943 6.308 -2.600 1.00 1.02 C ATOM 2659 CD1 LEU B 55 -30.616 5.623 -2.314 1.00 1.13 C ATOM 2660 CD2 LEU B 55 -31.741 7.807 -2.778 1.00 1.09 C ATOM 0 H LEU B 55 -33.672 6.939 -5.678 1.00 0.98 H new ATOM 0 HA LEU B 55 -30.973 6.457 -4.988 1.00 0.95 H new ATOM 0 HB2 LEU B 55 -33.628 6.100 -3.908 1.00 0.94 H new ATOM 0 HB3 LEU B 55 -32.714 4.623 -3.677 1.00 0.94 H new ATOM 0 HG LEU B 55 -32.601 6.150 -1.746 1.00 1.02 H new ATOM 0 HD11 LEU B 55 -30.156 6.073 -1.434 1.00 1.13 H new ATOM 0 HD12 LEU B 55 -30.786 4.562 -2.132 1.00 1.13 H new ATOM 0 HD13 LEU B 55 -29.953 5.742 -3.171 1.00 1.13 H new ATOM 0 HD21 LEU B 55 -31.261 8.217 -1.890 1.00 1.09 H new ATOM 0 HD22 LEU B 55 -31.110 7.988 -3.648 1.00 1.09 H new ATOM 0 HD23 LEU B 55 -32.707 8.290 -2.924 1.00 1.09 H new ATOM 2672 N ASN B 56 -32.619 4.061 -6.523 1.00 1.06 N ATOM 2673 CA ASN B 56 -32.521 2.794 -7.238 1.00 1.16 C ATOM 2674 C ASN B 56 -31.453 2.863 -8.331 1.00 1.20 C ATOM 2675 O ASN B 56 -30.633 1.958 -8.473 1.00 1.26 O ATOM 2676 CB ASN B 56 -33.881 2.445 -7.852 1.00 1.26 C ATOM 2677 CG ASN B 56 -33.854 1.165 -8.665 1.00 1.44 C ATOM 2678 OD1 ASN B 56 -33.158 0.210 -8.323 1.00 1.49 O ATOM 2679 ND2 ASN B 56 -34.601 1.145 -9.760 1.00 1.58 N ATOM 0 H ASN B 56 -33.537 4.501 -6.591 1.00 1.06 H new ATOM 0 HA ASN B 56 -32.231 2.017 -6.531 1.00 1.16 H new ATOM 0 HB2 ASN B 56 -34.619 2.347 -7.055 1.00 1.26 H new ATOM 0 HB3 ASN B 56 -34.207 3.267 -8.489 1.00 1.26 H new ATOM 0 HD21 ASN B 56 -34.613 0.316 -10.354 1.00 1.58 H new ATOM 0 HD22 ASN B 56 -35.164 1.958 -10.008 1.00 1.58 H new ATOM 2686 N LYS B 57 -31.461 3.950 -9.091 1.00 1.21 N ATOM 2687 CA LYS B 57 -30.498 4.142 -10.171 1.00 1.29 C ATOM 2688 C LYS B 57 -29.096 4.401 -9.623 1.00 1.21 C ATOM 2689 O LYS B 57 -28.102 3.929 -10.178 1.00 1.26 O ATOM 2690 CB LYS B 57 -30.930 5.312 -11.062 1.00 1.39 C ATOM 2691 CG LYS B 57 -32.278 5.119 -11.751 1.00 1.52 C ATOM 2692 CD LYS B 57 -32.119 4.531 -13.148 1.00 1.62 C ATOM 2693 CE LYS B 57 -32.128 3.013 -13.129 1.00 1.73 C ATOM 2694 NZ LYS B 57 -33.450 2.464 -12.727 1.00 1.81 N ATOM 0 H LYS B 57 -32.126 4.716 -8.980 1.00 1.21 H new ATOM 0 HA LYS B 57 -30.471 3.227 -10.762 1.00 1.29 H new ATOM 0 HB2 LYS B 57 -30.972 6.217 -10.456 1.00 1.39 H new ATOM 0 HB3 LYS B 57 -30.167 5.473 -11.823 1.00 1.39 H new ATOM 0 HG2 LYS B 57 -32.904 4.461 -11.148 1.00 1.52 H new ATOM 0 HG3 LYS B 57 -32.794 6.077 -11.816 1.00 1.52 H new ATOM 0 HD2 LYS B 57 -32.926 4.891 -13.787 1.00 1.62 H new ATOM 0 HD3 LYS B 57 -31.185 4.883 -13.586 1.00 1.62 H new ATOM 0 HE2 LYS B 57 -31.866 2.637 -14.118 1.00 1.73 H new ATOM 0 HE3 LYS B 57 -31.363 2.655 -12.440 1.00 1.73 H new ATOM 0 HZ1 LYS B 57 -33.319 1.758 -11.975 1.00 1.81 H new ATOM 0 HZ2 LYS B 57 -34.054 3.235 -12.377 1.00 1.81 H new ATOM 0 HZ3 LYS B 57 -33.903 2.015 -13.548 1.00 1.81 H new ATOM 2708 N LEU B 58 -29.029 5.137 -8.520 1.00 1.12 N ATOM 2709 CA LEU B 58 -27.759 5.477 -7.895 1.00 1.09 C ATOM 2710 C LEU B 58 -27.038 4.233 -7.387 1.00 1.08 C ATOM 2711 O LEU B 58 -25.858 4.032 -7.680 1.00 1.11 O ATOM 2712 CB LEU B 58 -27.975 6.472 -6.748 1.00 1.06 C ATOM 2713 CG LEU B 58 -27.649 7.935 -7.073 1.00 1.21 C ATOM 2714 CD1 LEU B 58 -26.162 8.111 -7.340 1.00 1.37 C ATOM 2715 CD2 LEU B 58 -28.458 8.424 -8.262 1.00 1.40 C ATOM 0 H LEU B 58 -29.846 5.512 -8.038 1.00 1.12 H new ATOM 0 HA LEU B 58 -27.130 5.943 -8.653 1.00 1.09 H new ATOM 0 HB2 LEU B 58 -29.016 6.412 -6.429 1.00 1.06 H new ATOM 0 HB3 LEU B 58 -27.364 6.161 -5.901 1.00 1.06 H new ATOM 0 HG LEU B 58 -27.920 8.536 -6.205 1.00 1.21 H new ATOM 0 HD11 LEU B 58 -25.955 9.156 -7.568 1.00 1.37 H new ATOM 0 HD12 LEU B 58 -25.596 7.813 -6.457 1.00 1.37 H new ATOM 0 HD13 LEU B 58 -25.868 7.490 -8.186 1.00 1.37 H new ATOM 0 HD21 LEU B 58 -28.207 9.464 -8.470 1.00 1.40 H new ATOM 0 HD22 LEU B 58 -28.227 7.813 -9.135 1.00 1.40 H new ATOM 0 HD23 LEU B 58 -29.521 8.346 -8.035 1.00 1.40 H new ATOM 2727 N ILE B 59 -27.750 3.395 -6.639 1.00 1.08 N ATOM 2728 CA ILE B 59 -27.164 2.172 -6.101 1.00 1.15 C ATOM 2729 C ILE B 59 -26.760 1.230 -7.238 1.00 1.25 C ATOM 2730 O ILE B 59 -25.744 0.541 -7.152 1.00 1.32 O ATOM 2731 CB ILE B 59 -28.122 1.455 -5.109 1.00 1.20 C ATOM 2732 CG1 ILE B 59 -27.407 0.298 -4.402 1.00 1.33 C ATOM 2733 CG2 ILE B 59 -29.368 0.951 -5.816 1.00 1.22 C ATOM 2734 CD1 ILE B 59 -26.354 0.751 -3.415 1.00 1.37 C ATOM 0 H ILE B 59 -28.729 3.540 -6.393 1.00 1.08 H new ATOM 0 HA ILE B 59 -26.272 2.454 -5.541 1.00 1.15 H new ATOM 0 HB ILE B 59 -28.428 2.185 -4.359 1.00 1.20 H new ATOM 0 HG12 ILE B 59 -28.146 -0.310 -3.879 1.00 1.33 H new ATOM 0 HG13 ILE B 59 -26.940 -0.342 -5.151 1.00 1.33 H new ATOM 0 HG21 ILE B 59 -30.019 0.454 -5.096 1.00 1.22 H new ATOM 0 HG22 ILE B 59 -29.897 1.792 -6.264 1.00 1.22 H new ATOM 0 HG23 ILE B 59 -29.083 0.245 -6.596 1.00 1.22 H new ATOM 0 HD11 ILE B 59 -25.890 -0.120 -2.953 1.00 1.37 H new ATOM 0 HD12 ILE B 59 -25.594 1.334 -3.936 1.00 1.37 H new ATOM 0 HD13 ILE B 59 -26.818 1.366 -2.644 1.00 1.37 H new ATOM 2746 N GLU B 60 -27.549 1.237 -8.314 1.00 1.29 N ATOM 2747 CA GLU B 60 -27.280 0.404 -9.480 1.00 1.44 C ATOM 2748 C GLU B 60 -25.949 0.802 -10.113 1.00 1.40 C ATOM 2749 O GLU B 60 -25.190 -0.045 -10.587 1.00 1.51 O ATOM 2750 CB GLU B 60 -28.413 0.537 -10.500 1.00 1.54 C ATOM 2751 CG GLU B 60 -28.210 -0.299 -11.752 1.00 1.75 C ATOM 2752 CD GLU B 60 -29.411 -0.273 -12.674 1.00 1.96 C ATOM 2753 OE1 GLU B 60 -29.516 0.659 -13.497 1.00 2.17 O ATOM 2754 OE2 GLU B 60 -30.260 -1.184 -12.584 1.00 2.28 O ATOM 0 H GLU B 60 -28.384 1.816 -8.399 1.00 1.29 H new ATOM 0 HA GLU B 60 -27.220 -0.637 -9.161 1.00 1.44 H new ATOM 0 HB2 GLU B 60 -29.351 0.246 -10.028 1.00 1.54 H new ATOM 0 HB3 GLU B 60 -28.512 1.584 -10.785 1.00 1.54 H new ATOM 0 HG2 GLU B 60 -27.336 0.067 -12.290 1.00 1.75 H new ATOM 0 HG3 GLU B 60 -27.999 -1.329 -11.466 1.00 1.75 H new ATOM 2761 N GLY B 61 -25.664 2.098 -10.080 1.00 1.29 N ATOM 2762 CA GLY B 61 -24.428 2.608 -10.641 1.00 1.28 C ATOM 2763 C GLY B 61 -23.208 2.186 -9.842 1.00 1.21 C ATOM 2764 O GLY B 61 -22.123 2.026 -10.395 1.00 1.23 O ATOM 0 H GLY B 61 -26.271 2.809 -9.672 1.00 1.29 H new ATOM 0 HA2 GLY B 61 -24.326 2.255 -11.667 1.00 1.28 H new ATOM 0 HA3 GLY B 61 -24.473 3.696 -10.681 1.00 1.28 H new ATOM 2768 N TYR B 62 -23.389 2.012 -8.536 1.00 1.19 N ATOM 2769 CA TYR B 62 -22.298 1.595 -7.658 1.00 1.23 C ATOM 2770 C TYR B 62 -21.924 0.137 -7.912 1.00 1.35 C ATOM 2771 O TYR B 62 -20.746 -0.226 -7.872 1.00 1.37 O ATOM 2772 CB TYR B 62 -22.681 1.801 -6.191 1.00 1.28 C ATOM 2773 CG TYR B 62 -22.868 3.255 -5.813 1.00 1.60 C ATOM 2774 CD1 TYR B 62 -22.035 4.243 -6.327 1.00 2.25 C ATOM 2775 CD2 TYR B 62 -23.875 3.639 -4.938 1.00 2.11 C ATOM 2776 CE1 TYR B 62 -22.204 5.568 -5.981 1.00 2.90 C ATOM 2777 CE2 TYR B 62 -24.049 4.963 -4.587 1.00 2.72 C ATOM 2778 CZ TYR B 62 -23.210 5.921 -5.111 1.00 2.96 C ATOM 2779 OH TYR B 62 -23.374 7.237 -4.757 1.00 3.75 O ATOM 0 H TYR B 62 -24.281 2.153 -8.061 1.00 1.19 H new ATOM 0 HA TYR B 62 -21.428 2.214 -7.879 1.00 1.23 H new ATOM 0 HB2 TYR B 62 -23.604 1.259 -5.985 1.00 1.28 H new ATOM 0 HB3 TYR B 62 -21.908 1.366 -5.558 1.00 1.28 H new ATOM 0 HD1 TYR B 62 -21.243 3.969 -7.008 1.00 2.25 H new ATOM 0 HD2 TYR B 62 -24.534 2.889 -4.525 1.00 2.11 H new ATOM 0 HE1 TYR B 62 -21.550 6.324 -6.391 1.00 2.90 H new ATOM 0 HE2 TYR B 62 -24.838 5.245 -3.906 1.00 2.72 H new ATOM 0 HH TYR B 62 -24.129 7.317 -4.137 1.00 3.75 H new ATOM 2789 N THR B 63 -22.930 -0.693 -8.182 1.00 1.51 N ATOM 2790 CA THR B 63 -22.698 -2.106 -8.460 1.00 1.71 C ATOM 2791 C THR B 63 -21.944 -2.279 -9.771 1.00 1.67 C ATOM 2792 O THR B 63 -21.220 -3.253 -9.963 1.00 1.80 O ATOM 2793 CB THR B 63 -24.018 -2.894 -8.533 1.00 1.94 C ATOM 2794 OG1 THR B 63 -25.119 -1.990 -8.669 1.00 2.00 O ATOM 2795 CG2 THR B 63 -24.212 -3.748 -7.294 1.00 2.31 C ATOM 0 H THR B 63 -23.910 -0.411 -8.214 1.00 1.51 H new ATOM 0 HA THR B 63 -22.101 -2.499 -7.637 1.00 1.71 H new ATOM 0 HB THR B 63 -23.973 -3.550 -9.402 1.00 1.94 H new ATOM 0 HG1 THR B 63 -24.976 -1.416 -9.451 1.00 2.00 H new ATOM 0 HG21 THR B 63 -25.152 -4.294 -7.372 1.00 2.31 H new ATOM 0 HG22 THR B 63 -23.388 -4.456 -7.207 1.00 2.31 H new ATOM 0 HG23 THR B 63 -24.236 -3.109 -6.412 1.00 2.31 H new ATOM 2803 N TYR B 64 -22.116 -1.317 -10.667 1.00 1.57 N ATOM 2804 CA TYR B 64 -21.452 -1.350 -11.962 1.00 1.63 C ATOM 2805 C TYR B 64 -20.179 -0.514 -11.925 1.00 1.37 C ATOM 2806 O TYR B 64 -19.618 -0.166 -12.963 1.00 1.46 O ATOM 2807 CB TYR B 64 -22.385 -0.821 -13.050 1.00 1.90 C ATOM 2808 CG TYR B 64 -23.501 -1.774 -13.434 1.00 2.42 C ATOM 2809 CD1 TYR B 64 -24.476 -2.149 -12.516 1.00 2.81 C ATOM 2810 CD2 TYR B 64 -23.586 -2.281 -14.721 1.00 3.10 C ATOM 2811 CE1 TYR B 64 -25.501 -2.998 -12.871 1.00 3.50 C ATOM 2812 CE2 TYR B 64 -24.609 -3.135 -15.083 1.00 3.76 C ATOM 2813 CZ TYR B 64 -25.563 -3.489 -14.155 1.00 3.84 C ATOM 2814 OH TYR B 64 -26.582 -4.337 -14.517 1.00 4.62 O ATOM 0 H TYR B 64 -22.712 -0.502 -10.520 1.00 1.57 H new ATOM 0 HA TYR B 64 -21.192 -2.384 -12.189 1.00 1.63 H new ATOM 0 HB2 TYR B 64 -22.825 0.117 -12.710 1.00 1.90 H new ATOM 0 HB3 TYR B 64 -21.796 -0.594 -13.938 1.00 1.90 H new ATOM 0 HD1 TYR B 64 -24.429 -1.768 -11.507 1.00 2.81 H new ATOM 0 HD2 TYR B 64 -22.841 -2.004 -15.452 1.00 3.10 H new ATOM 0 HE1 TYR B 64 -26.251 -3.277 -12.146 1.00 3.50 H new ATOM 0 HE2 TYR B 64 -24.661 -3.524 -16.089 1.00 3.76 H new ATOM 0 HH TYR B 64 -26.478 -4.590 -15.458 1.00 4.62 H new ATOM 2824 N GLY B 65 -19.737 -0.191 -10.716 1.00 1.20 N ATOM 2825 CA GLY B 65 -18.544 0.607 -10.542 1.00 1.11 C ATOM 2826 C GLY B 65 -17.274 -0.183 -10.765 1.00 1.04 C ATOM 2827 O GLY B 65 -16.633 -0.628 -9.808 1.00 1.03 O ATOM 0 H GLY B 65 -20.190 -0.472 -9.847 1.00 1.20 H new ATOM 0 HA2 GLY B 65 -18.570 1.448 -11.235 1.00 1.11 H new ATOM 0 HA3 GLY B 65 -18.535 1.024 -9.535 1.00 1.11 H new ATOM 2831 N GLU B 66 -16.909 -0.358 -12.025 1.00 1.04 N ATOM 2832 CA GLU B 66 -15.698 -1.082 -12.381 1.00 1.02 C ATOM 2833 C GLU B 66 -14.477 -0.314 -11.897 1.00 0.98 C ATOM 2834 O GLU B 66 -13.486 -0.904 -11.470 1.00 0.95 O ATOM 2835 CB GLU B 66 -15.626 -1.297 -13.892 1.00 1.10 C ATOM 2836 CG GLU B 66 -16.426 -2.496 -14.371 1.00 1.36 C ATOM 2837 CD GLU B 66 -15.666 -3.791 -14.199 1.00 1.66 C ATOM 2838 OE1 GLU B 66 -14.758 -4.056 -15.016 1.00 2.08 O ATOM 2839 OE2 GLU B 66 -15.959 -4.542 -13.248 1.00 2.08 O ATOM 0 H GLU B 66 -17.438 -0.006 -12.823 1.00 1.04 H new ATOM 0 HA GLU B 66 -15.718 -2.059 -11.898 1.00 1.02 H new ATOM 0 HB2 GLU B 66 -15.990 -0.402 -14.396 1.00 1.10 H new ATOM 0 HB3 GLU B 66 -14.584 -1.425 -14.184 1.00 1.10 H new ATOM 0 HG2 GLU B 66 -17.364 -2.550 -13.818 1.00 1.36 H new ATOM 0 HG3 GLU B 66 -16.683 -2.364 -15.422 1.00 1.36 H new ATOM 2846 N GLU B 67 -14.572 1.009 -11.943 1.00 1.00 N ATOM 2847 CA GLU B 67 -13.488 1.870 -11.493 1.00 1.01 C ATOM 2848 C GLU B 67 -13.258 1.687 -9.996 1.00 0.97 C ATOM 2849 O GLU B 67 -12.137 1.815 -9.513 1.00 0.95 O ATOM 2850 CB GLU B 67 -13.791 3.332 -11.814 1.00 1.10 C ATOM 2851 CG GLU B 67 -13.733 3.643 -13.299 1.00 1.53 C ATOM 2852 CD GLU B 67 -14.599 4.817 -13.685 1.00 1.81 C ATOM 2853 OE1 GLU B 67 -15.839 4.686 -13.645 1.00 2.28 O ATOM 2854 OE2 GLU B 67 -14.049 5.879 -14.034 1.00 2.44 O ATOM 0 H GLU B 67 -15.391 1.509 -12.288 1.00 1.00 H new ATOM 0 HA GLU B 67 -12.578 1.588 -12.023 1.00 1.01 H new ATOM 0 HB2 GLU B 67 -14.782 3.582 -11.435 1.00 1.10 H new ATOM 0 HB3 GLU B 67 -13.079 3.968 -11.288 1.00 1.10 H new ATOM 0 HG2 GLU B 67 -12.701 3.850 -13.582 1.00 1.53 H new ATOM 0 HG3 GLU B 67 -14.048 2.764 -13.862 1.00 1.53 H new ATOM 2861 N ARG B 68 -14.323 1.360 -9.268 1.00 0.98 N ATOM 2862 CA ARG B 68 -14.214 1.131 -7.832 1.00 0.99 C ATOM 2863 C ARG B 68 -13.403 -0.136 -7.599 1.00 0.95 C ATOM 2864 O ARG B 68 -12.586 -0.219 -6.679 1.00 0.95 O ATOM 2865 CB ARG B 68 -15.596 0.999 -7.179 1.00 1.04 C ATOM 2866 CG ARG B 68 -15.537 0.768 -5.674 1.00 1.10 C ATOM 2867 CD ARG B 68 -16.608 -0.209 -5.219 1.00 1.41 C ATOM 2868 NE ARG B 68 -16.344 -0.723 -3.872 1.00 1.59 N ATOM 2869 CZ ARG B 68 -16.686 -1.946 -3.455 1.00 1.88 C ATOM 2870 NH1 ARG B 68 -17.305 -2.787 -4.275 1.00 2.30 N ATOM 2871 NH2 ARG B 68 -16.401 -2.330 -2.217 1.00 2.17 N ATOM 0 H ARG B 68 -15.264 1.249 -9.646 1.00 0.98 H new ATOM 0 HA ARG B 68 -13.716 1.987 -7.376 1.00 0.99 H new ATOM 0 HB2 ARG B 68 -16.171 1.904 -7.378 1.00 1.04 H new ATOM 0 HB3 ARG B 68 -16.132 0.172 -7.645 1.00 1.04 H new ATOM 0 HG2 ARG B 68 -14.554 0.384 -5.402 1.00 1.10 H new ATOM 0 HG3 ARG B 68 -15.664 1.717 -5.154 1.00 1.10 H new ATOM 0 HD2 ARG B 68 -17.580 0.285 -5.235 1.00 1.41 H new ATOM 0 HD3 ARG B 68 -16.662 -1.041 -5.921 1.00 1.41 H new ATOM 0 HE ARG B 68 -15.869 -0.108 -3.211 1.00 1.59 H new ATOM 0 HH11 ARG B 68 -17.522 -2.501 -5.230 1.00 2.30 H new ATOM 0 HH12 ARG B 68 -17.563 -3.719 -3.950 1.00 2.30 H new ATOM 0 HH21 ARG B 68 -15.921 -1.692 -1.583 1.00 2.17 H new ATOM 0 HH22 ARG B 68 -16.662 -3.263 -1.900 1.00 2.17 H new ATOM 2885 N LYS B 69 -13.626 -1.119 -8.463 1.00 0.94 N ATOM 2886 CA LYS B 69 -12.912 -2.381 -8.389 1.00 0.94 C ATOM 2887 C LYS B 69 -11.439 -2.146 -8.709 1.00 0.89 C ATOM 2888 O LYS B 69 -10.554 -2.813 -8.173 1.00 0.88 O ATOM 2889 CB LYS B 69 -13.527 -3.384 -9.369 1.00 1.00 C ATOM 2890 CG LYS B 69 -13.062 -4.816 -9.166 1.00 1.28 C ATOM 2891 CD LYS B 69 -13.799 -5.776 -10.088 1.00 1.46 C ATOM 2892 CE LYS B 69 -13.365 -5.604 -11.535 1.00 1.55 C ATOM 2893 NZ LYS B 69 -14.206 -6.395 -12.472 1.00 1.70 N ATOM 0 H LYS B 69 -14.300 -1.062 -9.226 1.00 0.94 H new ATOM 0 HA LYS B 69 -12.993 -2.792 -7.383 1.00 0.94 H new ATOM 0 HB2 LYS B 69 -14.612 -3.349 -9.274 1.00 1.00 H new ATOM 0 HB3 LYS B 69 -13.286 -3.076 -10.386 1.00 1.00 H new ATOM 0 HG2 LYS B 69 -11.990 -4.882 -9.352 1.00 1.28 H new ATOM 0 HG3 LYS B 69 -13.224 -5.109 -8.129 1.00 1.28 H new ATOM 0 HD2 LYS B 69 -13.612 -6.802 -9.771 1.00 1.46 H new ATOM 0 HD3 LYS B 69 -14.873 -5.608 -10.007 1.00 1.46 H new ATOM 0 HE2 LYS B 69 -13.417 -4.549 -11.805 1.00 1.55 H new ATOM 0 HE3 LYS B 69 -12.324 -5.909 -11.639 1.00 1.55 H new ATOM 0 HZ1 LYS B 69 -13.654 -6.628 -13.322 1.00 1.70 H new ATOM 0 HZ2 LYS B 69 -14.513 -7.273 -12.006 1.00 1.70 H new ATOM 0 HZ3 LYS B 69 -15.041 -5.838 -12.744 1.00 1.70 H new ATOM 2907 N LEU B 70 -11.191 -1.166 -9.578 1.00 0.89 N ATOM 2908 CA LEU B 70 -9.834 -0.807 -9.978 1.00 0.87 C ATOM 2909 C LEU B 70 -9.056 -0.252 -8.789 1.00 0.83 C ATOM 2910 O LEU B 70 -7.851 -0.466 -8.671 1.00 0.82 O ATOM 2911 CB LEU B 70 -9.863 0.219 -11.115 1.00 0.91 C ATOM 2912 CG LEU B 70 -8.492 0.628 -11.659 1.00 0.96 C ATOM 2913 CD1 LEU B 70 -7.881 -0.502 -12.479 1.00 1.04 C ATOM 2914 CD2 LEU B 70 -8.607 1.899 -12.492 1.00 1.04 C ATOM 0 H LEU B 70 -11.919 -0.604 -10.020 1.00 0.89 H new ATOM 0 HA LEU B 70 -9.333 -1.707 -10.334 1.00 0.87 H new ATOM 0 HB2 LEU B 70 -10.455 -0.188 -11.935 1.00 0.91 H new ATOM 0 HB3 LEU B 70 -10.378 1.113 -10.763 1.00 0.91 H new ATOM 0 HG LEU B 70 -7.832 0.830 -10.815 1.00 0.96 H new ATOM 0 HD11 LEU B 70 -6.907 -0.192 -12.857 1.00 1.04 H new ATOM 0 HD12 LEU B 70 -7.762 -1.385 -11.850 1.00 1.04 H new ATOM 0 HD13 LEU B 70 -8.537 -0.739 -13.317 1.00 1.04 H new ATOM 0 HD21 LEU B 70 -7.623 2.176 -12.871 1.00 1.04 H new ATOM 0 HD22 LEU B 70 -9.283 1.725 -13.329 1.00 1.04 H new ATOM 0 HD23 LEU B 70 -8.997 2.706 -11.872 1.00 1.04 H new ATOM 2926 N TYR B 71 -9.753 0.453 -7.905 1.00 0.84 N ATOM 2927 CA TYR B 71 -9.125 1.026 -6.716 1.00 0.84 C ATOM 2928 C TYR B 71 -8.720 -0.095 -5.769 1.00 0.83 C ATOM 2929 O TYR B 71 -7.652 -0.057 -5.152 1.00 0.82 O ATOM 2930 CB TYR B 71 -10.072 2.009 -6.012 1.00 0.91 C ATOM 2931 CG TYR B 71 -10.570 3.125 -6.907 1.00 0.92 C ATOM 2932 CD1 TYR B 71 -9.728 3.714 -7.841 1.00 0.93 C ATOM 2933 CD2 TYR B 71 -11.881 3.587 -6.823 1.00 1.01 C ATOM 2934 CE1 TYR B 71 -10.175 4.728 -8.666 1.00 1.00 C ATOM 2935 CE2 TYR B 71 -12.333 4.602 -7.645 1.00 1.09 C ATOM 2936 CZ TYR B 71 -11.477 5.169 -8.566 1.00 1.07 C ATOM 2937 OH TYR B 71 -11.926 6.182 -9.384 1.00 1.19 O ATOM 0 H TYR B 71 -10.752 0.642 -7.987 1.00 0.84 H new ATOM 0 HA TYR B 71 -8.238 1.581 -7.020 1.00 0.84 H new ATOM 0 HB2 TYR B 71 -10.928 1.458 -5.623 1.00 0.91 H new ATOM 0 HB3 TYR B 71 -9.557 2.445 -5.156 1.00 0.91 H new ATOM 0 HD1 TYR B 71 -8.706 3.374 -7.924 1.00 0.93 H new ATOM 0 HD2 TYR B 71 -12.555 3.145 -6.104 1.00 1.01 H new ATOM 0 HE1 TYR B 71 -9.506 5.174 -9.387 1.00 1.00 H new ATOM 0 HE2 TYR B 71 -13.352 4.950 -7.566 1.00 1.09 H new ATOM 0 HH TYR B 71 -12.867 6.371 -9.185 1.00 1.19 H new ATOM 2947 N ASP B 72 -9.581 -1.103 -5.674 1.00 0.86 N ATOM 2948 CA ASP B 72 -9.316 -2.268 -4.840 1.00 0.88 C ATOM 2949 C ASP B 72 -8.107 -3.023 -5.398 1.00 0.85 C ATOM 2950 O ASP B 72 -7.306 -3.596 -4.651 1.00 0.85 O ATOM 2951 CB ASP B 72 -10.549 -3.178 -4.793 1.00 0.95 C ATOM 2952 CG ASP B 72 -10.248 -4.558 -4.233 1.00 1.07 C ATOM 2953 OD1 ASP B 72 -10.165 -4.706 -2.993 1.00 1.31 O ATOM 2954 OD2 ASP B 72 -10.117 -5.508 -5.032 1.00 1.32 O ATOM 0 H ASP B 72 -10.473 -1.135 -6.168 1.00 0.86 H new ATOM 0 HA ASP B 72 -9.096 -1.945 -3.822 1.00 0.88 H new ATOM 0 HB2 ASP B 72 -11.320 -2.705 -4.184 1.00 0.95 H new ATOM 0 HB3 ASP B 72 -10.956 -3.281 -5.799 1.00 0.95 H new ATOM 2959 N SER B 73 -7.976 -3.001 -6.724 1.00 0.84 N ATOM 2960 CA SER B 73 -6.862 -3.648 -7.400 1.00 0.83 C ATOM 2961 C SER B 73 -5.551 -2.920 -7.097 1.00 0.79 C ATOM 2962 O SER B 73 -4.512 -3.549 -6.894 1.00 0.78 O ATOM 2963 CB SER B 73 -7.102 -3.669 -8.912 1.00 0.86 C ATOM 2964 OG SER B 73 -8.369 -4.224 -9.226 1.00 0.91 O ATOM 0 H SER B 73 -8.634 -2.538 -7.351 1.00 0.84 H new ATOM 0 HA SER B 73 -6.788 -4.672 -7.033 1.00 0.83 H new ATOM 0 HB2 SER B 73 -7.039 -2.655 -9.306 1.00 0.86 H new ATOM 0 HB3 SER B 73 -6.318 -4.249 -9.399 1.00 0.86 H new ATOM 0 HG SER B 73 -9.076 -3.627 -8.905 1.00 0.91 H new ATOM 2970 N ALA B 74 -5.615 -1.593 -7.049 1.00 0.79 N ATOM 2971 CA ALA B 74 -4.440 -0.770 -6.781 1.00 0.78 C ATOM 2972 C ALA B 74 -3.898 -1.019 -5.381 1.00 0.74 C ATOM 2973 O ALA B 74 -2.687 -1.132 -5.186 1.00 0.72 O ATOM 2974 CB ALA B 74 -4.763 0.704 -6.974 1.00 0.81 C ATOM 0 H ALA B 74 -6.474 -1.062 -7.193 1.00 0.79 H new ATOM 0 HA ALA B 74 -3.666 -1.053 -7.494 1.00 0.78 H new ATOM 0 HB1 ALA B 74 -3.874 1.301 -6.769 1.00 0.81 H new ATOM 0 HB2 ALA B 74 -5.086 0.874 -8.001 1.00 0.81 H new ATOM 0 HB3 ALA B 74 -5.560 0.994 -6.290 1.00 0.81 H new ATOM 2980 N LEU B 75 -4.792 -1.122 -4.406 1.00 0.76 N ATOM 2981 CA LEU B 75 -4.386 -1.367 -3.026 1.00 0.76 C ATOM 2982 C LEU B 75 -3.760 -2.754 -2.897 1.00 0.73 C ATOM 2983 O LEU B 75 -2.852 -2.966 -2.093 1.00 0.71 O ATOM 2984 CB LEU B 75 -5.585 -1.226 -2.083 1.00 0.81 C ATOM 2985 CG LEU B 75 -5.323 -0.435 -0.790 1.00 0.89 C ATOM 2986 CD1 LEU B 75 -4.312 -1.151 0.095 1.00 1.13 C ATOM 2987 CD2 LEU B 75 -4.836 0.974 -1.111 1.00 1.14 C ATOM 0 H LEU B 75 -5.799 -1.040 -4.543 1.00 0.76 H new ATOM 0 HA LEU B 75 -3.640 -0.624 -2.744 1.00 0.76 H new ATOM 0 HB2 LEU B 75 -6.397 -0.742 -2.626 1.00 0.81 H new ATOM 0 HB3 LEU B 75 -5.932 -2.224 -1.814 1.00 0.81 H new ATOM 0 HG LEU B 75 -6.265 -0.365 -0.246 1.00 0.89 H new ATOM 0 HD11 LEU B 75 -4.146 -0.569 1.002 1.00 1.13 H new ATOM 0 HD12 LEU B 75 -4.695 -2.136 0.361 1.00 1.13 H new ATOM 0 HD13 LEU B 75 -3.370 -1.261 -0.443 1.00 1.13 H new ATOM 0 HD21 LEU B 75 -4.656 1.517 -0.183 1.00 1.14 H new ATOM 0 HD22 LEU B 75 -3.910 0.917 -1.683 1.00 1.14 H new ATOM 0 HD23 LEU B 75 -5.593 1.496 -1.696 1.00 1.14 H new ATOM 2999 N SER B 76 -4.231 -3.694 -3.709 1.00 0.75 N ATOM 3000 CA SER B 76 -3.698 -5.049 -3.693 1.00 0.75 C ATOM 3001 C SER B 76 -2.253 -5.044 -4.200 1.00 0.72 C ATOM 3002 O SER B 76 -1.446 -5.906 -3.839 1.00 0.72 O ATOM 3003 CB SER B 76 -4.582 -5.969 -4.539 1.00 0.81 C ATOM 3004 OG SER B 76 -5.910 -6.015 -4.024 1.00 0.91 O ATOM 0 H SER B 76 -4.980 -3.542 -4.385 1.00 0.75 H new ATOM 0 HA SER B 76 -3.698 -5.429 -2.671 1.00 0.75 H new ATOM 0 HB2 SER B 76 -4.600 -5.615 -5.570 1.00 0.81 H new ATOM 0 HB3 SER B 76 -4.159 -6.973 -4.554 1.00 0.81 H new ATOM 0 HG SER B 76 -6.375 -5.181 -4.244 1.00 0.91 H new ATOM 3010 N LYS B 77 -1.933 -4.056 -5.026 1.00 0.72 N ATOM 3011 CA LYS B 77 -0.591 -3.912 -5.558 1.00 0.71 C ATOM 3012 C LYS B 77 0.331 -3.444 -4.445 1.00 0.67 C ATOM 3013 O LYS B 77 1.503 -3.809 -4.401 1.00 0.66 O ATOM 3014 CB LYS B 77 -0.573 -2.915 -6.725 1.00 0.75 C ATOM 3015 CG LYS B 77 -1.285 -3.415 -7.975 1.00 0.93 C ATOM 3016 CD LYS B 77 -1.343 -2.351 -9.062 1.00 1.09 C ATOM 3017 CE LYS B 77 0.042 -1.846 -9.433 1.00 1.34 C ATOM 3018 NZ LYS B 77 0.071 -1.236 -10.788 1.00 1.68 N ATOM 0 H LYS B 77 -2.590 -3.342 -5.341 1.00 0.72 H new ATOM 0 HA LYS B 77 -0.248 -4.874 -5.938 1.00 0.71 H new ATOM 0 HB2 LYS B 77 -1.038 -1.984 -6.402 1.00 0.75 H new ATOM 0 HB3 LYS B 77 0.462 -2.684 -6.976 1.00 0.75 H new ATOM 0 HG2 LYS B 77 -0.770 -4.296 -8.357 1.00 0.93 H new ATOM 0 HG3 LYS B 77 -2.298 -3.725 -7.716 1.00 0.93 H new ATOM 0 HD2 LYS B 77 -1.829 -2.762 -9.947 1.00 1.09 H new ATOM 0 HD3 LYS B 77 -1.955 -1.516 -8.721 1.00 1.09 H new ATOM 0 HE2 LYS B 77 0.368 -1.110 -8.698 1.00 1.34 H new ATOM 0 HE3 LYS B 77 0.751 -2.673 -9.393 1.00 1.34 H new ATOM 0 HZ1 LYS B 77 1.034 -0.906 -10.999 1.00 1.68 H new ATOM 0 HZ2 LYS B 77 -0.215 -1.944 -11.494 1.00 1.68 H new ATOM 0 HZ3 LYS B 77 -0.586 -0.431 -10.820 1.00 1.68 H new ATOM 3032 N ILE B 78 -0.222 -2.639 -3.539 1.00 0.66 N ATOM 3033 CA ILE B 78 0.524 -2.135 -2.394 1.00 0.64 C ATOM 3034 C ILE B 78 1.005 -3.310 -1.546 1.00 0.63 C ATOM 3035 O ILE B 78 2.146 -3.334 -1.082 1.00 0.64 O ATOM 3036 CB ILE B 78 -0.348 -1.191 -1.525 1.00 0.67 C ATOM 3037 CG1 ILE B 78 -0.552 0.160 -2.226 1.00 0.90 C ATOM 3038 CG2 ILE B 78 0.260 -0.995 -0.140 1.00 0.79 C ATOM 3039 CD1 ILE B 78 0.657 1.076 -2.166 1.00 1.15 C ATOM 0 H ILE B 78 -1.191 -2.322 -3.579 1.00 0.66 H new ATOM 0 HA ILE B 78 1.377 -1.566 -2.764 1.00 0.64 H new ATOM 0 HB ILE B 78 -1.323 -1.662 -1.397 1.00 0.67 H new ATOM 0 HG12 ILE B 78 -0.808 -0.019 -3.270 1.00 0.90 H new ATOM 0 HG13 ILE B 78 -1.403 0.668 -1.772 1.00 0.90 H new ATOM 0 HG21 ILE B 78 -0.374 -0.329 0.445 1.00 0.79 H new ATOM 0 HG22 ILE B 78 0.336 -1.959 0.364 1.00 0.79 H new ATOM 0 HG23 ILE B 78 1.254 -0.557 -0.237 1.00 0.79 H new ATOM 0 HD11 ILE B 78 0.433 2.009 -2.683 1.00 1.15 H new ATOM 0 HD12 ILE B 78 0.902 1.288 -1.125 1.00 1.15 H new ATOM 0 HD13 ILE B 78 1.506 0.590 -2.647 1.00 1.15 H new ATOM 3051 N GLU B 79 0.123 -4.293 -1.382 1.00 0.65 N ATOM 3052 CA GLU B 79 0.428 -5.491 -0.607 1.00 0.67 C ATOM 3053 C GLU B 79 1.638 -6.211 -1.196 1.00 0.67 C ATOM 3054 O GLU B 79 2.484 -6.731 -0.462 1.00 0.70 O ATOM 3055 CB GLU B 79 -0.785 -6.425 -0.581 1.00 0.71 C ATOM 3056 CG GLU B 79 -0.634 -7.587 0.386 1.00 0.77 C ATOM 3057 CD GLU B 79 -1.720 -8.622 0.215 1.00 1.10 C ATOM 3058 OE1 GLU B 79 -1.531 -9.551 -0.598 1.00 1.74 O ATOM 3059 OE2 GLU B 79 -2.767 -8.513 0.887 1.00 1.59 O ATOM 0 H GLU B 79 -0.816 -4.282 -1.780 1.00 0.65 H new ATOM 0 HA GLU B 79 0.665 -5.195 0.415 1.00 0.67 H new ATOM 0 HB2 GLU B 79 -1.671 -5.850 -0.310 1.00 0.71 H new ATOM 0 HB3 GLU B 79 -0.954 -6.817 -1.584 1.00 0.71 H new ATOM 0 HG2 GLU B 79 0.338 -8.056 0.237 1.00 0.77 H new ATOM 0 HG3 GLU B 79 -0.653 -7.210 1.409 1.00 0.77 H new ATOM 3066 N LYS B 80 1.726 -6.227 -2.523 1.00 0.67 N ATOM 3067 CA LYS B 80 2.847 -6.867 -3.207 1.00 0.69 C ATOM 3068 C LYS B 80 4.151 -6.170 -2.844 1.00 0.68 C ATOM 3069 O LYS B 80 5.176 -6.820 -2.644 1.00 0.72 O ATOM 3070 CB LYS B 80 2.643 -6.843 -4.725 1.00 0.72 C ATOM 3071 CG LYS B 80 1.466 -7.678 -5.196 1.00 0.79 C ATOM 3072 CD LYS B 80 1.537 -7.948 -6.692 1.00 1.18 C ATOM 3073 CE LYS B 80 2.653 -8.925 -7.040 1.00 1.78 C ATOM 3074 NZ LYS B 80 2.419 -10.275 -6.459 1.00 2.05 N ATOM 0 H LYS B 80 1.037 -5.805 -3.145 1.00 0.67 H new ATOM 0 HA LYS B 80 2.897 -7.906 -2.883 1.00 0.69 H new ATOM 0 HB2 LYS B 80 2.497 -5.812 -5.047 1.00 0.72 H new ATOM 0 HB3 LYS B 80 3.550 -7.203 -5.210 1.00 0.72 H new ATOM 0 HG2 LYS B 80 1.450 -8.624 -4.655 1.00 0.79 H new ATOM 0 HG3 LYS B 80 0.535 -7.161 -4.962 1.00 0.79 H new ATOM 0 HD2 LYS B 80 0.583 -8.349 -7.034 1.00 1.18 H new ATOM 0 HD3 LYS B 80 1.697 -7.010 -7.223 1.00 1.18 H new ATOM 0 HE2 LYS B 80 2.737 -9.007 -8.124 1.00 1.78 H new ATOM 0 HE3 LYS B 80 3.603 -8.534 -6.675 1.00 1.78 H new ATOM 0 HZ1 LYS B 80 3.037 -10.967 -6.929 1.00 2.05 H new ATOM 0 HZ2 LYS B 80 2.632 -10.256 -5.441 1.00 2.05 H new ATOM 0 HZ3 LYS B 80 1.425 -10.546 -6.600 1.00 2.05 H new ATOM 3088 N LEU B 81 4.095 -4.846 -2.740 1.00 0.65 N ATOM 3089 CA LEU B 81 5.263 -4.045 -2.389 1.00 0.67 C ATOM 3090 C LEU B 81 5.712 -4.367 -0.966 1.00 0.68 C ATOM 3091 O LEU B 81 6.908 -4.395 -0.668 1.00 0.72 O ATOM 3092 CB LEU B 81 4.943 -2.548 -2.510 1.00 0.67 C ATOM 3093 CG LEU B 81 5.320 -1.886 -3.840 1.00 0.78 C ATOM 3094 CD1 LEU B 81 6.831 -1.835 -3.996 1.00 1.02 C ATOM 3095 CD2 LEU B 81 4.692 -2.621 -5.018 1.00 0.97 C ATOM 0 H LEU B 81 3.246 -4.302 -2.895 1.00 0.65 H new ATOM 0 HA LEU B 81 6.070 -4.288 -3.081 1.00 0.67 H new ATOM 0 HB2 LEU B 81 3.874 -2.411 -2.349 1.00 0.67 H new ATOM 0 HB3 LEU B 81 5.457 -2.021 -1.706 1.00 0.67 H new ATOM 0 HG LEU B 81 4.931 -0.868 -3.831 1.00 0.78 H new ATOM 0 HD11 LEU B 81 7.083 -1.362 -4.945 1.00 1.02 H new ATOM 0 HD12 LEU B 81 7.262 -1.258 -3.178 1.00 1.02 H new ATOM 0 HD13 LEU B 81 7.233 -2.848 -3.977 1.00 1.02 H new ATOM 0 HD21 LEU B 81 4.977 -2.129 -5.948 1.00 0.97 H new ATOM 0 HD22 LEU B 81 5.042 -3.653 -5.032 1.00 0.97 H new ATOM 0 HD23 LEU B 81 3.607 -2.608 -4.918 1.00 0.97 H new ATOM 3107 N ILE B 82 4.739 -4.623 -0.094 1.00 0.68 N ATOM 3108 CA ILE B 82 5.017 -4.960 1.294 1.00 0.72 C ATOM 3109 C ILE B 82 5.792 -6.269 1.365 1.00 0.77 C ATOM 3110 O ILE B 82 6.709 -6.420 2.176 1.00 0.81 O ATOM 3111 CB ILE B 82 3.715 -5.077 2.126 1.00 0.72 C ATOM 3112 CG1 ILE B 82 2.838 -3.838 1.911 1.00 0.70 C ATOM 3113 CG2 ILE B 82 4.043 -5.252 3.602 1.00 0.78 C ATOM 3114 CD1 ILE B 82 1.530 -3.848 2.680 1.00 0.72 C ATOM 0 H ILE B 82 3.747 -4.602 -0.329 1.00 0.68 H new ATOM 0 HA ILE B 82 5.616 -4.154 1.718 1.00 0.72 H new ATOM 0 HB ILE B 82 3.162 -5.955 1.792 1.00 0.72 H new ATOM 0 HG12 ILE B 82 3.406 -2.953 2.198 1.00 0.70 H new ATOM 0 HG13 ILE B 82 2.618 -3.745 0.847 1.00 0.70 H new ATOM 0 HG21 ILE B 82 3.118 -5.333 4.173 1.00 0.78 H new ATOM 0 HG22 ILE B 82 4.634 -6.158 3.739 1.00 0.78 H new ATOM 0 HG23 ILE B 82 4.612 -4.391 3.953 1.00 0.78 H new ATOM 0 HD11 ILE B 82 0.976 -2.934 2.467 1.00 0.72 H new ATOM 0 HD12 ILE B 82 0.937 -4.711 2.377 1.00 0.72 H new ATOM 0 HD13 ILE B 82 1.737 -3.907 3.749 1.00 0.72 H new ATOM 3126 N GLU B 83 5.438 -7.199 0.484 1.00 0.78 N ATOM 3127 CA GLU B 83 6.096 -8.494 0.435 1.00 0.85 C ATOM 3128 C GLU B 83 7.539 -8.351 -0.053 1.00 0.87 C ATOM 3129 O GLU B 83 8.399 -9.167 0.273 1.00 0.94 O ATOM 3130 CB GLU B 83 5.326 -9.450 -0.476 1.00 0.88 C ATOM 3131 CG GLU B 83 5.627 -10.914 -0.208 1.00 1.11 C ATOM 3132 CD GLU B 83 5.376 -11.785 -1.416 1.00 1.73 C ATOM 3133 OE1 GLU B 83 4.214 -11.870 -1.861 1.00 2.41 O ATOM 3134 OE2 GLU B 83 6.343 -12.386 -1.927 1.00 2.25 O ATOM 0 H GLU B 83 4.697 -7.077 -0.206 1.00 0.78 H new ATOM 0 HA GLU B 83 6.111 -8.905 1.444 1.00 0.85 H new ATOM 0 HB2 GLU B 83 4.257 -9.278 -0.350 1.00 0.88 H new ATOM 0 HB3 GLU B 83 5.565 -9.222 -1.515 1.00 0.88 H new ATOM 0 HG2 GLU B 83 6.667 -11.017 0.101 1.00 1.11 H new ATOM 0 HG3 GLU B 83 5.012 -11.262 0.622 1.00 1.11 H new ATOM 3141 N THR B 84 7.805 -7.309 -0.830 1.00 0.83 N ATOM 3142 CA THR B 84 9.144 -7.082 -1.339 1.00 0.87 C ATOM 3143 C THR B 84 10.023 -6.465 -0.253 1.00 0.91 C ATOM 3144 O THR B 84 11.236 -6.675 -0.220 1.00 0.98 O ATOM 3145 CB THR B 84 9.128 -6.169 -2.579 1.00 0.84 C ATOM 3146 OG1 THR B 84 7.874 -6.294 -3.267 1.00 0.84 O ATOM 3147 CG2 THR B 84 10.267 -6.521 -3.524 1.00 0.87 C ATOM 0 H THR B 84 7.115 -6.615 -1.118 1.00 0.83 H new ATOM 0 HA THR B 84 9.555 -8.047 -1.634 1.00 0.87 H new ATOM 0 HB THR B 84 9.257 -5.139 -2.246 1.00 0.84 H new ATOM 0 HG1 THR B 84 7.872 -5.709 -4.053 1.00 0.84 H new ATOM 0 HG21 THR B 84 10.236 -5.863 -4.393 1.00 0.87 H new ATOM 0 HG22 THR B 84 11.219 -6.396 -3.008 1.00 0.87 H new ATOM 0 HG23 THR B 84 10.163 -7.556 -3.849 1.00 0.87 H new ATOM 3155 N LEU B 85 9.397 -5.707 0.642 1.00 0.90 N ATOM 3156 CA LEU B 85 10.112 -5.071 1.738 1.00 0.98 C ATOM 3157 C LEU B 85 10.412 -6.090 2.833 1.00 1.07 C ATOM 3158 O LEU B 85 11.392 -5.960 3.570 1.00 1.22 O ATOM 3159 CB LEU B 85 9.294 -3.909 2.306 1.00 0.97 C ATOM 3160 CG LEU B 85 9.118 -2.719 1.361 1.00 0.91 C ATOM 3161 CD1 LEU B 85 8.089 -1.751 1.918 1.00 1.03 C ATOM 3162 CD2 LEU B 85 10.446 -2.009 1.134 1.00 1.01 C ATOM 0 H LEU B 85 8.395 -5.519 0.628 1.00 0.90 H new ATOM 0 HA LEU B 85 11.054 -4.678 1.357 1.00 0.98 H new ATOM 0 HB2 LEU B 85 8.308 -4.281 2.585 1.00 0.97 H new ATOM 0 HB3 LEU B 85 9.774 -3.560 3.220 1.00 0.97 H new ATOM 0 HG LEU B 85 8.762 -3.093 0.401 1.00 0.91 H new ATOM 0 HD11 LEU B 85 7.974 -0.909 1.235 1.00 1.03 H new ATOM 0 HD12 LEU B 85 7.132 -2.261 2.029 1.00 1.03 H new ATOM 0 HD13 LEU B 85 8.421 -1.387 2.890 1.00 1.03 H new ATOM 0 HD21 LEU B 85 10.297 -1.166 0.459 1.00 1.01 H new ATOM 0 HD22 LEU B 85 10.833 -1.647 2.087 1.00 1.01 H new ATOM 0 HD23 LEU B 85 11.160 -2.705 0.694 1.00 1.01 H new ATOM 3174 N SER B 86 9.563 -7.111 2.924 1.00 1.08 N ATOM 3175 CA SER B 86 9.727 -8.171 3.914 1.00 1.20 C ATOM 3176 C SER B 86 9.281 -9.513 3.333 1.00 1.59 C ATOM 3177 O SER B 86 8.127 -9.915 3.494 1.00 2.11 O ATOM 3178 CB SER B 86 8.930 -7.850 5.188 1.00 1.48 C ATOM 3179 OG SER B 86 8.013 -6.784 4.974 1.00 1.78 O ATOM 0 H SER B 86 8.750 -7.226 2.319 1.00 1.08 H new ATOM 0 HA SER B 86 10.783 -8.237 4.176 1.00 1.20 H new ATOM 0 HB2 SER B 86 8.388 -8.738 5.513 1.00 1.48 H new ATOM 0 HB3 SER B 86 9.617 -7.585 5.991 1.00 1.48 H new ATOM 0 HG SER B 86 7.520 -6.605 5.802 1.00 1.78 H new