USER MOD reduce.3.24.130724 H: found=0, std=0, add=886, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 883 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 Single : A 1 GLY N :NH3+ -109:sc= 0.0704 (180deg=0) USER MOD Single : A 2 SER OG : rot -86:sc= 0.155 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 14 ASN : amide:sc= 0 X(o=0,f=-0.015) USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 17 GLN : amide:sc= 0 X(o=0,f=-0.0026) USER MOD Single : A 25 ASN : amide:sc= -0.663 K(o=-0.66,f=-7.1!) USER MOD Single : A 30 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 THR OG1 : rot 80:sc= 1.21 USER MOD Single : A 36 LYS NZ :NH3+ 158:sc= 0.42 (180deg=0.216) USER MOD Single : A 38 HIS : no HD1:sc= -0.156 X(o=-0.16,f=-0.38) USER MOD Single : A 43 THR OG1 : rot -76:sc= -0.0947 USER MOD Single : A 44 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 46 HIS : no HD1:sc=-0.00504 X(o=-0.005,f=0) USER MOD Single : A 54 SER OG : rot 94:sc= 0.0233 USER MOD Single : A 56 SER OG : rot 180:sc= 0 USER MOD Single : A 57 GLN : amide:sc= -0.199 X(o=-0.2,f=0.097) USER MOD Single : A 62 SER OG : rot 180:sc= 0 USER MOD Single : A 63 LYS NZ :NH3+ -150:sc= -0.253 (180deg=-1.28!) USER MOD Single : A 66 SER OG : rot 96:sc= 0.00968 USER MOD Single : A 67 MET CE :methyl 176:sc= 0 (180deg=-0.0116) USER MOD Single : A 68 TYR OH : rot 180:sc= 0 USER MOD Single : A 71 GLN : amide:sc= -0.344 K(o=-0.34,f=-1.8!) USER MOD Single : A 78 SER OG : rot 81:sc= -1.38 USER MOD Single : A 80 SER OG : rot 180:sc= 0 USER MOD Single : A 84 MET CE :methyl 153:sc= -0.13 (180deg=-0.759) USER MOD Single : A 85 ASN : amide:sc= -0.0208 X(o=-0.021,f=-0.021) USER MOD Single : A 87 MET CE :methyl -141:sc= -0.0525 (180deg=-0.627) USER MOD Single : A 92 TYR OH : rot 180:sc= -0.0274 USER MOD Single : A 94 ASN : amide:sc= -2.53! C(o=-2.5!,f=-2.5!) USER MOD Single : A 95 GLN : amide:sc= -0.313 K(o=-0.31,f=-3.2!) USER MOD Single : A 97 CYS SG : rot -102:sc= -0.246 USER MOD Single : A 99 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 101 TYR OH : rot 180:sc= 0 USER MOD Single : A 105 TYR OH : rot 180:sc= 0 USER MOD Single : A 108 HIS : no HD1:sc= 0 K(o=0,f=-0.9) USER MOD Single : A 110 SER OG : rot 24:sc= 0.0263 USER MOD Single : A 113 SER OG : rot 180:sc= 0 USER MOD Single : A 114 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -25.518 -20.707 8.127 1.00 0.00 N ATOM 2 CA GLY A 1 -24.094 -20.298 8.276 1.00 0.00 C ATOM 3 C GLY A 1 -23.921 -18.793 8.283 1.00 0.00 C ATOM 4 O GLY A 1 -24.830 -18.054 7.905 1.00 0.00 O ATOM 0 H1 GLY A 1 -25.862 -21.102 9.026 1.00 0.00 H new ATOM 0 H2 GLY A 1 -26.092 -19.879 7.871 1.00 0.00 H new ATOM 0 H3 GLY A 1 -25.596 -21.426 7.380 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -23.696 -20.711 9.203 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -23.510 -20.724 7.460 1.00 0.00 H new ATOM 10 N SER A 2 -22.750 -18.336 8.716 1.00 0.00 N ATOM 11 CA SER A 2 -22.459 -16.908 8.772 1.00 0.00 C ATOM 12 C SER A 2 -22.367 -16.316 7.368 1.00 0.00 C ATOM 13 O SER A 2 -21.619 -16.810 6.524 1.00 0.00 O ATOM 14 CB SER A 2 -21.152 -16.662 9.529 1.00 0.00 C ATOM 15 OG SER A 2 -20.892 -15.275 9.659 1.00 0.00 O ATOM 0 H SER A 2 -21.987 -18.934 9.033 1.00 0.00 H new ATOM 0 HA SER A 2 -23.275 -16.416 9.301 1.00 0.00 H new ATOM 0 HB2 SER A 2 -21.209 -17.119 10.517 1.00 0.00 H new ATOM 0 HB3 SER A 2 -20.327 -17.142 9.003 1.00 0.00 H new ATOM 0 HG SER A 2 -20.415 -14.956 8.865 1.00 0.00 H new ATOM 21 N SER A 3 -23.130 -15.256 7.129 1.00 0.00 N ATOM 22 CA SER A 3 -23.133 -14.595 5.829 1.00 0.00 C ATOM 23 C SER A 3 -22.007 -13.571 5.737 1.00 0.00 C ATOM 24 O SER A 3 -21.277 -13.523 4.747 1.00 0.00 O ATOM 25 CB SER A 3 -24.479 -13.911 5.584 1.00 0.00 C ATOM 26 OG SER A 3 -25.499 -14.864 5.335 1.00 0.00 O ATOM 0 H SER A 3 -23.754 -14.836 7.818 1.00 0.00 H new ATOM 0 HA SER A 3 -22.974 -15.354 5.063 1.00 0.00 H new ATOM 0 HB2 SER A 3 -24.746 -13.306 6.451 1.00 0.00 H new ATOM 0 HB3 SER A 3 -24.396 -13.232 4.735 1.00 0.00 H new ATOM 0 HG SER A 3 -26.349 -14.401 5.183 1.00 0.00 H new ATOM 32 N GLY A 4 -21.870 -12.756 6.777 1.00 0.00 N ATOM 33 CA GLY A 4 -20.830 -11.744 6.797 1.00 0.00 C ATOM 34 C GLY A 4 -19.959 -11.831 8.034 1.00 0.00 C ATOM 35 O GLY A 4 -19.674 -12.925 8.523 1.00 0.00 O ATOM 0 H GLY A 4 -22.461 -12.778 7.608 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -20.206 -11.851 5.909 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -21.288 -10.756 6.748 1.00 0.00 H new ATOM 39 N SER A 5 -19.536 -10.678 8.541 1.00 0.00 N ATOM 40 CA SER A 5 -18.693 -10.631 9.731 1.00 0.00 C ATOM 41 C SER A 5 -18.988 -9.384 10.558 1.00 0.00 C ATOM 42 O SER A 5 -19.339 -9.476 11.734 1.00 0.00 O ATOM 43 CB SER A 5 -17.216 -10.656 9.334 1.00 0.00 C ATOM 44 OG SER A 5 -16.468 -11.490 10.203 1.00 0.00 O ATOM 0 H SER A 5 -19.762 -9.765 8.147 1.00 0.00 H new ATOM 0 HA SER A 5 -18.915 -11.508 10.339 1.00 0.00 H new ATOM 0 HB2 SER A 5 -17.118 -11.013 8.309 1.00 0.00 H new ATOM 0 HB3 SER A 5 -16.812 -9.644 9.359 1.00 0.00 H new ATOM 0 HG SER A 5 -15.528 -11.490 9.927 1.00 0.00 H new ATOM 50 N SER A 6 -18.847 -8.219 9.935 1.00 0.00 N ATOM 51 CA SER A 6 -19.099 -6.953 10.615 1.00 0.00 C ATOM 52 C SER A 6 -19.401 -5.847 9.610 1.00 0.00 C ATOM 53 O SER A 6 -19.091 -4.679 9.845 1.00 0.00 O ATOM 54 CB SER A 6 -17.896 -6.563 11.475 1.00 0.00 C ATOM 55 OG SER A 6 -16.725 -6.435 10.686 1.00 0.00 O ATOM 0 H SER A 6 -18.560 -8.125 8.961 1.00 0.00 H new ATOM 0 HA SER A 6 -19.969 -7.082 11.259 1.00 0.00 H new ATOM 0 HB2 SER A 6 -18.099 -5.621 11.985 1.00 0.00 H new ATOM 0 HB3 SER A 6 -17.738 -7.316 12.247 1.00 0.00 H new ATOM 0 HG SER A 6 -15.971 -6.183 11.259 1.00 0.00 H new ATOM 61 N GLY A 7 -20.008 -6.223 8.488 1.00 0.00 N ATOM 62 CA GLY A 7 -20.342 -5.250 7.464 1.00 0.00 C ATOM 63 C GLY A 7 -19.930 -5.703 6.078 1.00 0.00 C ATOM 64 O GLY A 7 -20.378 -6.744 5.598 1.00 0.00 O ATOM 0 H GLY A 7 -20.274 -7.183 8.270 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -21.416 -5.066 7.478 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -19.853 -4.303 7.694 1.00 0.00 H new ATOM 68 N MET A 8 -19.073 -4.918 5.431 1.00 0.00 N ATOM 69 CA MET A 8 -18.600 -5.245 4.091 1.00 0.00 C ATOM 70 C MET A 8 -17.272 -4.552 3.800 1.00 0.00 C ATOM 71 O MET A 8 -16.979 -4.204 2.655 1.00 0.00 O ATOM 72 CB MET A 8 -19.644 -4.838 3.047 1.00 0.00 C ATOM 73 CG MET A 8 -20.024 -5.963 2.097 1.00 0.00 C ATOM 74 SD MET A 8 -21.780 -5.966 1.691 1.00 0.00 S ATOM 75 CE MET A 8 -21.747 -6.679 0.049 1.00 0.00 C ATOM 0 H MET A 8 -18.693 -4.052 5.813 1.00 0.00 H new ATOM 0 HA MET A 8 -18.445 -6.323 4.038 1.00 0.00 H new ATOM 0 HB2 MET A 8 -20.540 -4.487 3.559 1.00 0.00 H new ATOM 0 HB3 MET A 8 -19.259 -3.999 2.468 1.00 0.00 H new ATOM 0 HG2 MET A 8 -19.443 -5.870 1.179 1.00 0.00 H new ATOM 0 HG3 MET A 8 -19.758 -6.919 2.547 1.00 0.00 H new ATOM 0 HE1 MET A 8 -22.763 -6.747 -0.339 1.00 0.00 H new ATOM 0 HE2 MET A 8 -21.149 -6.049 -0.609 1.00 0.00 H new ATOM 0 HE3 MET A 8 -21.309 -7.676 0.094 1.00 0.00 H new ATOM 85 N ALA A 9 -16.471 -4.357 4.843 1.00 0.00 N ATOM 86 CA ALA A 9 -15.175 -3.707 4.698 1.00 0.00 C ATOM 87 C ALA A 9 -14.098 -4.448 5.484 1.00 0.00 C ATOM 88 O ALA A 9 -14.402 -5.269 6.350 1.00 0.00 O ATOM 89 CB ALA A 9 -15.258 -2.257 5.152 1.00 0.00 C ATOM 0 H ALA A 9 -16.697 -4.640 5.797 1.00 0.00 H new ATOM 0 HA ALA A 9 -14.900 -3.731 3.643 1.00 0.00 H new ATOM 0 HB1 ALA A 9 -14.283 -1.784 5.038 1.00 0.00 H new ATOM 0 HB2 ALA A 9 -15.992 -1.727 4.545 1.00 0.00 H new ATOM 0 HB3 ALA A 9 -15.559 -2.220 6.199 1.00 0.00 H new ATOM 95 N LEU A 10 -12.839 -4.153 5.177 1.00 0.00 N ATOM 96 CA LEU A 10 -11.717 -4.791 5.855 1.00 0.00 C ATOM 97 C LEU A 10 -11.487 -4.168 7.229 1.00 0.00 C ATOM 98 O LEU A 10 -11.820 -4.763 8.254 1.00 0.00 O ATOM 99 CB LEU A 10 -10.448 -4.672 5.009 1.00 0.00 C ATOM 100 CG LEU A 10 -10.404 -5.576 3.777 1.00 0.00 C ATOM 101 CD1 LEU A 10 -9.429 -5.026 2.747 1.00 0.00 C ATOM 102 CD2 LEU A 10 -10.023 -6.995 4.171 1.00 0.00 C ATOM 0 H LEU A 10 -12.570 -3.476 4.463 1.00 0.00 H new ATOM 0 HA LEU A 10 -11.958 -5.846 5.989 1.00 0.00 H new ATOM 0 HB2 LEU A 10 -10.341 -3.637 4.685 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -9.588 -4.899 5.638 1.00 0.00 H new ATOM 0 HG LEU A 10 -11.398 -5.599 3.330 1.00 0.00 H new ATOM 0 HD11 LEU A 10 -9.411 -5.682 1.877 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -9.746 -4.028 2.443 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -8.431 -4.973 3.183 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -9.997 -7.625 3.282 1.00 0.00 H new ATOM 0 HD22 LEU A 10 -9.040 -6.990 4.642 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -10.759 -7.388 4.872 1.00 0.00 H new ATOM 114 N ALA A 11 -10.917 -2.968 7.241 1.00 0.00 N ATOM 115 CA ALA A 11 -10.643 -2.265 8.487 1.00 0.00 C ATOM 116 C ALA A 11 -10.715 -0.754 8.291 1.00 0.00 C ATOM 117 O ALA A 11 -11.159 -0.274 7.248 1.00 0.00 O ATOM 118 CB ALA A 11 -9.279 -2.663 9.029 1.00 0.00 C ATOM 0 H ALA A 11 -10.636 -2.462 6.401 1.00 0.00 H new ATOM 0 HA ALA A 11 -11.407 -2.549 9.211 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -9.088 -2.130 9.960 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -9.261 -3.737 9.215 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -8.509 -2.408 8.300 1.00 0.00 H new ATOM 124 N ARG A 12 -10.276 -0.009 9.301 1.00 0.00 N ATOM 125 CA ARG A 12 -10.290 1.448 9.239 1.00 0.00 C ATOM 126 C ARG A 12 -8.913 2.020 9.559 1.00 0.00 C ATOM 127 O ARG A 12 -8.264 1.603 10.519 1.00 0.00 O ATOM 128 CB ARG A 12 -11.328 2.010 10.211 1.00 0.00 C ATOM 129 CG ARG A 12 -11.125 1.556 11.648 1.00 0.00 C ATOM 130 CD ARG A 12 -11.782 2.511 12.632 1.00 0.00 C ATOM 131 NE ARG A 12 -11.774 1.983 13.994 1.00 0.00 N ATOM 132 CZ ARG A 12 -12.538 2.456 14.976 1.00 0.00 C ATOM 133 NH1 ARG A 12 -13.372 3.465 14.752 1.00 0.00 N ATOM 134 NH2 ARG A 12 -12.468 1.919 16.186 1.00 0.00 N ATOM 0 H ARG A 12 -9.906 -0.390 10.172 1.00 0.00 H new ATOM 0 HA ARG A 12 -10.557 1.741 8.224 1.00 0.00 H new ATOM 0 HB2 ARG A 12 -11.295 3.099 10.175 1.00 0.00 H new ATOM 0 HB3 ARG A 12 -12.323 1.710 9.881 1.00 0.00 H new ATOM 0 HG2 ARG A 12 -11.540 0.556 11.777 1.00 0.00 H new ATOM 0 HG3 ARG A 12 -10.058 1.488 11.862 1.00 0.00 H new ATOM 0 HD2 ARG A 12 -11.261 3.468 12.611 1.00 0.00 H new ATOM 0 HD3 ARG A 12 -12.810 2.700 12.322 1.00 0.00 H new ATOM 0 HE ARG A 12 -11.147 1.207 14.205 1.00 0.00 H new ATOM 0 HH11 ARG A 12 -13.430 3.882 13.823 1.00 0.00 H new ATOM 0 HH12 ARG A 12 -13.955 3.823 15.509 1.00 0.00 H new ATOM 0 HH21 ARG A 12 -11.829 1.144 16.364 1.00 0.00 H new ATOM 0 HH22 ARG A 12 -13.053 2.281 16.939 1.00 0.00 H new ATOM 148 N ALA A 13 -8.473 2.979 8.751 1.00 0.00 N ATOM 149 CA ALA A 13 -7.173 3.609 8.948 1.00 0.00 C ATOM 150 C ALA A 13 -7.118 4.974 8.272 1.00 0.00 C ATOM 151 O ALA A 13 -7.173 5.074 7.046 1.00 0.00 O ATOM 152 CB ALA A 13 -6.067 2.710 8.419 1.00 0.00 C ATOM 0 H ALA A 13 -8.998 3.337 7.953 1.00 0.00 H new ATOM 0 HA ALA A 13 -7.025 3.757 10.018 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -5.102 3.192 8.572 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -6.086 1.759 8.951 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -6.219 2.534 7.354 1.00 0.00 H new ATOM 158 N ASN A 14 -7.009 6.025 9.079 1.00 0.00 N ATOM 159 CA ASN A 14 -6.947 7.386 8.558 1.00 0.00 C ATOM 160 C ASN A 14 -5.503 7.875 8.490 1.00 0.00 C ATOM 161 O ASN A 14 -5.226 9.055 8.706 1.00 0.00 O ATOM 162 CB ASN A 14 -7.781 8.327 9.431 1.00 0.00 C ATOM 163 CG ASN A 14 -8.837 9.070 8.637 1.00 0.00 C ATOM 164 OD1 ASN A 14 -9.725 8.460 8.042 1.00 0.00 O ATOM 165 ND2 ASN A 14 -8.745 10.395 8.623 1.00 0.00 N ATOM 0 H ASN A 14 -6.962 5.960 10.096 1.00 0.00 H new ATOM 0 HA ASN A 14 -7.357 7.384 7.548 1.00 0.00 H new ATOM 0 HB2 ASN A 14 -8.263 7.752 10.222 1.00 0.00 H new ATOM 0 HB3 ASN A 14 -7.122 9.047 9.916 1.00 0.00 H new ATOM 0 HD21 ASN A 14 -9.427 10.948 8.105 1.00 0.00 H new ATOM 0 HD22 ASN A 14 -7.992 10.859 9.131 1.00 0.00 H new ATOM 172 N SER A 15 -4.587 6.961 8.188 1.00 0.00 N ATOM 173 CA SER A 15 -3.172 7.299 8.091 1.00 0.00 C ATOM 174 C SER A 15 -2.548 6.682 6.841 1.00 0.00 C ATOM 175 O SER A 15 -2.927 5.585 6.426 1.00 0.00 O ATOM 176 CB SER A 15 -2.425 6.820 9.337 1.00 0.00 C ATOM 177 OG SER A 15 -2.511 7.774 10.382 1.00 0.00 O ATOM 0 H SER A 15 -4.799 5.980 8.006 1.00 0.00 H new ATOM 0 HA SER A 15 -3.088 8.383 8.019 1.00 0.00 H new ATOM 0 HB2 SER A 15 -2.842 5.870 9.672 1.00 0.00 H new ATOM 0 HB3 SER A 15 -1.379 6.639 9.091 1.00 0.00 H new ATOM 0 HG SER A 15 -2.027 7.443 11.167 1.00 0.00 H new ATOM 183 N PRO A 16 -1.580 7.379 6.221 1.00 0.00 N ATOM 184 CA PRO A 16 -0.906 6.892 5.014 1.00 0.00 C ATOM 185 C PRO A 16 0.060 5.749 5.310 1.00 0.00 C ATOM 186 O PRO A 16 0.171 4.800 4.534 1.00 0.00 O ATOM 187 CB PRO A 16 -0.143 8.120 4.518 1.00 0.00 C ATOM 188 CG PRO A 16 0.115 8.924 5.744 1.00 0.00 C ATOM 189 CD PRO A 16 -1.067 8.696 6.648 1.00 0.00 C ATOM 0 HA PRO A 16 -1.611 6.487 4.288 1.00 0.00 H new ATOM 0 HB2 PRO A 16 0.788 7.836 4.027 1.00 0.00 H new ATOM 0 HB3 PRO A 16 -0.728 8.683 3.791 1.00 0.00 H new ATOM 0 HG2 PRO A 16 1.041 8.612 6.227 1.00 0.00 H new ATOM 0 HG3 PRO A 16 0.222 9.981 5.502 1.00 0.00 H new ATOM 0 HD2 PRO A 16 -0.774 8.691 7.698 1.00 0.00 H new ATOM 0 HD3 PRO A 16 -1.819 9.477 6.530 1.00 0.00 H new ATOM 197 N GLN A 17 0.757 5.848 6.438 1.00 0.00 N ATOM 198 CA GLN A 17 1.715 4.823 6.836 1.00 0.00 C ATOM 199 C GLN A 17 1.000 3.591 7.379 1.00 0.00 C ATOM 200 O GLN A 17 1.426 2.460 7.144 1.00 0.00 O ATOM 201 CB GLN A 17 2.674 5.376 7.891 1.00 0.00 C ATOM 202 CG GLN A 17 3.486 6.568 7.411 1.00 0.00 C ATOM 203 CD GLN A 17 4.658 6.878 8.320 1.00 0.00 C ATOM 204 OE1 GLN A 17 5.554 6.053 8.502 1.00 0.00 O ATOM 205 NE2 GLN A 17 4.659 8.073 8.898 1.00 0.00 N ATOM 0 H GLN A 17 0.676 6.627 7.092 1.00 0.00 H new ATOM 0 HA GLN A 17 2.284 4.531 5.954 1.00 0.00 H new ATOM 0 HB2 GLN A 17 2.102 5.668 8.772 1.00 0.00 H new ATOM 0 HB3 GLN A 17 3.356 4.584 8.201 1.00 0.00 H new ATOM 0 HG2 GLN A 17 3.854 6.371 6.404 1.00 0.00 H new ATOM 0 HG3 GLN A 17 2.838 7.443 7.348 1.00 0.00 H new ATOM 0 HE21 GLN A 17 3.896 8.726 8.720 1.00 0.00 H new ATOM 0 HE22 GLN A 17 5.422 8.338 9.521 1.00 0.00 H new ATOM 214 N GLU A 18 -0.090 3.816 8.105 1.00 0.00 N ATOM 215 CA GLU A 18 -0.864 2.723 8.680 1.00 0.00 C ATOM 216 C GLU A 18 -1.552 1.908 7.589 1.00 0.00 C ATOM 217 O GLU A 18 -1.479 0.680 7.579 1.00 0.00 O ATOM 218 CB GLU A 18 -1.906 3.267 9.660 1.00 0.00 C ATOM 219 CG GLU A 18 -2.082 2.407 10.901 1.00 0.00 C ATOM 220 CD GLU A 18 -2.912 3.090 11.971 1.00 0.00 C ATOM 221 OE1 GLU A 18 -4.143 3.195 11.791 1.00 0.00 O ATOM 222 OE2 GLU A 18 -2.330 3.520 12.989 1.00 0.00 O ATOM 0 H GLU A 18 -0.457 4.746 8.309 1.00 0.00 H new ATOM 0 HA GLU A 18 -0.177 2.069 9.217 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -1.617 4.273 9.964 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -2.865 3.352 9.148 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -2.558 1.467 10.622 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -1.102 2.160 11.309 1.00 0.00 H new ATOM 229 N ALA A 19 -2.221 2.601 6.673 1.00 0.00 N ATOM 230 CA ALA A 19 -2.921 1.942 5.578 1.00 0.00 C ATOM 231 C ALA A 19 -1.953 1.154 4.700 1.00 0.00 C ATOM 232 O ALA A 19 -2.306 0.113 4.148 1.00 0.00 O ATOM 233 CB ALA A 19 -3.678 2.965 4.744 1.00 0.00 C ATOM 0 H ALA A 19 -2.293 3.618 6.668 1.00 0.00 H new ATOM 0 HA ALA A 19 -3.634 1.239 6.008 1.00 0.00 H new ATOM 0 HB1 ALA A 19 -4.196 2.459 3.930 1.00 0.00 H new ATOM 0 HB2 ALA A 19 -4.405 3.480 5.372 1.00 0.00 H new ATOM 0 HB3 ALA A 19 -2.976 3.690 4.332 1.00 0.00 H new ATOM 239 N LEU A 20 -0.730 1.660 4.577 1.00 0.00 N ATOM 240 CA LEU A 20 0.290 1.004 3.767 1.00 0.00 C ATOM 241 C LEU A 20 0.802 -0.259 4.453 1.00 0.00 C ATOM 242 O LEU A 20 0.815 -1.338 3.860 1.00 0.00 O ATOM 243 CB LEU A 20 1.453 1.962 3.501 1.00 0.00 C ATOM 244 CG LEU A 20 2.574 1.392 2.631 1.00 0.00 C ATOM 245 CD1 LEU A 20 2.235 1.545 1.156 1.00 0.00 C ATOM 246 CD2 LEU A 20 3.896 2.078 2.948 1.00 0.00 C ATOM 0 H LEU A 20 -0.422 2.522 5.028 1.00 0.00 H new ATOM 0 HA LEU A 20 -0.163 0.720 2.817 1.00 0.00 H new ATOM 0 HB2 LEU A 20 1.062 2.860 3.022 1.00 0.00 H new ATOM 0 HB3 LEU A 20 1.876 2.270 4.457 1.00 0.00 H new ATOM 0 HG LEU A 20 2.675 0.330 2.852 1.00 0.00 H new ATOM 0 HD11 LEU A 20 3.044 1.134 0.552 1.00 0.00 H new ATOM 0 HD12 LEU A 20 1.311 1.010 0.938 1.00 0.00 H new ATOM 0 HD13 LEU A 20 2.107 2.601 0.920 1.00 0.00 H new ATOM 0 HD21 LEU A 20 4.683 1.660 2.320 1.00 0.00 H new ATOM 0 HD22 LEU A 20 3.807 3.147 2.755 1.00 0.00 H new ATOM 0 HD23 LEU A 20 4.146 1.919 3.997 1.00 0.00 H new ATOM 258 N LEU A 21 1.222 -0.117 5.705 1.00 0.00 N ATOM 259 CA LEU A 21 1.736 -1.246 6.473 1.00 0.00 C ATOM 260 C LEU A 21 0.678 -2.335 6.612 1.00 0.00 C ATOM 261 O LEU A 21 0.977 -3.524 6.500 1.00 0.00 O ATOM 262 CB LEU A 21 2.192 -0.781 7.858 1.00 0.00 C ATOM 263 CG LEU A 21 2.706 -1.892 8.775 1.00 0.00 C ATOM 264 CD1 LEU A 21 4.182 -2.156 8.520 1.00 0.00 C ATOM 265 CD2 LEU A 21 2.473 -1.527 10.234 1.00 0.00 C ATOM 0 H LEU A 21 1.217 0.769 6.210 1.00 0.00 H new ATOM 0 HA LEU A 21 2.590 -1.661 5.937 1.00 0.00 H new ATOM 0 HB2 LEU A 21 2.980 -0.039 7.734 1.00 0.00 H new ATOM 0 HB3 LEU A 21 1.358 -0.281 8.350 1.00 0.00 H new ATOM 0 HG LEU A 21 2.152 -2.804 8.555 1.00 0.00 H new ATOM 0 HD11 LEU A 21 4.529 -2.949 9.182 1.00 0.00 H new ATOM 0 HD12 LEU A 21 4.323 -2.461 7.483 1.00 0.00 H new ATOM 0 HD13 LEU A 21 4.753 -1.247 8.712 1.00 0.00 H new ATOM 0 HD21 LEU A 21 2.844 -2.328 10.873 1.00 0.00 H new ATOM 0 HD22 LEU A 21 3.001 -0.603 10.467 1.00 0.00 H new ATOM 0 HD23 LEU A 21 1.406 -1.389 10.409 1.00 0.00 H new ATOM 277 N TRP A 22 -0.562 -1.922 6.859 1.00 0.00 N ATOM 278 CA TRP A 22 -1.664 -2.863 7.014 1.00 0.00 C ATOM 279 C TRP A 22 -1.999 -3.535 5.685 1.00 0.00 C ATOM 280 O TRP A 22 -2.451 -4.679 5.654 1.00 0.00 O ATOM 281 CB TRP A 22 -2.900 -2.147 7.562 1.00 0.00 C ATOM 282 CG TRP A 22 -3.853 -3.062 8.268 1.00 0.00 C ATOM 283 CD1 TRP A 22 -3.703 -3.599 9.515 1.00 0.00 C ATOM 284 CD2 TRP A 22 -5.103 -3.551 7.768 1.00 0.00 C ATOM 285 NE1 TRP A 22 -4.784 -4.391 9.821 1.00 0.00 N ATOM 286 CE2 TRP A 22 -5.656 -4.377 8.764 1.00 0.00 C ATOM 287 CE3 TRP A 22 -5.808 -3.368 6.575 1.00 0.00 C ATOM 288 CZ2 TRP A 22 -6.882 -5.019 8.604 1.00 0.00 C ATOM 289 CZ3 TRP A 22 -7.024 -4.007 6.417 1.00 0.00 C ATOM 290 CH2 TRP A 22 -7.551 -4.823 7.426 1.00 0.00 C ATOM 0 H TRP A 22 -0.828 -0.942 6.956 1.00 0.00 H new ATOM 0 HA TRP A 22 -1.354 -3.632 7.721 1.00 0.00 H new ATOM 0 HB2 TRP A 22 -2.582 -1.364 8.251 1.00 0.00 H new ATOM 0 HB3 TRP A 22 -3.421 -1.656 6.740 1.00 0.00 H new ATOM 0 HD1 TRP A 22 -2.858 -3.426 10.166 1.00 0.00 H new ATOM 0 HE1 TRP A 22 -4.916 -4.905 10.692 1.00 0.00 H new ATOM 0 HE3 TRP A 22 -5.411 -2.740 5.792 1.00 0.00 H new ATOM 0 HZ2 TRP A 22 -7.290 -5.648 9.381 1.00 0.00 H new ATOM 0 HZ3 TRP A 22 -7.577 -3.874 5.499 1.00 0.00 H new ATOM 0 HH2 TRP A 22 -8.504 -5.307 7.272 1.00 0.00 H new ATOM 301 N ALA A 23 -1.777 -2.815 4.590 1.00 0.00 N ATOM 302 CA ALA A 23 -2.055 -3.340 3.260 1.00 0.00 C ATOM 303 C ALA A 23 -1.041 -4.410 2.869 1.00 0.00 C ATOM 304 O ALA A 23 -1.379 -5.384 2.196 1.00 0.00 O ATOM 305 CB ALA A 23 -2.059 -2.214 2.237 1.00 0.00 C ATOM 0 H ALA A 23 -1.405 -1.865 4.599 1.00 0.00 H new ATOM 0 HA ALA A 23 -3.042 -3.802 3.278 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -2.268 -2.622 1.248 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -2.827 -1.487 2.499 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -1.085 -1.726 2.230 1.00 0.00 H new ATOM 311 N LEU A 24 0.204 -4.222 3.293 1.00 0.00 N ATOM 312 CA LEU A 24 1.268 -5.171 2.986 1.00 0.00 C ATOM 313 C LEU A 24 1.112 -6.448 3.804 1.00 0.00 C ATOM 314 O LEU A 24 1.322 -7.551 3.299 1.00 0.00 O ATOM 315 CB LEU A 24 2.636 -4.541 3.258 1.00 0.00 C ATOM 316 CG LEU A 24 2.968 -3.319 2.399 1.00 0.00 C ATOM 317 CD1 LEU A 24 4.311 -2.731 2.804 1.00 0.00 C ATOM 318 CD2 LEU A 24 2.970 -3.692 0.924 1.00 0.00 C ATOM 0 H LEU A 24 0.501 -3.421 3.850 1.00 0.00 H new ATOM 0 HA LEU A 24 1.197 -5.428 1.929 1.00 0.00 H new ATOM 0 HB2 LEU A 24 2.684 -4.252 4.308 1.00 0.00 H new ATOM 0 HB3 LEU A 24 3.405 -5.297 3.100 1.00 0.00 H new ATOM 0 HG LEU A 24 2.200 -2.563 2.562 1.00 0.00 H new ATOM 0 HD11 LEU A 24 4.530 -1.863 2.182 1.00 0.00 H new ATOM 0 HD12 LEU A 24 4.275 -2.428 3.850 1.00 0.00 H new ATOM 0 HD13 LEU A 24 5.091 -3.480 2.670 1.00 0.00 H new ATOM 0 HD21 LEU A 24 3.208 -2.812 0.326 1.00 0.00 H new ATOM 0 HD22 LEU A 24 3.718 -4.465 0.745 1.00 0.00 H new ATOM 0 HD23 LEU A 24 1.986 -4.067 0.642 1.00 0.00 H new ATOM 330 N ASN A 25 0.740 -6.293 5.071 1.00 0.00 N ATOM 331 CA ASN A 25 0.555 -7.435 5.958 1.00 0.00 C ATOM 332 C ASN A 25 -0.681 -8.237 5.562 1.00 0.00 C ATOM 333 O ASN A 25 -0.725 -9.455 5.735 1.00 0.00 O ATOM 334 CB ASN A 25 0.428 -6.965 7.408 1.00 0.00 C ATOM 335 CG ASN A 25 1.772 -6.654 8.036 1.00 0.00 C ATOM 336 OD1 ASN A 25 2.788 -7.253 7.682 1.00 0.00 O ATOM 337 ND2 ASN A 25 1.785 -5.715 8.974 1.00 0.00 N ATOM 0 H ASN A 25 0.561 -5.388 5.506 1.00 0.00 H new ATOM 0 HA ASN A 25 1.429 -8.080 5.867 1.00 0.00 H new ATOM 0 HB2 ASN A 25 -0.201 -6.076 7.445 1.00 0.00 H new ATOM 0 HB3 ASN A 25 -0.074 -7.735 7.994 1.00 0.00 H new ATOM 0 HD21 ASN A 25 2.661 -5.464 9.433 1.00 0.00 H new ATOM 0 HD22 ASN A 25 0.919 -5.244 9.236 1.00 0.00 H new ATOM 344 N ASP A 26 -1.681 -7.544 5.028 1.00 0.00 N ATOM 345 CA ASP A 26 -2.919 -8.191 4.605 1.00 0.00 C ATOM 346 C ASP A 26 -2.652 -9.225 3.516 1.00 0.00 C ATOM 347 O ASP A 26 -3.385 -10.205 3.384 1.00 0.00 O ATOM 348 CB ASP A 26 -3.916 -7.147 4.098 1.00 0.00 C ATOM 349 CG ASP A 26 -5.349 -7.637 4.162 1.00 0.00 C ATOM 350 OD1 ASP A 26 -5.823 -7.941 5.278 1.00 0.00 O ATOM 351 OD2 ASP A 26 -5.998 -7.716 3.099 1.00 0.00 O ATOM 0 H ASP A 26 -1.659 -6.535 4.878 1.00 0.00 H new ATOM 0 HA ASP A 26 -3.344 -8.703 5.469 1.00 0.00 H new ATOM 0 HB2 ASP A 26 -3.819 -6.238 4.691 1.00 0.00 H new ATOM 0 HB3 ASP A 26 -3.671 -6.884 3.069 1.00 0.00 H new ATOM 356 N LEU A 27 -1.598 -9.001 2.735 1.00 0.00 N ATOM 357 CA LEU A 27 -1.237 -9.914 1.657 1.00 0.00 C ATOM 358 C LEU A 27 -0.988 -11.320 2.192 1.00 0.00 C ATOM 359 O LEU A 27 -0.572 -11.495 3.338 1.00 0.00 O ATOM 360 CB LEU A 27 0.009 -9.406 0.927 1.00 0.00 C ATOM 361 CG LEU A 27 -0.217 -8.183 0.036 1.00 0.00 C ATOM 362 CD1 LEU A 27 1.024 -7.303 0.015 1.00 0.00 C ATOM 363 CD2 LEU A 27 -0.590 -8.615 -1.374 1.00 0.00 C ATOM 0 H LEU A 27 -0.980 -8.195 2.830 1.00 0.00 H new ATOM 0 HA LEU A 27 -2.071 -9.955 0.956 1.00 0.00 H new ATOM 0 HB2 LEU A 27 0.771 -9.162 1.667 1.00 0.00 H new ATOM 0 HB3 LEU A 27 0.408 -10.215 0.314 1.00 0.00 H new ATOM 0 HG LEU A 27 -1.043 -7.603 0.448 1.00 0.00 H new ATOM 0 HD11 LEU A 27 0.846 -6.438 -0.624 1.00 0.00 H new ATOM 0 HD12 LEU A 27 1.249 -6.967 1.027 1.00 0.00 H new ATOM 0 HD13 LEU A 27 1.868 -7.873 -0.374 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -0.747 -7.733 -1.995 1.00 0.00 H new ATOM 0 HD22 LEU A 27 0.215 -9.217 -1.795 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -1.506 -9.205 -1.343 1.00 0.00 H new ATOM 375 N GLU A 28 -1.246 -12.320 1.356 1.00 0.00 N ATOM 376 CA GLU A 28 -1.049 -13.712 1.744 1.00 0.00 C ATOM 377 C GLU A 28 0.331 -14.204 1.321 1.00 0.00 C ATOM 378 O GLU A 28 1.176 -13.419 0.890 1.00 0.00 O ATOM 379 CB GLU A 28 -2.132 -14.595 1.120 1.00 0.00 C ATOM 380 CG GLU A 28 -3.541 -14.060 1.317 1.00 0.00 C ATOM 381 CD GLU A 28 -4.469 -14.431 0.178 1.00 0.00 C ATOM 382 OE1 GLU A 28 -4.179 -15.422 -0.526 1.00 0.00 O ATOM 383 OE2 GLU A 28 -5.487 -13.732 -0.012 1.00 0.00 O ATOM 0 H GLU A 28 -1.592 -12.192 0.405 1.00 0.00 H new ATOM 0 HA GLU A 28 -1.120 -13.775 2.830 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -1.936 -14.696 0.052 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -2.068 -15.594 1.551 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -3.946 -14.448 2.252 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -3.504 -12.975 1.412 1.00 0.00 H new ATOM 390 N GLU A 29 0.553 -15.509 1.447 1.00 0.00 N ATOM 391 CA GLU A 29 1.831 -16.105 1.079 1.00 0.00 C ATOM 392 C GLU A 29 1.998 -16.142 -0.437 1.00 0.00 C ATOM 393 O GLU A 29 2.980 -15.631 -0.977 1.00 0.00 O ATOM 394 CB GLU A 29 1.941 -17.520 1.649 1.00 0.00 C ATOM 395 CG GLU A 29 2.626 -17.578 3.005 1.00 0.00 C ATOM 396 CD GLU A 29 1.640 -17.676 4.153 1.00 0.00 C ATOM 397 OE1 GLU A 29 0.541 -18.230 3.945 1.00 0.00 O ATOM 398 OE2 GLU A 29 1.968 -17.199 5.259 1.00 0.00 O ATOM 0 H GLU A 29 -0.136 -16.173 1.801 1.00 0.00 H new ATOM 0 HA GLU A 29 2.625 -15.488 1.500 1.00 0.00 H new ATOM 0 HB2 GLU A 29 0.942 -17.946 1.738 1.00 0.00 H new ATOM 0 HB3 GLU A 29 2.492 -18.144 0.946 1.00 0.00 H new ATOM 0 HG2 GLU A 29 3.297 -18.437 3.033 1.00 0.00 H new ATOM 0 HG3 GLU A 29 3.242 -16.688 3.135 1.00 0.00 H new ATOM 405 N ASN A 30 1.033 -16.751 -1.119 1.00 0.00 N ATOM 406 CA ASN A 30 1.074 -16.857 -2.573 1.00 0.00 C ATOM 407 C ASN A 30 0.992 -15.478 -3.223 1.00 0.00 C ATOM 408 O ASN A 30 1.545 -15.256 -4.300 1.00 0.00 O ATOM 409 CB ASN A 30 -0.073 -17.740 -3.071 1.00 0.00 C ATOM 410 CG ASN A 30 0.383 -18.744 -4.112 1.00 0.00 C ATOM 411 OD1 ASN A 30 0.911 -19.805 -3.779 1.00 0.00 O ATOM 412 ND2 ASN A 30 0.180 -18.413 -5.383 1.00 0.00 N ATOM 0 H ASN A 30 0.213 -17.178 -0.688 1.00 0.00 H new ATOM 0 HA ASN A 30 2.023 -17.313 -2.854 1.00 0.00 H new ATOM 0 HB2 ASN A 30 -0.513 -18.270 -2.227 1.00 0.00 H new ATOM 0 HB3 ASN A 30 -0.855 -17.110 -3.495 1.00 0.00 H new ATOM 0 HD21 ASN A 30 0.466 -19.049 -6.128 1.00 0.00 H new ATOM 0 HD22 ASN A 30 -0.261 -17.523 -5.614 1.00 0.00 H new ATOM 419 N SER A 31 0.299 -14.557 -2.563 1.00 0.00 N ATOM 420 CA SER A 31 0.146 -13.201 -3.078 1.00 0.00 C ATOM 421 C SER A 31 1.455 -12.427 -2.975 1.00 0.00 C ATOM 422 O SER A 31 1.861 -11.745 -3.917 1.00 0.00 O ATOM 423 CB SER A 31 -0.957 -12.465 -2.314 1.00 0.00 C ATOM 424 OG SER A 31 -2.208 -12.601 -2.967 1.00 0.00 O ATOM 0 H SER A 31 -0.166 -14.724 -1.671 1.00 0.00 H new ATOM 0 HA SER A 31 -0.132 -13.269 -4.130 1.00 0.00 H new ATOM 0 HB2 SER A 31 -1.027 -12.860 -1.301 1.00 0.00 H new ATOM 0 HB3 SER A 31 -0.701 -11.409 -2.227 1.00 0.00 H new ATOM 0 HG SER A 31 -2.896 -12.123 -2.458 1.00 0.00 H new ATOM 430 N PHE A 32 2.113 -12.535 -1.825 1.00 0.00 N ATOM 431 CA PHE A 32 3.378 -11.843 -1.601 1.00 0.00 C ATOM 432 C PHE A 32 4.507 -12.501 -2.388 1.00 0.00 C ATOM 433 O PHE A 32 5.445 -11.833 -2.821 1.00 0.00 O ATOM 434 CB PHE A 32 3.720 -11.834 -0.110 1.00 0.00 C ATOM 435 CG PHE A 32 4.601 -10.687 0.295 1.00 0.00 C ATOM 436 CD1 PHE A 32 4.202 -9.379 0.076 1.00 0.00 C ATOM 437 CD2 PHE A 32 5.829 -10.918 0.894 1.00 0.00 C ATOM 438 CE1 PHE A 32 5.011 -8.322 0.446 1.00 0.00 C ATOM 439 CE2 PHE A 32 6.643 -9.865 1.266 1.00 0.00 C ATOM 440 CZ PHE A 32 6.233 -8.565 1.043 1.00 0.00 C ATOM 0 H PHE A 32 1.792 -13.094 -1.035 1.00 0.00 H new ATOM 0 HA PHE A 32 3.268 -10.816 -1.949 1.00 0.00 H new ATOM 0 HB2 PHE A 32 2.796 -11.793 0.467 1.00 0.00 H new ATOM 0 HB3 PHE A 32 4.215 -12.771 0.147 1.00 0.00 H new ATOM 0 HD1 PHE A 32 3.247 -9.183 -0.389 1.00 0.00 H new ATOM 0 HD2 PHE A 32 6.154 -11.933 1.072 1.00 0.00 H new ATOM 0 HE1 PHE A 32 4.688 -7.307 0.269 1.00 0.00 H new ATOM 0 HE2 PHE A 32 7.599 -10.058 1.731 1.00 0.00 H new ATOM 0 HZ PHE A 32 6.866 -7.740 1.335 1.00 0.00 H new ATOM 450 N LYS A 33 4.408 -13.814 -2.569 1.00 0.00 N ATOM 451 CA LYS A 33 5.422 -14.562 -3.304 1.00 0.00 C ATOM 452 C LYS A 33 5.448 -14.151 -4.774 1.00 0.00 C ATOM 453 O LYS A 33 6.490 -14.213 -5.427 1.00 0.00 O ATOM 454 CB LYS A 33 5.160 -16.065 -3.188 1.00 0.00 C ATOM 455 CG LYS A 33 5.934 -16.734 -2.063 1.00 0.00 C ATOM 456 CD LYS A 33 5.443 -18.151 -1.817 1.00 0.00 C ATOM 457 CE LYS A 33 6.589 -19.082 -1.453 1.00 0.00 C ATOM 458 NZ LYS A 33 6.209 -20.514 -1.597 1.00 0.00 N ATOM 0 H LYS A 33 3.637 -14.382 -2.217 1.00 0.00 H new ATOM 0 HA LYS A 33 6.393 -14.333 -2.866 1.00 0.00 H new ATOM 0 HB2 LYS A 33 4.094 -16.228 -3.031 1.00 0.00 H new ATOM 0 HB3 LYS A 33 5.420 -16.544 -4.132 1.00 0.00 H new ATOM 0 HG2 LYS A 33 6.995 -16.753 -2.311 1.00 0.00 H new ATOM 0 HG3 LYS A 33 5.831 -16.148 -1.150 1.00 0.00 H new ATOM 0 HD2 LYS A 33 4.706 -18.148 -1.014 1.00 0.00 H new ATOM 0 HD3 LYS A 33 4.940 -18.523 -2.709 1.00 0.00 H new ATOM 0 HE2 LYS A 33 7.447 -18.868 -2.091 1.00 0.00 H new ATOM 0 HE3 LYS A 33 6.900 -18.891 -0.426 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 7.018 -21.115 -1.339 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 5.407 -20.725 -0.970 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 5.937 -20.704 -2.583 1.00 0.00 H new ATOM 472 N THR A 34 4.296 -13.733 -5.287 1.00 0.00 N ATOM 473 CA THR A 34 4.189 -13.313 -6.680 1.00 0.00 C ATOM 474 C THR A 34 4.370 -11.804 -6.815 1.00 0.00 C ATOM 475 O THR A 34 4.834 -11.315 -7.844 1.00 0.00 O ATOM 476 CB THR A 34 2.834 -13.728 -7.255 1.00 0.00 C ATOM 477 OG1 THR A 34 2.516 -15.057 -6.882 1.00 0.00 O ATOM 478 CG2 THR A 34 2.774 -13.648 -8.765 1.00 0.00 C ATOM 0 H THR A 34 3.424 -13.676 -4.760 1.00 0.00 H new ATOM 0 HA THR A 34 4.983 -13.805 -7.241 1.00 0.00 H new ATOM 0 HB THR A 34 2.116 -13.019 -6.841 1.00 0.00 H new ATOM 0 HG1 THR A 34 2.165 -15.065 -5.967 1.00 0.00 H new ATOM 0 HG21 THR A 34 1.786 -13.956 -9.107 1.00 0.00 H new ATOM 0 HG22 THR A 34 2.965 -12.623 -9.083 1.00 0.00 H new ATOM 0 HG23 THR A 34 3.528 -14.307 -9.195 1.00 0.00 H new ATOM 486 N LEU A 35 3.998 -11.071 -5.770 1.00 0.00 N ATOM 487 CA LEU A 35 4.119 -9.619 -5.775 1.00 0.00 C ATOM 488 C LEU A 35 5.552 -9.186 -5.475 1.00 0.00 C ATOM 489 O LEU A 35 6.016 -8.161 -5.974 1.00 0.00 O ATOM 490 CB LEU A 35 3.165 -9.005 -4.747 1.00 0.00 C ATOM 491 CG LEU A 35 3.126 -7.475 -4.733 1.00 0.00 C ATOM 492 CD1 LEU A 35 1.969 -6.962 -5.577 1.00 0.00 C ATOM 493 CD2 LEU A 35 3.017 -6.957 -3.306 1.00 0.00 C ATOM 0 H LEU A 35 3.611 -11.459 -4.910 1.00 0.00 H new ATOM 0 HA LEU A 35 3.854 -9.263 -6.770 1.00 0.00 H new ATOM 0 HB2 LEU A 35 2.159 -9.377 -4.940 1.00 0.00 H new ATOM 0 HB3 LEU A 35 3.450 -9.355 -3.755 1.00 0.00 H new ATOM 0 HG LEU A 35 4.056 -7.104 -5.164 1.00 0.00 H new ATOM 0 HD11 LEU A 35 1.958 -5.872 -5.555 1.00 0.00 H new ATOM 0 HD12 LEU A 35 2.090 -7.303 -6.605 1.00 0.00 H new ATOM 0 HD13 LEU A 35 1.030 -7.343 -5.176 1.00 0.00 H new ATOM 0 HD21 LEU A 35 2.991 -5.867 -3.315 1.00 0.00 H new ATOM 0 HD22 LEU A 35 2.104 -7.338 -2.849 1.00 0.00 H new ATOM 0 HD23 LEU A 35 3.879 -7.294 -2.730 1.00 0.00 H new ATOM 505 N LYS A 36 6.246 -9.972 -4.658 1.00 0.00 N ATOM 506 CA LYS A 36 7.626 -9.669 -4.290 1.00 0.00 C ATOM 507 C LYS A 36 8.496 -9.462 -5.528 1.00 0.00 C ATOM 508 O LYS A 36 9.112 -8.409 -5.695 1.00 0.00 O ATOM 509 CB LYS A 36 8.203 -10.795 -3.428 1.00 0.00 C ATOM 510 CG LYS A 36 8.307 -10.440 -1.954 1.00 0.00 C ATOM 511 CD LYS A 36 9.532 -9.585 -1.672 1.00 0.00 C ATOM 512 CE LYS A 36 9.705 -9.331 -0.184 1.00 0.00 C ATOM 513 NZ LYS A 36 10.175 -10.545 0.537 1.00 0.00 N ATOM 0 H LYS A 36 5.876 -10.824 -4.238 1.00 0.00 H new ATOM 0 HA LYS A 36 7.624 -8.742 -3.716 1.00 0.00 H new ATOM 0 HB2 LYS A 36 7.578 -11.681 -3.537 1.00 0.00 H new ATOM 0 HB3 LYS A 36 9.193 -11.056 -3.801 1.00 0.00 H new ATOM 0 HG2 LYS A 36 7.409 -9.905 -1.643 1.00 0.00 H new ATOM 0 HG3 LYS A 36 8.355 -11.353 -1.361 1.00 0.00 H new ATOM 0 HD2 LYS A 36 10.421 -10.081 -2.063 1.00 0.00 H new ATOM 0 HD3 LYS A 36 9.441 -8.634 -2.196 1.00 0.00 H new ATOM 0 HE2 LYS A 36 10.419 -8.521 -0.035 1.00 0.00 H new ATOM 0 HE3 LYS A 36 8.757 -9.002 0.240 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 10.629 -10.265 1.430 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 9.364 -11.164 0.740 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 10.861 -11.056 -0.054 1.00 0.00 H new ATOM 527 N PHE A 37 8.543 -10.472 -6.389 1.00 0.00 N ATOM 528 CA PHE A 37 9.341 -10.402 -7.609 1.00 0.00 C ATOM 529 C PHE A 37 8.932 -9.204 -8.465 1.00 0.00 C ATOM 530 O PHE A 37 9.739 -8.670 -9.226 1.00 0.00 O ATOM 531 CB PHE A 37 9.196 -11.696 -8.414 1.00 0.00 C ATOM 532 CG PHE A 37 10.492 -12.428 -8.611 1.00 0.00 C ATOM 533 CD1 PHE A 37 11.552 -11.821 -9.267 1.00 0.00 C ATOM 534 CD2 PHE A 37 10.652 -13.721 -8.142 1.00 0.00 C ATOM 535 CE1 PHE A 37 12.747 -12.491 -9.449 1.00 0.00 C ATOM 536 CE2 PHE A 37 11.844 -14.397 -8.322 1.00 0.00 C ATOM 537 CZ PHE A 37 12.893 -13.780 -8.977 1.00 0.00 C ATOM 0 H PHE A 37 8.038 -11.350 -6.265 1.00 0.00 H new ATOM 0 HA PHE A 37 10.385 -10.277 -7.322 1.00 0.00 H new ATOM 0 HB2 PHE A 37 8.490 -12.353 -7.906 1.00 0.00 H new ATOM 0 HB3 PHE A 37 8.768 -11.462 -9.389 1.00 0.00 H new ATOM 0 HD1 PHE A 37 11.443 -10.813 -9.640 1.00 0.00 H new ATOM 0 HD2 PHE A 37 9.835 -14.207 -7.629 1.00 0.00 H new ATOM 0 HE1 PHE A 37 13.566 -12.007 -9.960 1.00 0.00 H new ATOM 0 HE2 PHE A 37 11.955 -15.405 -7.952 1.00 0.00 H new ATOM 0 HZ PHE A 37 13.826 -14.306 -9.119 1.00 0.00 H new ATOM 547 N HIS A 38 7.677 -8.785 -8.333 1.00 0.00 N ATOM 548 CA HIS A 38 7.166 -7.652 -9.095 1.00 0.00 C ATOM 549 C HIS A 38 7.659 -6.333 -8.507 1.00 0.00 C ATOM 550 O HIS A 38 7.815 -5.343 -9.222 1.00 0.00 O ATOM 551 CB HIS A 38 5.636 -7.672 -9.116 1.00 0.00 C ATOM 552 CG HIS A 38 5.062 -8.710 -10.031 1.00 0.00 C ATOM 553 ND1 HIS A 38 5.696 -9.170 -11.164 1.00 0.00 N ATOM 554 CD2 HIS A 38 3.884 -9.379 -9.962 1.00 0.00 C ATOM 555 CE1 HIS A 38 4.900 -10.084 -11.736 1.00 0.00 C ATOM 556 NE2 HIS A 38 3.789 -10.249 -11.045 1.00 0.00 N ATOM 0 H HIS A 38 6.996 -9.213 -7.706 1.00 0.00 H new ATOM 0 HA HIS A 38 7.538 -7.737 -10.116 1.00 0.00 H new ATOM 0 HB2 HIS A 38 5.269 -7.848 -8.105 1.00 0.00 H new ATOM 0 HB3 HIS A 38 5.272 -6.691 -9.420 1.00 0.00 H new ATOM 0 HD2 HIS A 38 3.139 -9.256 -9.190 1.00 0.00 H new ATOM 0 HE1 HIS A 38 5.138 -10.616 -12.645 1.00 0.00 H new ATOM 0 HE2 HIS A 38 3.019 -10.883 -11.260 1.00 0.00 H new ATOM 564 N LEU A 39 7.898 -6.325 -7.199 1.00 0.00 N ATOM 565 CA LEU A 39 8.371 -5.128 -6.514 1.00 0.00 C ATOM 566 C LEU A 39 9.699 -4.652 -7.096 1.00 0.00 C ATOM 567 O LEU A 39 9.868 -3.471 -7.398 1.00 0.00 O ATOM 568 CB LEU A 39 8.527 -5.399 -5.017 1.00 0.00 C ATOM 569 CG LEU A 39 7.223 -5.681 -4.270 1.00 0.00 C ATOM 570 CD1 LEU A 39 7.505 -6.386 -2.952 1.00 0.00 C ATOM 571 CD2 LEU A 39 6.457 -4.389 -4.032 1.00 0.00 C ATOM 0 H LEU A 39 7.772 -7.135 -6.592 1.00 0.00 H new ATOM 0 HA LEU A 39 7.630 -4.343 -6.660 1.00 0.00 H new ATOM 0 HB2 LEU A 39 9.195 -6.251 -4.885 1.00 0.00 H new ATOM 0 HB3 LEU A 39 9.013 -4.539 -4.556 1.00 0.00 H new ATOM 0 HG LEU A 39 6.608 -6.338 -4.885 1.00 0.00 H new ATOM 0 HD11 LEU A 39 6.565 -6.579 -2.434 1.00 0.00 H new ATOM 0 HD12 LEU A 39 8.013 -7.331 -3.146 1.00 0.00 H new ATOM 0 HD13 LEU A 39 8.139 -5.754 -2.330 1.00 0.00 H new ATOM 0 HD21 LEU A 39 5.531 -4.608 -3.499 1.00 0.00 H new ATOM 0 HD22 LEU A 39 7.066 -3.709 -3.437 1.00 0.00 H new ATOM 0 HD23 LEU A 39 6.223 -3.923 -4.989 1.00 0.00 H new ATOM 583 N ARG A 40 10.639 -5.580 -7.248 1.00 0.00 N ATOM 584 CA ARG A 40 11.955 -5.257 -7.790 1.00 0.00 C ATOM 585 C ARG A 40 11.838 -4.602 -9.162 1.00 0.00 C ATOM 586 O ARG A 40 12.661 -3.764 -9.534 1.00 0.00 O ATOM 587 CB ARG A 40 12.812 -6.520 -7.888 1.00 0.00 C ATOM 588 CG ARG A 40 14.299 -6.239 -8.022 1.00 0.00 C ATOM 589 CD ARG A 40 14.714 -6.122 -9.480 1.00 0.00 C ATOM 590 NE ARG A 40 15.099 -7.412 -10.044 1.00 0.00 N ATOM 591 CZ ARG A 40 15.478 -7.586 -11.309 1.00 0.00 C ATOM 592 NH1 ARG A 40 15.522 -6.553 -12.142 1.00 0.00 N ATOM 593 NH2 ARG A 40 15.813 -8.793 -11.741 1.00 0.00 N ATOM 0 H ARG A 40 10.514 -6.562 -7.003 1.00 0.00 H new ATOM 0 HA ARG A 40 12.433 -4.550 -7.112 1.00 0.00 H new ATOM 0 HB2 ARG A 40 12.645 -7.132 -7.001 1.00 0.00 H new ATOM 0 HB3 ARG A 40 12.483 -7.106 -8.746 1.00 0.00 H new ATOM 0 HG2 ARG A 40 14.545 -5.316 -7.497 1.00 0.00 H new ATOM 0 HG3 ARG A 40 14.866 -7.038 -7.544 1.00 0.00 H new ATOM 0 HD2 ARG A 40 13.890 -5.704 -10.059 1.00 0.00 H new ATOM 0 HD3 ARG A 40 15.548 -5.426 -9.565 1.00 0.00 H new ATOM 0 HE ARG A 40 15.076 -8.229 -9.433 1.00 0.00 H new ATOM 0 HH11 ARG A 40 15.265 -5.622 -11.814 1.00 0.00 H new ATOM 0 HH12 ARG A 40 15.813 -6.690 -13.110 1.00 0.00 H new ATOM 0 HH21 ARG A 40 15.781 -9.590 -11.105 1.00 0.00 H new ATOM 0 HH22 ARG A 40 16.103 -8.926 -12.710 1.00 0.00 H new ATOM 607 N ASP A 41 10.811 -4.988 -9.912 1.00 0.00 N ATOM 608 CA ASP A 41 10.588 -4.439 -11.245 1.00 0.00 C ATOM 609 C ASP A 41 10.204 -2.964 -11.171 1.00 0.00 C ATOM 610 O ASP A 41 10.889 -2.106 -11.728 1.00 0.00 O ATOM 611 CB ASP A 41 9.492 -5.227 -11.965 1.00 0.00 C ATOM 612 CG ASP A 41 9.755 -5.354 -13.453 1.00 0.00 C ATOM 613 OD1 ASP A 41 9.808 -4.312 -14.138 1.00 0.00 O ATOM 614 OD2 ASP A 41 9.907 -6.498 -13.932 1.00 0.00 O ATOM 0 H ASP A 41 10.120 -5.679 -9.620 1.00 0.00 H new ATOM 0 HA ASP A 41 11.518 -4.525 -11.806 1.00 0.00 H new ATOM 0 HB2 ASP A 41 9.415 -6.222 -11.526 1.00 0.00 H new ATOM 0 HB3 ASP A 41 8.532 -4.735 -11.809 1.00 0.00 H new ATOM 619 N VAL A 42 9.105 -2.677 -10.481 1.00 0.00 N ATOM 620 CA VAL A 42 8.629 -1.306 -10.337 1.00 0.00 C ATOM 621 C VAL A 42 9.646 -0.441 -9.600 1.00 0.00 C ATOM 622 O VAL A 42 9.762 0.756 -9.861 1.00 0.00 O ATOM 623 CB VAL A 42 7.286 -1.256 -9.583 1.00 0.00 C ATOM 624 CG1 VAL A 42 6.197 -1.950 -10.385 1.00 0.00 C ATOM 625 CG2 VAL A 42 7.424 -1.881 -8.203 1.00 0.00 C ATOM 0 H VAL A 42 8.527 -3.375 -10.013 1.00 0.00 H new ATOM 0 HA VAL A 42 8.489 -0.914 -11.344 1.00 0.00 H new ATOM 0 HB VAL A 42 7.001 -0.212 -9.456 1.00 0.00 H new ATOM 0 HG11 VAL A 42 5.256 -1.904 -9.837 1.00 0.00 H new ATOM 0 HG12 VAL A 42 6.080 -1.452 -11.347 1.00 0.00 H new ATOM 0 HG13 VAL A 42 6.472 -2.992 -10.547 1.00 0.00 H new ATOM 0 HG21 VAL A 42 6.466 -1.836 -7.686 1.00 0.00 H new ATOM 0 HG22 VAL A 42 7.734 -2.921 -8.304 1.00 0.00 H new ATOM 0 HG23 VAL A 42 8.172 -1.334 -7.629 1.00 0.00 H new ATOM 635 N THR A 43 10.381 -1.053 -8.675 1.00 0.00 N ATOM 636 CA THR A 43 11.386 -0.334 -7.902 1.00 0.00 C ATOM 637 C THR A 43 12.696 -0.222 -8.677 1.00 0.00 C ATOM 638 O THR A 43 12.999 0.823 -9.252 1.00 0.00 O ATOM 639 CB THR A 43 11.629 -1.034 -6.564 1.00 0.00 C ATOM 640 OG1 THR A 43 12.012 -2.383 -6.766 1.00 0.00 O ATOM 641 CG2 THR A 43 10.418 -1.032 -5.656 1.00 0.00 C ATOM 0 H THR A 43 10.299 -2.043 -8.444 1.00 0.00 H new ATOM 0 HA THR A 43 11.010 0.672 -7.715 1.00 0.00 H new ATOM 0 HB THR A 43 12.424 -0.465 -6.082 1.00 0.00 H new ATOM 0 HG1 THR A 43 11.224 -2.914 -7.007 1.00 0.00 H new ATOM 0 HG21 THR A 43 10.660 -1.545 -4.725 1.00 0.00 H new ATOM 0 HG22 THR A 43 10.127 -0.004 -5.439 1.00 0.00 H new ATOM 0 HG23 THR A 43 9.593 -1.546 -6.149 1.00 0.00 H new ATOM 649 N GLN A 44 13.467 -1.304 -8.688 1.00 0.00 N ATOM 650 CA GLN A 44 14.745 -1.325 -9.392 1.00 0.00 C ATOM 651 C GLN A 44 15.682 -0.249 -8.851 1.00 0.00 C ATOM 652 O GLN A 44 16.523 0.280 -9.578 1.00 0.00 O ATOM 653 CB GLN A 44 14.525 -1.124 -10.894 1.00 0.00 C ATOM 654 CG GLN A 44 14.525 -2.420 -11.687 1.00 0.00 C ATOM 655 CD GLN A 44 14.997 -2.230 -13.115 1.00 0.00 C ATOM 656 OE1 GLN A 44 16.195 -2.258 -13.394 1.00 0.00 O ATOM 657 NE2 GLN A 44 14.053 -2.034 -14.029 1.00 0.00 N ATOM 0 H GLN A 44 13.230 -2.178 -8.218 1.00 0.00 H new ATOM 0 HA GLN A 44 15.209 -2.298 -9.227 1.00 0.00 H new ATOM 0 HB2 GLN A 44 13.575 -0.613 -11.048 1.00 0.00 H new ATOM 0 HB3 GLN A 44 15.305 -0.470 -11.283 1.00 0.00 H new ATOM 0 HG2 GLN A 44 15.168 -3.146 -11.189 1.00 0.00 H new ATOM 0 HG3 GLN A 44 13.518 -2.838 -11.694 1.00 0.00 H new ATOM 0 HE21 GLN A 44 13.071 -2.018 -13.753 1.00 0.00 H new ATOM 0 HE22 GLN A 44 14.310 -1.899 -15.007 1.00 0.00 H new ATOM 666 N PHE A 45 15.531 0.069 -7.569 1.00 0.00 N ATOM 667 CA PHE A 45 16.363 1.081 -6.930 1.00 0.00 C ATOM 668 C PHE A 45 17.164 0.480 -5.779 1.00 0.00 C ATOM 669 O PHE A 45 16.638 0.269 -4.687 1.00 0.00 O ATOM 670 CB PHE A 45 15.498 2.232 -6.415 1.00 0.00 C ATOM 671 CG PHE A 45 16.252 3.519 -6.241 1.00 0.00 C ATOM 672 CD1 PHE A 45 16.471 4.360 -7.320 1.00 0.00 C ATOM 673 CD2 PHE A 45 16.741 3.888 -4.998 1.00 0.00 C ATOM 674 CE1 PHE A 45 17.165 5.546 -7.162 1.00 0.00 C ATOM 675 CE2 PHE A 45 17.434 5.071 -4.834 1.00 0.00 C ATOM 676 CZ PHE A 45 17.647 5.901 -5.918 1.00 0.00 C ATOM 0 H PHE A 45 14.840 -0.360 -6.953 1.00 0.00 H new ATOM 0 HA PHE A 45 17.061 1.464 -7.675 1.00 0.00 H new ATOM 0 HB2 PHE A 45 14.673 2.395 -7.109 1.00 0.00 H new ATOM 0 HB3 PHE A 45 15.059 1.946 -5.459 1.00 0.00 H new ATOM 0 HD1 PHE A 45 16.096 4.087 -8.295 1.00 0.00 H new ATOM 0 HD2 PHE A 45 16.578 3.243 -4.147 1.00 0.00 H new ATOM 0 HE1 PHE A 45 17.330 6.193 -8.011 1.00 0.00 H new ATOM 0 HE2 PHE A 45 17.809 5.347 -3.860 1.00 0.00 H new ATOM 0 HZ PHE A 45 18.190 6.826 -5.792 1.00 0.00 H new ATOM 686 N HIS A 46 18.439 0.205 -6.033 1.00 0.00 N ATOM 687 CA HIS A 46 19.314 -0.374 -5.019 1.00 0.00 C ATOM 688 C HIS A 46 18.795 -1.736 -4.565 1.00 0.00 C ATOM 689 O HIS A 46 18.974 -2.127 -3.412 1.00 0.00 O ATOM 690 CB HIS A 46 19.431 0.567 -3.819 1.00 0.00 C ATOM 691 CG HIS A 46 20.818 0.658 -3.262 1.00 0.00 C ATOM 692 ND1 HIS A 46 21.412 1.834 -2.866 1.00 0.00 N ATOM 693 CD2 HIS A 46 21.735 -0.318 -3.038 1.00 0.00 C ATOM 694 CE1 HIS A 46 22.643 1.545 -2.423 1.00 0.00 C ATOM 695 NE2 HIS A 46 22.889 0.252 -2.506 1.00 0.00 N ATOM 0 H HIS A 46 18.890 0.374 -6.932 1.00 0.00 H new ATOM 0 HA HIS A 46 20.301 -0.511 -5.461 1.00 0.00 H new ATOM 0 HB2 HIS A 46 19.101 1.563 -4.115 1.00 0.00 H new ATOM 0 HB3 HIS A 46 18.755 0.228 -3.034 1.00 0.00 H new ATOM 0 HD2 HIS A 46 21.592 -1.369 -3.240 1.00 0.00 H new ATOM 0 HE1 HIS A 46 23.343 2.276 -2.047 1.00 0.00 H new ATOM 0 HE2 HIS A 46 23.746 -0.230 -2.237 1.00 0.00 H new ATOM 703 N LEU A 47 18.152 -2.452 -5.481 1.00 0.00 N ATOM 704 CA LEU A 47 17.608 -3.771 -5.177 1.00 0.00 C ATOM 705 C LEU A 47 17.988 -4.777 -6.259 1.00 0.00 C ATOM 706 O LEU A 47 17.917 -4.478 -7.451 1.00 0.00 O ATOM 707 CB LEU A 47 16.086 -3.700 -5.042 1.00 0.00 C ATOM 708 CG LEU A 47 15.568 -2.582 -4.134 1.00 0.00 C ATOM 709 CD1 LEU A 47 14.363 -1.898 -4.762 1.00 0.00 C ATOM 710 CD2 LEU A 47 15.215 -3.131 -2.759 1.00 0.00 C ATOM 0 H LEU A 47 17.995 -2.142 -6.440 1.00 0.00 H new ATOM 0 HA LEU A 47 18.034 -4.103 -4.230 1.00 0.00 H new ATOM 0 HB2 LEU A 47 15.654 -3.571 -6.034 1.00 0.00 H new ATOM 0 HB3 LEU A 47 15.725 -4.655 -4.659 1.00 0.00 H new ATOM 0 HG LEU A 47 16.359 -1.842 -4.016 1.00 0.00 H new ATOM 0 HD11 LEU A 47 14.009 -1.106 -4.102 1.00 0.00 H new ATOM 0 HD12 LEU A 47 14.648 -1.469 -5.723 1.00 0.00 H new ATOM 0 HD13 LEU A 47 13.568 -2.628 -4.912 1.00 0.00 H new ATOM 0 HD21 LEU A 47 14.849 -2.322 -2.127 1.00 0.00 H new ATOM 0 HD22 LEU A 47 14.441 -3.892 -2.859 1.00 0.00 H new ATOM 0 HD23 LEU A 47 16.102 -3.573 -2.305 1.00 0.00 H new ATOM 722 N ALA A 48 18.394 -5.970 -5.836 1.00 0.00 N ATOM 723 CA ALA A 48 18.786 -7.017 -6.770 1.00 0.00 C ATOM 724 C ALA A 48 18.149 -8.353 -6.396 1.00 0.00 C ATOM 725 O ALA A 48 17.184 -8.789 -7.025 1.00 0.00 O ATOM 726 CB ALA A 48 20.303 -7.144 -6.813 1.00 0.00 C ATOM 0 H ALA A 48 18.460 -6.235 -4.853 1.00 0.00 H new ATOM 0 HA ALA A 48 18.428 -6.740 -7.762 1.00 0.00 H new ATOM 0 HB1 ALA A 48 20.583 -7.930 -7.515 1.00 0.00 H new ATOM 0 HB2 ALA A 48 20.738 -6.198 -7.135 1.00 0.00 H new ATOM 0 HB3 ALA A 48 20.675 -7.395 -5.820 1.00 0.00 H new ATOM 732 N ARG A 49 18.695 -8.998 -5.371 1.00 0.00 N ATOM 733 CA ARG A 49 18.180 -10.283 -4.915 1.00 0.00 C ATOM 734 C ARG A 49 18.189 -10.365 -3.392 1.00 0.00 C ATOM 735 O ARG A 49 17.148 -10.553 -2.763 1.00 0.00 O ATOM 736 CB ARG A 49 19.009 -11.426 -5.503 1.00 0.00 C ATOM 737 CG ARG A 49 18.853 -11.579 -7.007 1.00 0.00 C ATOM 738 CD ARG A 49 19.866 -10.733 -7.762 1.00 0.00 C ATOM 739 NE ARG A 49 20.310 -11.379 -8.994 1.00 0.00 N ATOM 740 CZ ARG A 49 19.579 -11.440 -10.105 1.00 0.00 C ATOM 741 NH1 ARG A 49 18.369 -10.895 -10.141 1.00 0.00 N ATOM 742 NH2 ARG A 49 20.058 -12.046 -11.182 1.00 0.00 N ATOM 0 H ARG A 49 19.494 -8.652 -4.840 1.00 0.00 H new ATOM 0 HA ARG A 49 17.150 -10.375 -5.259 1.00 0.00 H new ATOM 0 HB2 ARG A 49 20.061 -11.258 -5.270 1.00 0.00 H new ATOM 0 HB3 ARG A 49 18.721 -12.359 -5.019 1.00 0.00 H new ATOM 0 HG2 ARG A 49 18.976 -12.627 -7.282 1.00 0.00 H new ATOM 0 HG3 ARG A 49 17.844 -11.289 -7.300 1.00 0.00 H new ATOM 0 HD2 ARG A 49 19.425 -9.765 -7.999 1.00 0.00 H new ATOM 0 HD3 ARG A 49 20.728 -10.542 -7.122 1.00 0.00 H new ATOM 0 HE ARG A 49 21.235 -11.809 -9.004 1.00 0.00 H new ATOM 0 HH11 ARG A 49 17.996 -10.427 -9.315 1.00 0.00 H new ATOM 0 HH12 ARG A 49 17.813 -10.944 -10.995 1.00 0.00 H new ATOM 0 HH21 ARG A 49 20.987 -12.466 -11.160 1.00 0.00 H new ATOM 0 HH22 ARG A 49 19.497 -12.092 -12.033 1.00 0.00 H new ATOM 756 N GLY A 50 19.372 -10.221 -2.805 1.00 0.00 N ATOM 757 CA GLY A 50 19.496 -10.282 -1.360 1.00 0.00 C ATOM 758 C GLY A 50 18.666 -9.223 -0.662 1.00 0.00 C ATOM 759 O GLY A 50 18.243 -9.409 0.479 1.00 0.00 O ATOM 0 H GLY A 50 20.248 -10.063 -3.304 1.00 0.00 H new ATOM 0 HA2 GLY A 50 19.187 -11.268 -1.013 1.00 0.00 H new ATOM 0 HA3 GLY A 50 20.543 -10.160 -1.083 1.00 0.00 H new ATOM 763 N GLU A 51 18.433 -8.108 -1.347 1.00 0.00 N ATOM 764 CA GLU A 51 17.648 -7.016 -0.784 1.00 0.00 C ATOM 765 C GLU A 51 16.156 -7.315 -0.876 1.00 0.00 C ATOM 766 O GLU A 51 15.384 -6.950 0.010 1.00 0.00 O ATOM 767 CB GLU A 51 17.965 -5.706 -1.508 1.00 0.00 C ATOM 768 CG GLU A 51 18.074 -4.508 -0.579 1.00 0.00 C ATOM 769 CD GLU A 51 19.368 -4.499 0.212 1.00 0.00 C ATOM 770 OE1 GLU A 51 19.837 -5.592 0.594 1.00 0.00 O ATOM 771 OE2 GLU A 51 19.912 -3.401 0.448 1.00 0.00 O ATOM 0 H GLU A 51 18.776 -7.937 -2.292 1.00 0.00 H new ATOM 0 HA GLU A 51 17.915 -6.914 0.268 1.00 0.00 H new ATOM 0 HB2 GLU A 51 18.902 -5.819 -2.053 1.00 0.00 H new ATOM 0 HB3 GLU A 51 17.188 -5.512 -2.248 1.00 0.00 H new ATOM 0 HG2 GLU A 51 18.004 -3.591 -1.165 1.00 0.00 H new ATOM 0 HG3 GLU A 51 17.231 -4.510 0.111 1.00 0.00 H new ATOM 778 N LEU A 52 15.756 -7.982 -1.953 1.00 0.00 N ATOM 779 CA LEU A 52 14.356 -8.333 -2.160 1.00 0.00 C ATOM 780 C LEU A 52 13.935 -9.460 -1.222 1.00 0.00 C ATOM 781 O LEU A 52 12.791 -9.513 -0.771 1.00 0.00 O ATOM 782 CB LEU A 52 14.120 -8.746 -3.613 1.00 0.00 C ATOM 783 CG LEU A 52 12.653 -8.784 -4.045 1.00 0.00 C ATOM 784 CD1 LEU A 52 12.166 -7.388 -4.402 1.00 0.00 C ATOM 785 CD2 LEU A 52 12.470 -9.731 -5.222 1.00 0.00 C ATOM 0 H LEU A 52 16.382 -8.291 -2.697 1.00 0.00 H new ATOM 0 HA LEU A 52 13.750 -7.454 -1.939 1.00 0.00 H new ATOM 0 HB2 LEU A 52 14.657 -8.055 -4.263 1.00 0.00 H new ATOM 0 HB3 LEU A 52 14.555 -9.733 -3.769 1.00 0.00 H new ATOM 0 HG LEU A 52 12.057 -9.152 -3.210 1.00 0.00 H new ATOM 0 HD11 LEU A 52 11.121 -7.434 -4.707 1.00 0.00 H new ATOM 0 HD12 LEU A 52 12.262 -6.736 -3.534 1.00 0.00 H new ATOM 0 HD13 LEU A 52 12.766 -6.992 -5.221 1.00 0.00 H new ATOM 0 HD21 LEU A 52 11.421 -9.746 -5.517 1.00 0.00 H new ATOM 0 HD22 LEU A 52 13.078 -9.391 -6.061 1.00 0.00 H new ATOM 0 HD23 LEU A 52 12.780 -10.735 -4.933 1.00 0.00 H new ATOM 797 N GLU A 53 14.870 -10.360 -0.932 1.00 0.00 N ATOM 798 CA GLU A 53 14.599 -11.487 -0.049 1.00 0.00 C ATOM 799 C GLU A 53 14.654 -11.056 1.414 1.00 0.00 C ATOM 800 O GLU A 53 13.935 -11.593 2.257 1.00 0.00 O ATOM 801 CB GLU A 53 15.606 -12.613 -0.302 1.00 0.00 C ATOM 802 CG GLU A 53 14.957 -13.953 -0.605 1.00 0.00 C ATOM 803 CD GLU A 53 15.714 -14.741 -1.658 1.00 0.00 C ATOM 804 OE1 GLU A 53 15.994 -14.174 -2.735 1.00 0.00 O ATOM 805 OE2 GLU A 53 16.025 -15.924 -1.404 1.00 0.00 O ATOM 0 H GLU A 53 15.822 -10.330 -1.296 1.00 0.00 H new ATOM 0 HA GLU A 53 13.595 -11.853 -0.263 1.00 0.00 H new ATOM 0 HB2 GLU A 53 16.249 -12.333 -1.136 1.00 0.00 H new ATOM 0 HB3 GLU A 53 16.247 -12.719 0.573 1.00 0.00 H new ATOM 0 HG2 GLU A 53 14.899 -14.540 0.311 1.00 0.00 H new ATOM 0 HG3 GLU A 53 13.934 -13.789 -0.944 1.00 0.00 H new ATOM 812 N SER A 54 15.511 -10.083 1.706 1.00 0.00 N ATOM 813 CA SER A 54 15.661 -9.579 3.067 1.00 0.00 C ATOM 814 C SER A 54 14.428 -8.793 3.498 1.00 0.00 C ATOM 815 O SER A 54 14.082 -8.759 4.679 1.00 0.00 O ATOM 816 CB SER A 54 16.904 -8.694 3.168 1.00 0.00 C ATOM 817 OG SER A 54 18.038 -9.449 3.557 1.00 0.00 O ATOM 0 H SER A 54 16.112 -9.628 1.019 1.00 0.00 H new ATOM 0 HA SER A 54 15.774 -10.434 3.734 1.00 0.00 H new ATOM 0 HB2 SER A 54 17.093 -8.217 2.206 1.00 0.00 H new ATOM 0 HB3 SER A 54 16.729 -7.897 3.890 1.00 0.00 H new ATOM 0 HG SER A 54 18.526 -9.741 2.759 1.00 0.00 H new ATOM 823 N LEU A 55 13.765 -8.161 2.534 1.00 0.00 N ATOM 824 CA LEU A 55 12.571 -7.375 2.816 1.00 0.00 C ATOM 825 C LEU A 55 11.479 -8.244 3.433 1.00 0.00 C ATOM 826 O LEU A 55 11.380 -9.435 3.139 1.00 0.00 O ATOM 827 CB LEU A 55 12.052 -6.718 1.536 1.00 0.00 C ATOM 828 CG LEU A 55 12.658 -5.349 1.220 1.00 0.00 C ATOM 829 CD1 LEU A 55 12.222 -4.876 -0.158 1.00 0.00 C ATOM 830 CD2 LEU A 55 12.262 -4.334 2.284 1.00 0.00 C ATOM 0 H LEU A 55 14.036 -8.179 1.551 1.00 0.00 H new ATOM 0 HA LEU A 55 12.840 -6.598 3.532 1.00 0.00 H new ATOM 0 HB2 LEU A 55 12.246 -7.387 0.698 1.00 0.00 H new ATOM 0 HB3 LEU A 55 10.970 -6.610 1.614 1.00 0.00 H new ATOM 0 HG LEU A 55 13.744 -5.444 1.221 1.00 0.00 H new ATOM 0 HD11 LEU A 55 12.663 -3.901 -0.364 1.00 0.00 H new ATOM 0 HD12 LEU A 55 12.555 -5.591 -0.910 1.00 0.00 H new ATOM 0 HD13 LEU A 55 11.135 -4.796 -0.188 1.00 0.00 H new ATOM 0 HD21 LEU A 55 12.701 -3.366 2.044 1.00 0.00 H new ATOM 0 HD22 LEU A 55 11.176 -4.243 2.314 1.00 0.00 H new ATOM 0 HD23 LEU A 55 12.625 -4.666 3.257 1.00 0.00 H new ATOM 842 N SER A 56 10.663 -7.640 4.291 1.00 0.00 N ATOM 843 CA SER A 56 9.578 -8.358 4.950 1.00 0.00 C ATOM 844 C SER A 56 8.246 -7.648 4.735 1.00 0.00 C ATOM 845 O SER A 56 8.206 -6.503 4.288 1.00 0.00 O ATOM 846 CB SER A 56 9.863 -8.490 6.449 1.00 0.00 C ATOM 847 OG SER A 56 9.434 -9.747 6.941 1.00 0.00 O ATOM 0 H SER A 56 10.733 -6.655 4.546 1.00 0.00 H new ATOM 0 HA SER A 56 9.514 -9.353 4.510 1.00 0.00 H new ATOM 0 HB2 SER A 56 10.931 -8.370 6.631 1.00 0.00 H new ATOM 0 HB3 SER A 56 9.356 -7.692 6.990 1.00 0.00 H new ATOM 0 HG SER A 56 9.629 -9.807 7.900 1.00 0.00 H new ATOM 853 N GLN A 57 7.155 -8.338 5.057 1.00 0.00 N ATOM 854 CA GLN A 57 5.820 -7.774 4.898 1.00 0.00 C ATOM 855 C GLN A 57 5.631 -6.557 5.800 1.00 0.00 C ATOM 856 O GLN A 57 4.888 -5.634 5.467 1.00 0.00 O ATOM 857 CB GLN A 57 4.757 -8.830 5.214 1.00 0.00 C ATOM 858 CG GLN A 57 4.046 -9.364 3.981 1.00 0.00 C ATOM 859 CD GLN A 57 3.272 -10.637 4.259 1.00 0.00 C ATOM 860 OE1 GLN A 57 3.340 -11.599 3.494 1.00 0.00 O ATOM 861 NE2 GLN A 57 2.527 -10.649 5.359 1.00 0.00 N ATOM 0 H GLN A 57 7.170 -9.288 5.429 1.00 0.00 H new ATOM 0 HA GLN A 57 5.708 -7.455 3.862 1.00 0.00 H new ATOM 0 HB2 GLN A 57 5.227 -9.661 5.741 1.00 0.00 H new ATOM 0 HB3 GLN A 57 4.019 -8.400 5.891 1.00 0.00 H new ATOM 0 HG2 GLN A 57 3.363 -8.604 3.602 1.00 0.00 H new ATOM 0 HG3 GLN A 57 4.779 -9.553 3.197 1.00 0.00 H new ATOM 0 HE21 GLN A 57 2.500 -9.829 5.965 1.00 0.00 H new ATOM 0 HE22 GLN A 57 1.982 -11.478 5.597 1.00 0.00 H new ATOM 870 N VAL A 58 6.310 -6.563 6.943 1.00 0.00 N ATOM 871 CA VAL A 58 6.217 -5.460 7.893 1.00 0.00 C ATOM 872 C VAL A 58 7.315 -4.430 7.650 1.00 0.00 C ATOM 873 O VAL A 58 7.132 -3.240 7.906 1.00 0.00 O ATOM 874 CB VAL A 58 6.314 -5.961 9.346 1.00 0.00 C ATOM 875 CG1 VAL A 58 6.014 -4.834 10.322 1.00 0.00 C ATOM 876 CG2 VAL A 58 5.373 -7.135 9.569 1.00 0.00 C ATOM 0 H VAL A 58 6.930 -7.319 7.234 1.00 0.00 H new ATOM 0 HA VAL A 58 5.244 -4.993 7.740 1.00 0.00 H new ATOM 0 HB VAL A 58 7.333 -6.303 9.526 1.00 0.00 H new ATOM 0 HG11 VAL A 58 6.088 -5.208 11.343 1.00 0.00 H new ATOM 0 HG12 VAL A 58 6.733 -4.027 10.178 1.00 0.00 H new ATOM 0 HG13 VAL A 58 5.006 -4.458 10.145 1.00 0.00 H new ATOM 0 HG21 VAL A 58 5.455 -7.476 10.601 1.00 0.00 H new ATOM 0 HG22 VAL A 58 4.348 -6.822 9.370 1.00 0.00 H new ATOM 0 HG23 VAL A 58 5.641 -7.949 8.896 1.00 0.00 H new ATOM 886 N ASP A 59 8.457 -4.896 7.154 1.00 0.00 N ATOM 887 CA ASP A 59 9.585 -4.015 6.876 1.00 0.00 C ATOM 888 C ASP A 59 9.420 -3.320 5.528 1.00 0.00 C ATOM 889 O ASP A 59 9.914 -2.212 5.325 1.00 0.00 O ATOM 890 CB ASP A 59 10.894 -4.806 6.897 1.00 0.00 C ATOM 891 CG ASP A 59 11.183 -5.411 8.256 1.00 0.00 C ATOM 892 OD1 ASP A 59 10.313 -6.139 8.779 1.00 0.00 O ATOM 893 OD2 ASP A 59 12.278 -5.157 8.798 1.00 0.00 O ATOM 0 H ASP A 59 8.625 -5.878 6.937 1.00 0.00 H new ATOM 0 HA ASP A 59 9.615 -3.252 7.654 1.00 0.00 H new ATOM 0 HB2 ASP A 59 10.847 -5.600 6.152 1.00 0.00 H new ATOM 0 HB3 ASP A 59 11.716 -4.150 6.612 1.00 0.00 H new ATOM 898 N LEU A 60 8.723 -3.980 4.608 1.00 0.00 N ATOM 899 CA LEU A 60 8.494 -3.426 3.278 1.00 0.00 C ATOM 900 C LEU A 60 7.781 -2.080 3.362 1.00 0.00 C ATOM 901 O LEU A 60 8.007 -1.195 2.537 1.00 0.00 O ATOM 902 CB LEU A 60 7.672 -4.400 2.432 1.00 0.00 C ATOM 903 CG LEU A 60 7.372 -3.927 1.009 1.00 0.00 C ATOM 904 CD1 LEU A 60 8.502 -4.316 0.070 1.00 0.00 C ATOM 905 CD2 LEU A 60 6.051 -4.504 0.525 1.00 0.00 C ATOM 0 H LEU A 60 8.307 -4.899 4.759 1.00 0.00 H new ATOM 0 HA LEU A 60 9.464 -3.273 2.805 1.00 0.00 H new ATOM 0 HB2 LEU A 60 8.204 -5.350 2.378 1.00 0.00 H new ATOM 0 HB3 LEU A 60 6.728 -4.592 2.941 1.00 0.00 H new ATOM 0 HG LEU A 60 7.290 -2.840 1.015 1.00 0.00 H new ATOM 0 HD11 LEU A 60 8.272 -3.972 -0.938 1.00 0.00 H new ATOM 0 HD12 LEU A 60 9.430 -3.856 0.408 1.00 0.00 H new ATOM 0 HD13 LEU A 60 8.615 -5.400 0.066 1.00 0.00 H new ATOM 0 HD21 LEU A 60 5.852 -4.158 -0.489 1.00 0.00 H new ATOM 0 HD22 LEU A 60 6.105 -5.593 0.533 1.00 0.00 H new ATOM 0 HD23 LEU A 60 5.247 -4.176 1.184 1.00 0.00 H new ATOM 917 N ALA A 61 6.920 -1.933 4.363 1.00 0.00 N ATOM 918 CA ALA A 61 6.175 -0.695 4.553 1.00 0.00 C ATOM 919 C ALA A 61 7.100 0.446 4.965 1.00 0.00 C ATOM 920 O ALA A 61 6.914 1.590 4.551 1.00 0.00 O ATOM 921 CB ALA A 61 5.081 -0.892 5.592 1.00 0.00 C ATOM 0 H ALA A 61 6.721 -2.656 5.055 1.00 0.00 H new ATOM 0 HA ALA A 61 5.714 -0.428 3.602 1.00 0.00 H new ATOM 0 HB1 ALA A 61 4.532 0.041 5.724 1.00 0.00 H new ATOM 0 HB2 ALA A 61 4.397 -1.671 5.256 1.00 0.00 H new ATOM 0 HB3 ALA A 61 5.529 -1.187 6.541 1.00 0.00 H new ATOM 927 N SER A 62 8.098 0.125 5.783 1.00 0.00 N ATOM 928 CA SER A 62 9.053 1.122 6.250 1.00 0.00 C ATOM 929 C SER A 62 10.022 1.513 5.138 1.00 0.00 C ATOM 930 O SER A 62 10.491 2.649 5.080 1.00 0.00 O ATOM 931 CB SER A 62 9.830 0.589 7.456 1.00 0.00 C ATOM 932 OG SER A 62 9.001 -0.207 8.285 1.00 0.00 O ATOM 0 H SER A 62 8.266 -0.817 6.135 1.00 0.00 H new ATOM 0 HA SER A 62 8.495 2.010 6.549 1.00 0.00 H new ATOM 0 HB2 SER A 62 10.680 -0.001 7.113 1.00 0.00 H new ATOM 0 HB3 SER A 62 10.232 1.423 8.031 1.00 0.00 H new ATOM 0 HG SER A 62 9.521 -0.537 9.047 1.00 0.00 H new ATOM 938 N LYS A 63 10.316 0.561 4.257 1.00 0.00 N ATOM 939 CA LYS A 63 11.228 0.805 3.145 1.00 0.00 C ATOM 940 C LYS A 63 10.539 1.598 2.039 1.00 0.00 C ATOM 941 O LYS A 63 11.143 2.473 1.420 1.00 0.00 O ATOM 942 CB LYS A 63 11.754 -0.520 2.590 1.00 0.00 C ATOM 943 CG LYS A 63 13.098 -0.932 3.171 1.00 0.00 C ATOM 944 CD LYS A 63 14.107 -1.250 2.079 1.00 0.00 C ATOM 945 CE LYS A 63 15.516 -0.855 2.490 1.00 0.00 C ATOM 946 NZ LYS A 63 15.599 0.578 2.883 1.00 0.00 N ATOM 0 H LYS A 63 9.936 -0.385 4.292 1.00 0.00 H new ATOM 0 HA LYS A 63 12.067 1.393 3.518 1.00 0.00 H new ATOM 0 HB2 LYS A 63 11.024 -1.304 2.792 1.00 0.00 H new ATOM 0 HB3 LYS A 63 11.845 -0.440 1.507 1.00 0.00 H new ATOM 0 HG2 LYS A 63 13.484 -0.130 3.801 1.00 0.00 H new ATOM 0 HG3 LYS A 63 12.966 -1.805 3.811 1.00 0.00 H new ATOM 0 HD2 LYS A 63 14.078 -2.316 1.855 1.00 0.00 H new ATOM 0 HD3 LYS A 63 13.833 -0.724 1.164 1.00 0.00 H new ATOM 0 HE2 LYS A 63 15.839 -1.479 3.323 1.00 0.00 H new ATOM 0 HE3 LYS A 63 16.202 -1.045 1.664 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 16.549 0.943 2.668 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 14.890 1.125 2.354 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 15.416 0.670 3.903 1.00 0.00 H new ATOM 960 N LEU A 64 9.271 1.284 1.796 1.00 0.00 N ATOM 961 CA LEU A 64 8.499 1.965 0.764 1.00 0.00 C ATOM 962 C LEU A 64 8.411 3.462 1.049 1.00 0.00 C ATOM 963 O LEU A 64 8.438 4.281 0.130 1.00 0.00 O ATOM 964 CB LEU A 64 7.093 1.368 0.668 1.00 0.00 C ATOM 965 CG LEU A 64 6.982 0.116 -0.204 1.00 0.00 C ATOM 966 CD1 LEU A 64 5.575 -0.458 -0.137 1.00 0.00 C ATOM 967 CD2 LEU A 64 7.364 0.434 -1.642 1.00 0.00 C ATOM 0 H LEU A 64 8.756 0.562 2.300 1.00 0.00 H new ATOM 0 HA LEU A 64 9.010 1.824 -0.188 1.00 0.00 H new ATOM 0 HB2 LEU A 64 6.748 1.125 1.673 1.00 0.00 H new ATOM 0 HB3 LEU A 64 6.418 2.128 0.275 1.00 0.00 H new ATOM 0 HG LEU A 64 7.675 -0.633 0.178 1.00 0.00 H new ATOM 0 HD11 LEU A 64 5.515 -1.348 -0.763 1.00 0.00 H new ATOM 0 HD12 LEU A 64 5.339 -0.723 0.894 1.00 0.00 H new ATOM 0 HD13 LEU A 64 4.862 0.285 -0.493 1.00 0.00 H new ATOM 0 HD21 LEU A 64 7.280 -0.468 -2.249 1.00 0.00 H new ATOM 0 HD22 LEU A 64 6.696 1.200 -2.035 1.00 0.00 H new ATOM 0 HD23 LEU A 64 8.391 0.798 -1.674 1.00 0.00 H new ATOM 979 N ILE A 65 8.306 3.812 2.326 1.00 0.00 N ATOM 980 CA ILE A 65 8.216 5.210 2.731 1.00 0.00 C ATOM 981 C ILE A 65 9.602 5.830 2.878 1.00 0.00 C ATOM 982 O ILE A 65 9.790 7.020 2.632 1.00 0.00 O ATOM 983 CB ILE A 65 7.453 5.364 4.060 1.00 0.00 C ATOM 984 CG1 ILE A 65 6.126 4.606 4.004 1.00 0.00 C ATOM 985 CG2 ILE A 65 7.217 6.835 4.370 1.00 0.00 C ATOM 986 CD1 ILE A 65 5.388 4.584 5.325 1.00 0.00 C ATOM 0 H ILE A 65 8.281 3.147 3.099 1.00 0.00 H new ATOM 0 HA ILE A 65 7.669 5.731 1.946 1.00 0.00 H new ATOM 0 HB ILE A 65 8.059 4.938 4.859 1.00 0.00 H new ATOM 0 HG12 ILE A 65 5.488 5.062 3.248 1.00 0.00 H new ATOM 0 HG13 ILE A 65 6.315 3.581 3.685 1.00 0.00 H new ATOM 0 HG21 ILE A 65 6.677 6.926 5.312 1.00 0.00 H new ATOM 0 HG22 ILE A 65 8.175 7.348 4.450 1.00 0.00 H new ATOM 0 HG23 ILE A 65 6.630 7.286 3.570 1.00 0.00 H new ATOM 0 HD11 ILE A 65 4.456 4.030 5.212 1.00 0.00 H new ATOM 0 HD12 ILE A 65 6.008 4.101 6.080 1.00 0.00 H new ATOM 0 HD13 ILE A 65 5.167 5.605 5.636 1.00 0.00 H new ATOM 998 N SER A 66 10.569 5.012 3.281 1.00 0.00 N ATOM 999 CA SER A 66 11.938 5.479 3.462 1.00 0.00 C ATOM 1000 C SER A 66 12.598 5.771 2.118 1.00 0.00 C ATOM 1001 O SER A 66 13.457 6.647 2.014 1.00 0.00 O ATOM 1002 CB SER A 66 12.757 4.438 4.228 1.00 0.00 C ATOM 1003 OG SER A 66 12.726 4.689 5.622 1.00 0.00 O ATOM 0 H SER A 66 10.430 4.023 3.488 1.00 0.00 H new ATOM 0 HA SER A 66 11.905 6.404 4.038 1.00 0.00 H new ATOM 0 HB2 SER A 66 12.364 3.441 4.026 1.00 0.00 H new ATOM 0 HB3 SER A 66 13.788 4.451 3.876 1.00 0.00 H new ATOM 0 HG SER A 66 12.024 4.145 6.037 1.00 0.00 H new ATOM 1009 N MET A 67 12.191 5.032 1.091 1.00 0.00 N ATOM 1010 CA MET A 67 12.744 5.212 -0.246 1.00 0.00 C ATOM 1011 C MET A 67 12.176 6.463 -0.908 1.00 0.00 C ATOM 1012 O MET A 67 12.910 7.403 -1.213 1.00 0.00 O ATOM 1013 CB MET A 67 12.448 3.986 -1.112 1.00 0.00 C ATOM 1014 CG MET A 67 13.360 2.803 -0.822 1.00 0.00 C ATOM 1015 SD MET A 67 13.741 1.842 -2.300 1.00 0.00 S ATOM 1016 CE MET A 67 12.226 0.906 -2.494 1.00 0.00 C ATOM 0 H MET A 67 11.481 4.303 1.159 1.00 0.00 H new ATOM 0 HA MET A 67 13.823 5.331 -0.151 1.00 0.00 H new ATOM 0 HB2 MET A 67 11.413 3.683 -0.957 1.00 0.00 H new ATOM 0 HB3 MET A 67 12.546 4.261 -2.162 1.00 0.00 H new ATOM 0 HG2 MET A 67 14.288 3.164 -0.379 1.00 0.00 H new ATOM 0 HG3 MET A 67 12.886 2.156 -0.084 1.00 0.00 H new ATOM 0 HE1 MET A 67 12.278 0.315 -3.408 1.00 0.00 H new ATOM 0 HE2 MET A 67 12.097 0.242 -1.639 1.00 0.00 H new ATOM 0 HE3 MET A 67 11.380 1.591 -2.553 1.00 0.00 H new ATOM 1026 N TYR A 68 10.865 6.469 -1.127 1.00 0.00 N ATOM 1027 CA TYR A 68 10.199 7.607 -1.753 1.00 0.00 C ATOM 1028 C TYR A 68 9.487 8.463 -0.711 1.00 0.00 C ATOM 1029 O TYR A 68 9.867 9.608 -0.469 1.00 0.00 O ATOM 1030 CB TYR A 68 9.197 7.123 -2.803 1.00 0.00 C ATOM 1031 CG TYR A 68 9.721 6.006 -3.677 1.00 0.00 C ATOM 1032 CD1 TYR A 68 10.797 6.212 -4.531 1.00 0.00 C ATOM 1033 CD2 TYR A 68 9.140 4.745 -3.647 1.00 0.00 C ATOM 1034 CE1 TYR A 68 11.279 5.192 -5.330 1.00 0.00 C ATOM 1035 CE2 TYR A 68 9.616 3.720 -4.443 1.00 0.00 C ATOM 1036 CZ TYR A 68 10.686 3.949 -5.283 1.00 0.00 C ATOM 1037 OH TYR A 68 11.163 2.931 -6.077 1.00 0.00 O ATOM 0 H TYR A 68 10.243 5.699 -0.881 1.00 0.00 H new ATOM 0 HA TYR A 68 10.959 8.218 -2.240 1.00 0.00 H new ATOM 0 HB2 TYR A 68 8.292 6.783 -2.299 1.00 0.00 H new ATOM 0 HB3 TYR A 68 8.913 7.964 -3.436 1.00 0.00 H new ATOM 0 HD1 TYR A 68 11.265 7.185 -4.571 1.00 0.00 H new ATOM 0 HD2 TYR A 68 8.302 4.562 -2.991 1.00 0.00 H new ATOM 0 HE1 TYR A 68 12.117 5.369 -5.988 1.00 0.00 H new ATOM 0 HE2 TYR A 68 9.153 2.745 -4.407 1.00 0.00 H new ATOM 0 HH TYR A 68 10.635 2.120 -5.922 1.00 0.00 H new ATOM 1047 N GLY A 69 8.451 7.899 -0.098 1.00 0.00 N ATOM 1048 CA GLY A 69 7.701 8.624 0.910 1.00 0.00 C ATOM 1049 C GLY A 69 6.322 8.037 1.137 1.00 0.00 C ATOM 1050 O GLY A 69 5.870 7.187 0.372 1.00 0.00 O ATOM 0 H GLY A 69 8.118 6.953 -0.282 1.00 0.00 H new ATOM 0 HA2 GLY A 69 8.256 8.615 1.848 1.00 0.00 H new ATOM 0 HA3 GLY A 69 7.604 9.667 0.607 1.00 0.00 H new ATOM 1054 N ALA A 70 5.653 8.491 2.191 1.00 0.00 N ATOM 1055 CA ALA A 70 4.317 8.005 2.516 1.00 0.00 C ATOM 1056 C ALA A 70 3.328 8.314 1.396 1.00 0.00 C ATOM 1057 O ALA A 70 2.320 7.624 1.239 1.00 0.00 O ATOM 1058 CB ALA A 70 3.840 8.613 3.827 1.00 0.00 C ATOM 0 H ALA A 70 6.014 9.195 2.835 1.00 0.00 H new ATOM 0 HA ALA A 70 4.370 6.922 2.627 1.00 0.00 H new ATOM 0 HB1 ALA A 70 2.841 8.242 4.058 1.00 0.00 H new ATOM 0 HB2 ALA A 70 4.525 8.334 4.628 1.00 0.00 H new ATOM 0 HB3 ALA A 70 3.811 9.699 3.735 1.00 0.00 H new ATOM 1064 N GLN A 71 3.620 9.355 0.623 1.00 0.00 N ATOM 1065 CA GLN A 71 2.752 9.754 -0.480 1.00 0.00 C ATOM 1066 C GLN A 71 3.002 8.895 -1.717 1.00 0.00 C ATOM 1067 O GLN A 71 2.101 8.682 -2.527 1.00 0.00 O ATOM 1068 CB GLN A 71 2.972 11.230 -0.819 1.00 0.00 C ATOM 1069 CG GLN A 71 2.295 12.184 0.151 1.00 0.00 C ATOM 1070 CD GLN A 71 1.110 12.902 -0.467 1.00 0.00 C ATOM 1071 OE1 GLN A 71 0.546 12.447 -1.463 1.00 0.00 O ATOM 1072 NE2 GLN A 71 0.727 14.028 0.122 1.00 0.00 N ATOM 0 H GLN A 71 4.450 9.937 0.739 1.00 0.00 H new ATOM 0 HA GLN A 71 1.719 9.607 -0.164 1.00 0.00 H new ATOM 0 HB2 GLN A 71 4.042 11.436 -0.831 1.00 0.00 H new ATOM 0 HB3 GLN A 71 2.599 11.423 -1.825 1.00 0.00 H new ATOM 0 HG2 GLN A 71 1.962 11.629 1.028 1.00 0.00 H new ATOM 0 HG3 GLN A 71 3.021 12.920 0.497 1.00 0.00 H new ATOM 0 HE21 GLN A 71 1.224 14.367 0.945 1.00 0.00 H new ATOM 0 HE22 GLN A 71 -0.064 14.554 -0.249 1.00 0.00 H new ATOM 1081 N GLU A 72 4.231 8.409 -1.858 1.00 0.00 N ATOM 1082 CA GLU A 72 4.597 7.578 -3.001 1.00 0.00 C ATOM 1083 C GLU A 72 4.498 6.092 -2.657 1.00 0.00 C ATOM 1084 O GLU A 72 4.334 5.252 -3.542 1.00 0.00 O ATOM 1085 CB GLU A 72 6.015 7.914 -3.468 1.00 0.00 C ATOM 1086 CG GLU A 72 6.087 8.357 -4.921 1.00 0.00 C ATOM 1087 CD GLU A 72 6.515 9.803 -5.071 1.00 0.00 C ATOM 1088 OE1 GLU A 72 6.014 10.653 -4.305 1.00 0.00 O ATOM 1089 OE2 GLU A 72 7.351 10.088 -5.954 1.00 0.00 O ATOM 0 H GLU A 72 4.990 8.575 -1.197 1.00 0.00 H new ATOM 0 HA GLU A 72 3.895 7.789 -3.808 1.00 0.00 H new ATOM 0 HB2 GLU A 72 6.420 8.704 -2.835 1.00 0.00 H new ATOM 0 HB3 GLU A 72 6.651 7.039 -3.331 1.00 0.00 H new ATOM 0 HG2 GLU A 72 6.788 7.717 -5.457 1.00 0.00 H new ATOM 0 HG3 GLU A 72 5.111 8.221 -5.387 1.00 0.00 H new ATOM 1096 N ALA A 73 4.599 5.774 -1.369 1.00 0.00 N ATOM 1097 CA ALA A 73 4.523 4.390 -0.912 1.00 0.00 C ATOM 1098 C ALA A 73 3.255 3.707 -1.417 1.00 0.00 C ATOM 1099 O ALA A 73 3.320 2.694 -2.114 1.00 0.00 O ATOM 1100 CB ALA A 73 4.586 4.333 0.607 1.00 0.00 C ATOM 0 H ALA A 73 4.734 6.457 -0.623 1.00 0.00 H new ATOM 0 HA ALA A 73 5.378 3.853 -1.323 1.00 0.00 H new ATOM 0 HB1 ALA A 73 4.528 3.295 0.935 1.00 0.00 H new ATOM 0 HB2 ALA A 73 5.524 4.770 0.949 1.00 0.00 H new ATOM 0 HB3 ALA A 73 3.751 4.893 1.027 1.00 0.00 H new ATOM 1106 N VAL A 74 2.104 4.267 -1.060 1.00 0.00 N ATOM 1107 CA VAL A 74 0.821 3.710 -1.476 1.00 0.00 C ATOM 1108 C VAL A 74 0.720 3.635 -2.996 1.00 0.00 C ATOM 1109 O VAL A 74 0.030 2.772 -3.540 1.00 0.00 O ATOM 1110 CB VAL A 74 -0.355 4.543 -0.937 1.00 0.00 C ATOM 1111 CG1 VAL A 74 -1.676 3.839 -1.206 1.00 0.00 C ATOM 1112 CG2 VAL A 74 -0.180 4.814 0.550 1.00 0.00 C ATOM 0 H VAL A 74 2.033 5.106 -0.484 1.00 0.00 H new ATOM 0 HA VAL A 74 0.765 2.704 -1.060 1.00 0.00 H new ATOM 0 HB VAL A 74 -0.367 5.500 -1.458 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -2.496 4.443 -0.818 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -1.803 3.702 -2.280 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -1.677 2.867 -0.713 1.00 0.00 H new ATOM 0 HG21 VAL A 74 -1.021 5.404 0.914 1.00 0.00 H new ATOM 0 HG22 VAL A 74 -0.140 3.868 1.090 1.00 0.00 H new ATOM 0 HG23 VAL A 74 0.747 5.364 0.713 1.00 0.00 H new ATOM 1122 N ARG A 75 1.411 4.542 -3.677 1.00 0.00 N ATOM 1123 CA ARG A 75 1.398 4.578 -5.135 1.00 0.00 C ATOM 1124 C ARG A 75 2.049 3.327 -5.717 1.00 0.00 C ATOM 1125 O ARG A 75 1.477 2.663 -6.583 1.00 0.00 O ATOM 1126 CB ARG A 75 2.122 5.827 -5.642 1.00 0.00 C ATOM 1127 CG ARG A 75 1.670 6.274 -7.022 1.00 0.00 C ATOM 1128 CD ARG A 75 0.655 7.403 -6.936 1.00 0.00 C ATOM 1129 NE ARG A 75 0.122 7.761 -8.249 1.00 0.00 N ATOM 1130 CZ ARG A 75 -0.488 8.913 -8.512 1.00 0.00 C ATOM 1131 NH1 ARG A 75 -0.646 9.822 -7.558 1.00 0.00 N ATOM 1132 NH2 ARG A 75 -0.943 9.159 -9.735 1.00 0.00 N ATOM 0 H ARG A 75 1.988 5.263 -3.243 1.00 0.00 H new ATOM 0 HA ARG A 75 0.359 4.610 -5.463 1.00 0.00 H new ATOM 0 HB2 ARG A 75 1.962 6.641 -4.935 1.00 0.00 H new ATOM 0 HB3 ARG A 75 3.194 5.631 -5.666 1.00 0.00 H new ATOM 0 HG2 ARG A 75 2.533 6.603 -7.600 1.00 0.00 H new ATOM 0 HG3 ARG A 75 1.232 5.429 -7.554 1.00 0.00 H new ATOM 0 HD2 ARG A 75 -0.164 7.105 -6.281 1.00 0.00 H new ATOM 0 HD3 ARG A 75 1.123 8.278 -6.484 1.00 0.00 H new ATOM 0 HE ARG A 75 0.224 7.088 -9.008 1.00 0.00 H new ATOM 0 HH11 ARG A 75 -0.299 9.639 -6.617 1.00 0.00 H new ATOM 0 HH12 ARG A 75 -1.115 10.704 -7.766 1.00 0.00 H new ATOM 0 HH21 ARG A 75 -0.825 8.464 -10.472 1.00 0.00 H new ATOM 0 HH22 ARG A 75 -1.411 10.043 -9.937 1.00 0.00 H new ATOM 1146 N VAL A 76 3.247 3.012 -5.237 1.00 0.00 N ATOM 1147 CA VAL A 76 3.977 1.842 -5.710 1.00 0.00 C ATOM 1148 C VAL A 76 3.189 0.560 -5.456 1.00 0.00 C ATOM 1149 O VAL A 76 3.299 -0.407 -6.211 1.00 0.00 O ATOM 1150 CB VAL A 76 5.355 1.728 -5.028 1.00 0.00 C ATOM 1151 CG1 VAL A 76 6.161 0.591 -5.638 1.00 0.00 C ATOM 1152 CG2 VAL A 76 6.114 3.043 -5.129 1.00 0.00 C ATOM 0 H VAL A 76 3.733 3.551 -4.520 1.00 0.00 H new ATOM 0 HA VAL A 76 4.119 1.970 -6.783 1.00 0.00 H new ATOM 0 HB VAL A 76 5.199 1.507 -3.972 1.00 0.00 H new ATOM 0 HG11 VAL A 76 7.130 0.526 -5.144 1.00 0.00 H new ATOM 0 HG12 VAL A 76 5.623 -0.348 -5.506 1.00 0.00 H new ATOM 0 HG13 VAL A 76 6.308 0.779 -6.702 1.00 0.00 H new ATOM 0 HG21 VAL A 76 7.084 2.942 -4.642 1.00 0.00 H new ATOM 0 HG22 VAL A 76 6.260 3.299 -6.178 1.00 0.00 H new ATOM 0 HG23 VAL A 76 5.543 3.831 -4.639 1.00 0.00 H new ATOM 1162 N VAL A 77 2.396 0.559 -4.390 1.00 0.00 N ATOM 1163 CA VAL A 77 1.592 -0.605 -4.038 1.00 0.00 C ATOM 1164 C VAL A 77 0.359 -0.713 -4.928 1.00 0.00 C ATOM 1165 O VAL A 77 0.003 -1.800 -5.382 1.00 0.00 O ATOM 1166 CB VAL A 77 1.146 -0.555 -2.565 1.00 0.00 C ATOM 1167 CG1 VAL A 77 0.479 -1.862 -2.163 1.00 0.00 C ATOM 1168 CG2 VAL A 77 2.329 -0.250 -1.659 1.00 0.00 C ATOM 0 H VAL A 77 2.293 1.351 -3.755 1.00 0.00 H new ATOM 0 HA VAL A 77 2.222 -1.481 -4.189 1.00 0.00 H new ATOM 0 HB VAL A 77 0.416 0.247 -2.453 1.00 0.00 H new ATOM 0 HG11 VAL A 77 0.171 -1.807 -1.119 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -0.396 -2.032 -2.791 1.00 0.00 H new ATOM 0 HG13 VAL A 77 1.183 -2.684 -2.291 1.00 0.00 H new ATOM 0 HG21 VAL A 77 1.995 -0.219 -0.622 1.00 0.00 H new ATOM 0 HG22 VAL A 77 3.085 -1.027 -1.773 1.00 0.00 H new ATOM 0 HG23 VAL A 77 2.757 0.715 -1.932 1.00 0.00 H new ATOM 1178 N SER A 78 -0.291 0.421 -5.171 1.00 0.00 N ATOM 1179 CA SER A 78 -1.486 0.452 -6.008 1.00 0.00 C ATOM 1180 C SER A 78 -1.158 0.053 -7.443 1.00 0.00 C ATOM 1181 O SER A 78 -1.980 -0.548 -8.133 1.00 0.00 O ATOM 1182 CB SER A 78 -2.115 1.846 -5.983 1.00 0.00 C ATOM 1183 OG SER A 78 -3.514 1.779 -6.200 1.00 0.00 O ATOM 0 H SER A 78 -0.011 1.329 -4.801 1.00 0.00 H new ATOM 0 HA SER A 78 -2.199 -0.268 -5.606 1.00 0.00 H new ATOM 0 HB2 SER A 78 -1.915 2.321 -5.023 1.00 0.00 H new ATOM 0 HB3 SER A 78 -1.655 2.470 -6.749 1.00 0.00 H new ATOM 0 HG SER A 78 -3.964 1.541 -5.363 1.00 0.00 H new ATOM 1189 N ARG A 79 0.047 0.395 -7.886 1.00 0.00 N ATOM 1190 CA ARG A 79 0.483 0.073 -9.239 1.00 0.00 C ATOM 1191 C ARG A 79 0.772 -1.420 -9.379 1.00 0.00 C ATOM 1192 O ARG A 79 0.370 -2.050 -10.357 1.00 0.00 O ATOM 1193 CB ARG A 79 1.729 0.885 -9.602 1.00 0.00 C ATOM 1194 CG ARG A 79 1.521 1.823 -10.781 1.00 0.00 C ATOM 1195 CD ARG A 79 2.541 2.952 -10.783 1.00 0.00 C ATOM 1196 NE ARG A 79 1.910 4.257 -10.964 1.00 0.00 N ATOM 1197 CZ ARG A 79 2.564 5.349 -11.355 1.00 0.00 C ATOM 1198 NH1 ARG A 79 3.865 5.296 -11.608 1.00 0.00 N ATOM 1199 NH2 ARG A 79 1.914 6.495 -11.494 1.00 0.00 N ATOM 0 H ARG A 79 0.739 0.895 -7.328 1.00 0.00 H new ATOM 0 HA ARG A 79 -0.323 0.332 -9.925 1.00 0.00 H new ATOM 0 HB2 ARG A 79 2.038 1.468 -8.734 1.00 0.00 H new ATOM 0 HB3 ARG A 79 2.545 0.200 -9.833 1.00 0.00 H new ATOM 0 HG2 ARG A 79 1.597 1.261 -11.712 1.00 0.00 H new ATOM 0 HG3 ARG A 79 0.515 2.240 -10.742 1.00 0.00 H new ATOM 0 HD2 ARG A 79 3.094 2.943 -9.844 1.00 0.00 H new ATOM 0 HD3 ARG A 79 3.265 2.785 -11.580 1.00 0.00 H new ATOM 0 HE ARG A 79 0.910 4.336 -10.780 1.00 0.00 H new ATOM 0 HH11 ARG A 79 4.369 4.416 -11.503 1.00 0.00 H new ATOM 0 HH12 ARG A 79 4.361 6.136 -11.907 1.00 0.00 H new ATOM 0 HH21 ARG A 79 0.913 6.540 -11.302 1.00 0.00 H new ATOM 0 HH22 ARG A 79 2.414 7.332 -11.793 1.00 0.00 H new ATOM 1213 N SER A 80 1.470 -1.977 -8.395 1.00 0.00 N ATOM 1214 CA SER A 80 1.812 -3.394 -8.408 1.00 0.00 C ATOM 1215 C SER A 80 0.561 -4.259 -8.290 1.00 0.00 C ATOM 1216 O SER A 80 0.509 -5.368 -8.821 1.00 0.00 O ATOM 1217 CB SER A 80 2.777 -3.718 -7.266 1.00 0.00 C ATOM 1218 OG SER A 80 3.698 -4.725 -7.645 1.00 0.00 O ATOM 0 H SER A 80 1.810 -1.469 -7.579 1.00 0.00 H new ATOM 0 HA SER A 80 2.296 -3.615 -9.359 1.00 0.00 H new ATOM 0 HB2 SER A 80 3.318 -2.817 -6.976 1.00 0.00 H new ATOM 0 HB3 SER A 80 2.214 -4.046 -6.392 1.00 0.00 H new ATOM 0 HG SER A 80 4.304 -4.912 -6.898 1.00 0.00 H new ATOM 1224 N LEU A 81 -0.443 -3.744 -7.590 1.00 0.00 N ATOM 1225 CA LEU A 81 -1.695 -4.468 -7.401 1.00 0.00 C ATOM 1226 C LEU A 81 -2.387 -4.718 -8.737 1.00 0.00 C ATOM 1227 O LEU A 81 -3.035 -5.747 -8.930 1.00 0.00 O ATOM 1228 CB LEU A 81 -2.624 -3.689 -6.469 1.00 0.00 C ATOM 1229 CG LEU A 81 -2.255 -3.749 -4.986 1.00 0.00 C ATOM 1230 CD1 LEU A 81 -2.917 -2.612 -4.225 1.00 0.00 C ATOM 1231 CD2 LEU A 81 -2.652 -5.093 -4.393 1.00 0.00 C ATOM 0 H LEU A 81 -0.415 -2.827 -7.144 1.00 0.00 H new ATOM 0 HA LEU A 81 -1.463 -5.432 -6.948 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -2.636 -2.645 -6.783 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -3.638 -4.070 -6.591 1.00 0.00 H new ATOM 0 HG LEU A 81 -1.174 -3.638 -4.895 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -2.643 -2.671 -3.172 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -2.584 -1.658 -4.634 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -4.000 -2.690 -4.323 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -2.382 -5.119 -3.337 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -3.728 -5.233 -4.496 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -2.130 -5.892 -4.920 1.00 0.00 H new ATOM 1243 N LEU A 82 -2.248 -3.768 -9.656 1.00 0.00 N ATOM 1244 CA LEU A 82 -2.861 -3.884 -10.974 1.00 0.00 C ATOM 1245 C LEU A 82 -2.266 -5.052 -11.753 1.00 0.00 C ATOM 1246 O LEU A 82 -2.966 -5.734 -12.501 1.00 0.00 O ATOM 1247 CB LEU A 82 -2.678 -2.585 -11.762 1.00 0.00 C ATOM 1248 CG LEU A 82 -3.751 -1.523 -11.516 1.00 0.00 C ATOM 1249 CD1 LEU A 82 -3.434 -0.256 -12.294 1.00 0.00 C ATOM 1250 CD2 LEU A 82 -5.125 -2.056 -11.896 1.00 0.00 C ATOM 0 H LEU A 82 -1.716 -2.909 -9.512 1.00 0.00 H new ATOM 0 HA LEU A 82 -3.926 -4.070 -10.834 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -1.705 -2.161 -11.514 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -2.660 -2.822 -12.826 1.00 0.00 H new ATOM 0 HG LEU A 82 -3.759 -1.280 -10.454 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -4.208 0.489 -12.107 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -2.468 0.136 -11.974 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -3.398 -0.483 -13.360 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -5.876 -1.287 -11.715 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -5.131 -2.327 -12.952 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -5.353 -2.936 -11.294 1.00 0.00 H new ATOM 1262 N ALA A 83 -0.968 -5.278 -11.572 1.00 0.00 N ATOM 1263 CA ALA A 83 -0.280 -6.366 -12.258 1.00 0.00 C ATOM 1264 C ALA A 83 -0.902 -7.714 -11.909 1.00 0.00 C ATOM 1265 O ALA A 83 -0.897 -8.639 -12.722 1.00 0.00 O ATOM 1266 CB ALA A 83 1.200 -6.357 -11.906 1.00 0.00 C ATOM 0 H ALA A 83 -0.373 -4.723 -10.957 1.00 0.00 H new ATOM 0 HA ALA A 83 -0.388 -6.214 -13.332 1.00 0.00 H new ATOM 0 HB1 ALA A 83 1.702 -7.174 -12.424 1.00 0.00 H new ATOM 0 HB2 ALA A 83 1.641 -5.408 -12.211 1.00 0.00 H new ATOM 0 HB3 ALA A 83 1.319 -6.483 -10.830 1.00 0.00 H new ATOM 1272 N MET A 84 -1.435 -7.818 -10.697 1.00 0.00 N ATOM 1273 CA MET A 84 -2.062 -9.053 -10.240 1.00 0.00 C ATOM 1274 C MET A 84 -3.586 -8.956 -10.292 1.00 0.00 C ATOM 1275 O MET A 84 -4.284 -9.954 -10.117 1.00 0.00 O ATOM 1276 CB MET A 84 -1.611 -9.380 -8.815 1.00 0.00 C ATOM 1277 CG MET A 84 -0.101 -9.444 -8.654 1.00 0.00 C ATOM 1278 SD MET A 84 0.404 -9.717 -6.945 1.00 0.00 S ATOM 1279 CE MET A 84 -0.229 -11.368 -6.662 1.00 0.00 C ATOM 0 H MET A 84 -1.446 -7.062 -10.013 1.00 0.00 H new ATOM 0 HA MET A 84 -1.749 -9.853 -10.911 1.00 0.00 H new ATOM 0 HB2 MET A 84 -2.009 -8.627 -8.135 1.00 0.00 H new ATOM 0 HB3 MET A 84 -2.041 -10.337 -8.517 1.00 0.00 H new ATOM 0 HG2 MET A 84 0.293 -10.246 -9.278 1.00 0.00 H new ATOM 0 HG3 MET A 84 0.339 -8.514 -9.015 1.00 0.00 H new ATOM 0 HE1 MET A 84 0.370 -11.861 -5.897 1.00 0.00 H new ATOM 0 HE2 MET A 84 -1.265 -11.308 -6.329 1.00 0.00 H new ATOM 0 HE3 MET A 84 -0.178 -11.941 -7.588 1.00 0.00 H new ATOM 1289 N ASN A 85 -4.100 -7.751 -10.532 1.00 0.00 N ATOM 1290 CA ASN A 85 -5.541 -7.535 -10.603 1.00 0.00 C ATOM 1291 C ASN A 85 -6.195 -7.774 -9.247 1.00 0.00 C ATOM 1292 O ASN A 85 -6.770 -8.835 -9.002 1.00 0.00 O ATOM 1293 CB ASN A 85 -6.168 -8.453 -11.655 1.00 0.00 C ATOM 1294 CG ASN A 85 -5.444 -8.387 -12.985 1.00 0.00 C ATOM 1295 OD1 ASN A 85 -4.790 -9.345 -13.398 1.00 0.00 O ATOM 1296 ND2 ASN A 85 -5.558 -7.251 -13.664 1.00 0.00 N ATOM 0 H ASN A 85 -3.540 -6.912 -10.680 1.00 0.00 H new ATOM 0 HA ASN A 85 -5.712 -6.498 -10.891 1.00 0.00 H new ATOM 0 HB2 ASN A 85 -6.158 -9.480 -11.290 1.00 0.00 H new ATOM 0 HB3 ASN A 85 -7.212 -8.176 -11.799 1.00 0.00 H new ATOM 0 HD21 ASN A 85 -5.093 -7.147 -14.566 1.00 0.00 H new ATOM 0 HD22 ASN A 85 -6.110 -6.483 -13.283 1.00 0.00 H new ATOM 1303 N LEU A 86 -6.103 -6.782 -8.368 1.00 0.00 N ATOM 1304 CA LEU A 86 -6.685 -6.885 -7.034 1.00 0.00 C ATOM 1305 C LEU A 86 -7.294 -5.554 -6.603 1.00 0.00 C ATOM 1306 O LEU A 86 -6.707 -4.819 -5.808 1.00 0.00 O ATOM 1307 CB LEU A 86 -5.624 -7.326 -6.025 1.00 0.00 C ATOM 1308 CG LEU A 86 -4.730 -8.478 -6.486 1.00 0.00 C ATOM 1309 CD1 LEU A 86 -3.488 -8.572 -5.614 1.00 0.00 C ATOM 1310 CD2 LEU A 86 -5.498 -9.790 -6.465 1.00 0.00 C ATOM 0 H LEU A 86 -5.631 -5.897 -8.555 1.00 0.00 H new ATOM 0 HA LEU A 86 -7.477 -7.633 -7.066 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -4.993 -6.470 -5.787 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -6.123 -7.621 -5.102 1.00 0.00 H new ATOM 0 HG LEU A 86 -4.415 -8.280 -7.511 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -2.864 -9.397 -5.957 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -2.926 -7.640 -5.680 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -3.782 -8.746 -4.579 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -4.846 -10.598 -6.796 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -5.843 -9.994 -5.451 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -6.357 -9.720 -7.133 1.00 0.00 H new ATOM 1322 N MET A 87 -8.474 -5.252 -7.132 1.00 0.00 N ATOM 1323 CA MET A 87 -9.166 -4.010 -6.803 1.00 0.00 C ATOM 1324 C MET A 87 -9.515 -3.951 -5.319 1.00 0.00 C ATOM 1325 O MET A 87 -9.689 -2.870 -4.756 1.00 0.00 O ATOM 1326 CB MET A 87 -10.437 -3.875 -7.644 1.00 0.00 C ATOM 1327 CG MET A 87 -10.189 -3.328 -9.041 1.00 0.00 C ATOM 1328 SD MET A 87 -10.703 -1.608 -9.217 1.00 0.00 S ATOM 1329 CE MET A 87 -9.123 -0.770 -9.124 1.00 0.00 C ATOM 0 H MET A 87 -8.972 -5.850 -7.791 1.00 0.00 H new ATOM 0 HA MET A 87 -8.496 -3.181 -7.029 1.00 0.00 H new ATOM 0 HB2 MET A 87 -10.914 -4.852 -7.725 1.00 0.00 H new ATOM 0 HB3 MET A 87 -11.137 -3.220 -7.126 1.00 0.00 H new ATOM 0 HG2 MET A 87 -9.128 -3.412 -9.276 1.00 0.00 H new ATOM 0 HG3 MET A 87 -10.726 -3.939 -9.767 1.00 0.00 H new ATOM 0 HE1 MET A 87 -9.233 0.150 -8.551 1.00 0.00 H new ATOM 0 HE2 MET A 87 -8.396 -1.418 -8.635 1.00 0.00 H new ATOM 0 HE3 MET A 87 -8.778 -0.532 -10.130 1.00 0.00 H new ATOM 1339 N GLU A 88 -9.619 -5.118 -4.689 1.00 0.00 N ATOM 1340 CA GLU A 88 -9.950 -5.197 -3.270 1.00 0.00 C ATOM 1341 C GLU A 88 -8.980 -4.366 -2.433 1.00 0.00 C ATOM 1342 O GLU A 88 -9.385 -3.674 -1.499 1.00 0.00 O ATOM 1343 CB GLU A 88 -9.928 -6.652 -2.800 1.00 0.00 C ATOM 1344 CG GLU A 88 -11.227 -7.396 -3.062 1.00 0.00 C ATOM 1345 CD GLU A 88 -11.165 -8.255 -4.309 1.00 0.00 C ATOM 1346 OE1 GLU A 88 -11.360 -7.710 -5.416 1.00 0.00 O ATOM 1347 OE2 GLU A 88 -10.923 -9.474 -4.180 1.00 0.00 O ATOM 0 H GLU A 88 -9.479 -6.022 -5.139 1.00 0.00 H new ATOM 0 HA GLU A 88 -10.953 -4.793 -3.136 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -9.113 -7.174 -3.300 1.00 0.00 H new ATOM 0 HB3 GLU A 88 -9.714 -6.677 -1.731 1.00 0.00 H new ATOM 0 HG2 GLU A 88 -11.461 -8.025 -2.203 1.00 0.00 H new ATOM 0 HG3 GLU A 88 -12.040 -6.677 -3.161 1.00 0.00 H new ATOM 1354 N LEU A 89 -7.698 -4.440 -2.774 1.00 0.00 N ATOM 1355 CA LEU A 89 -6.671 -3.696 -2.054 1.00 0.00 C ATOM 1356 C LEU A 89 -6.477 -2.309 -2.658 1.00 0.00 C ATOM 1357 O LEU A 89 -6.140 -1.357 -1.956 1.00 0.00 O ATOM 1358 CB LEU A 89 -5.347 -4.464 -2.073 1.00 0.00 C ATOM 1359 CG LEU A 89 -5.156 -5.455 -0.924 1.00 0.00 C ATOM 1360 CD1 LEU A 89 -3.898 -6.282 -1.136 1.00 0.00 C ATOM 1361 CD2 LEU A 89 -5.096 -4.719 0.407 1.00 0.00 C ATOM 0 H LEU A 89 -7.345 -5.008 -3.545 1.00 0.00 H new ATOM 0 HA LEU A 89 -7.000 -3.579 -1.022 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -5.273 -5.006 -3.016 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -4.528 -3.745 -2.053 1.00 0.00 H new ATOM 0 HG LEU A 89 -6.010 -6.132 -0.905 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -3.779 -6.981 -0.309 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -3.980 -6.836 -2.071 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -3.032 -5.622 -1.181 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -4.960 -5.438 1.215 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -4.260 -4.020 0.399 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -6.025 -4.171 0.562 1.00 0.00 H new ATOM 1373 N VAL A 90 -6.692 -2.204 -3.965 1.00 0.00 N ATOM 1374 CA VAL A 90 -6.540 -0.934 -4.665 1.00 0.00 C ATOM 1375 C VAL A 90 -7.656 0.037 -4.291 1.00 0.00 C ATOM 1376 O VAL A 90 -7.460 1.252 -4.289 1.00 0.00 O ATOM 1377 CB VAL A 90 -6.537 -1.131 -6.193 1.00 0.00 C ATOM 1378 CG1 VAL A 90 -6.228 0.179 -6.902 1.00 0.00 C ATOM 1379 CG2 VAL A 90 -5.539 -2.208 -6.590 1.00 0.00 C ATOM 0 H VAL A 90 -6.972 -2.983 -4.561 1.00 0.00 H new ATOM 0 HA VAL A 90 -5.581 -0.517 -4.358 1.00 0.00 H new ATOM 0 HB VAL A 90 -7.531 -1.457 -6.500 1.00 0.00 H new ATOM 0 HG11 VAL A 90 -6.231 0.019 -7.980 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -6.985 0.920 -6.644 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -5.247 0.538 -6.591 1.00 0.00 H new ATOM 0 HG21 VAL A 90 -5.551 -2.334 -7.673 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -4.540 -1.914 -6.269 1.00 0.00 H new ATOM 0 HG23 VAL A 90 -5.811 -3.150 -6.113 1.00 0.00 H new ATOM 1389 N ASP A 91 -8.826 -0.507 -3.973 1.00 0.00 N ATOM 1390 CA ASP A 91 -9.973 0.311 -3.596 1.00 0.00 C ATOM 1391 C ASP A 91 -9.760 0.948 -2.227 1.00 0.00 C ATOM 1392 O ASP A 91 -10.147 2.094 -1.998 1.00 0.00 O ATOM 1393 CB ASP A 91 -11.248 -0.533 -3.585 1.00 0.00 C ATOM 1394 CG ASP A 91 -12.502 0.311 -3.702 1.00 0.00 C ATOM 1395 OD1 ASP A 91 -12.429 1.524 -3.416 1.00 0.00 O ATOM 1396 OD2 ASP A 91 -13.557 -0.242 -4.078 1.00 0.00 O ATOM 0 H ASP A 91 -9.005 -1.511 -3.969 1.00 0.00 H new ATOM 0 HA ASP A 91 -10.079 1.105 -4.335 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -11.215 -1.246 -4.409 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -11.288 -1.113 -2.663 1.00 0.00 H new ATOM 1401 N TYR A 92 -9.144 0.197 -1.320 1.00 0.00 N ATOM 1402 CA TYR A 92 -8.880 0.687 0.028 1.00 0.00 C ATOM 1403 C TYR A 92 -7.716 1.672 0.031 1.00 0.00 C ATOM 1404 O TYR A 92 -7.692 2.620 0.816 1.00 0.00 O ATOM 1405 CB TYR A 92 -8.578 -0.481 0.968 1.00 0.00 C ATOM 1406 CG TYR A 92 -8.429 -0.072 2.416 1.00 0.00 C ATOM 1407 CD1 TYR A 92 -7.194 0.309 2.927 1.00 0.00 C ATOM 1408 CD2 TYR A 92 -9.522 -0.068 3.272 1.00 0.00 C ATOM 1409 CE1 TYR A 92 -7.054 0.682 4.250 1.00 0.00 C ATOM 1410 CE2 TYR A 92 -9.391 0.304 4.596 1.00 0.00 C ATOM 1411 CZ TYR A 92 -8.155 0.678 5.080 1.00 0.00 C ATOM 1412 OH TYR A 92 -8.019 1.050 6.398 1.00 0.00 O ATOM 0 H TYR A 92 -8.818 -0.754 -1.494 1.00 0.00 H new ATOM 0 HA TYR A 92 -9.772 1.206 0.380 1.00 0.00 H new ATOM 0 HB2 TYR A 92 -9.378 -1.217 0.888 1.00 0.00 H new ATOM 0 HB3 TYR A 92 -7.661 -0.971 0.642 1.00 0.00 H new ATOM 0 HD1 TYR A 92 -6.330 0.314 2.279 1.00 0.00 H new ATOM 0 HD2 TYR A 92 -10.491 -0.361 2.896 1.00 0.00 H new ATOM 0 HE1 TYR A 92 -6.087 0.975 4.632 1.00 0.00 H new ATOM 0 HE2 TYR A 92 -10.252 0.302 5.248 1.00 0.00 H new ATOM 0 HH TYR A 92 -8.889 0.994 6.845 1.00 0.00 H new ATOM 1422 N LEU A 93 -6.749 1.440 -0.852 1.00 0.00 N ATOM 1423 CA LEU A 93 -5.580 2.306 -0.951 1.00 0.00 C ATOM 1424 C LEU A 93 -5.878 3.531 -1.809 1.00 0.00 C ATOM 1425 O LEU A 93 -5.274 4.589 -1.628 1.00 0.00 O ATOM 1426 CB LEU A 93 -4.397 1.534 -1.537 1.00 0.00 C ATOM 1427 CG LEU A 93 -3.939 0.327 -0.715 1.00 0.00 C ATOM 1428 CD1 LEU A 93 -2.929 -0.498 -1.497 1.00 0.00 C ATOM 1429 CD2 LEU A 93 -3.348 0.780 0.611 1.00 0.00 C ATOM 0 H LEU A 93 -6.752 0.660 -1.509 1.00 0.00 H new ATOM 0 HA LEU A 93 -5.324 2.644 0.053 1.00 0.00 H new ATOM 0 HB2 LEU A 93 -4.665 1.193 -2.537 1.00 0.00 H new ATOM 0 HB3 LEU A 93 -3.556 2.218 -1.649 1.00 0.00 H new ATOM 0 HG LEU A 93 -4.807 -0.299 -0.508 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -2.614 -1.352 -0.897 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -3.386 -0.852 -2.421 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -2.062 0.118 -1.734 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -3.027 -0.091 1.183 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -2.491 1.428 0.425 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -4.101 1.328 1.177 1.00 0.00 H new ATOM 1441 N ASN A 94 -6.813 3.384 -2.744 1.00 0.00 N ATOM 1442 CA ASN A 94 -7.188 4.480 -3.630 1.00 0.00 C ATOM 1443 C ASN A 94 -7.658 5.693 -2.831 1.00 0.00 C ATOM 1444 O ASN A 94 -7.413 6.836 -3.217 1.00 0.00 O ATOM 1445 CB ASN A 94 -8.288 4.030 -4.594 1.00 0.00 C ATOM 1446 CG ASN A 94 -7.744 3.669 -5.963 1.00 0.00 C ATOM 1447 OD1 ASN A 94 -6.776 4.262 -6.435 1.00 0.00 O ATOM 1448 ND2 ASN A 94 -8.366 2.687 -6.607 1.00 0.00 N ATOM 0 H ASN A 94 -7.324 2.517 -2.907 1.00 0.00 H new ATOM 0 HA ASN A 94 -6.307 4.767 -4.204 1.00 0.00 H new ATOM 0 HB2 ASN A 94 -8.806 3.168 -4.173 1.00 0.00 H new ATOM 0 HB3 ASN A 94 -9.025 4.826 -4.697 1.00 0.00 H new ATOM 0 HD21 ASN A 94 -8.044 2.398 -7.531 1.00 0.00 H new ATOM 0 HD22 ASN A 94 -9.166 2.222 -6.178 1.00 0.00 H new ATOM 1455 N GLN A 95 -8.334 5.436 -1.716 1.00 0.00 N ATOM 1456 CA GLN A 95 -8.836 6.508 -0.864 1.00 0.00 C ATOM 1457 C GLN A 95 -7.684 7.262 -0.206 1.00 0.00 C ATOM 1458 O GLN A 95 -7.757 8.475 -0.007 1.00 0.00 O ATOM 1459 CB GLN A 95 -9.773 5.940 0.206 1.00 0.00 C ATOM 1460 CG GLN A 95 -11.216 6.395 0.053 1.00 0.00 C ATOM 1461 CD GLN A 95 -11.397 7.868 0.361 1.00 0.00 C ATOM 1462 OE1 GLN A 95 -10.447 8.648 0.305 1.00 0.00 O ATOM 1463 NE2 GLN A 95 -12.623 8.257 0.690 1.00 0.00 N ATOM 0 H GLN A 95 -8.547 4.496 -1.382 1.00 0.00 H new ATOM 0 HA GLN A 95 -9.393 7.207 -1.488 1.00 0.00 H new ATOM 0 HB2 GLN A 95 -9.738 4.851 0.167 1.00 0.00 H new ATOM 0 HB3 GLN A 95 -9.410 6.236 1.190 1.00 0.00 H new ATOM 0 HG2 GLN A 95 -11.550 6.197 -0.965 1.00 0.00 H new ATOM 0 HG3 GLN A 95 -11.851 5.808 0.717 1.00 0.00 H new ATOM 0 HE21 GLN A 95 -13.382 7.576 0.724 1.00 0.00 H new ATOM 0 HE22 GLN A 95 -12.806 9.236 0.909 1.00 0.00 H new ATOM 1472 N VAL A 96 -6.621 6.536 0.126 1.00 0.00 N ATOM 1473 CA VAL A 96 -5.454 7.137 0.760 1.00 0.00 C ATOM 1474 C VAL A 96 -4.403 7.517 -0.278 1.00 0.00 C ATOM 1475 O VAL A 96 -3.600 6.684 -0.698 1.00 0.00 O ATOM 1476 CB VAL A 96 -4.819 6.182 1.790 1.00 0.00 C ATOM 1477 CG1 VAL A 96 -3.702 6.882 2.551 1.00 0.00 C ATOM 1478 CG2 VAL A 96 -5.874 5.652 2.750 1.00 0.00 C ATOM 0 H VAL A 96 -6.544 5.531 -0.034 1.00 0.00 H new ATOM 0 HA VAL A 96 -5.799 8.035 1.273 1.00 0.00 H new ATOM 0 HB VAL A 96 -4.389 5.336 1.254 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -3.266 6.192 3.273 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -2.933 7.208 1.850 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -4.106 7.748 3.075 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -5.406 4.980 3.469 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -6.336 6.485 3.279 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -6.636 5.111 2.190 1.00 0.00 H new ATOM 1488 N CYS A 97 -4.417 8.780 -0.689 1.00 0.00 N ATOM 1489 CA CYS A 97 -3.466 9.272 -1.680 1.00 0.00 C ATOM 1490 C CYS A 97 -2.936 10.649 -1.294 1.00 0.00 C ATOM 1491 O CYS A 97 -1.734 10.904 -1.360 1.00 0.00 O ATOM 1492 CB CYS A 97 -4.121 9.334 -3.061 1.00 0.00 C ATOM 1493 SG CYS A 97 -5.757 10.104 -3.065 1.00 0.00 S ATOM 0 H CYS A 97 -5.076 9.482 -0.352 1.00 0.00 H new ATOM 0 HA CYS A 97 -2.627 8.577 -1.714 1.00 0.00 H new ATOM 0 HB2 CYS A 97 -3.469 9.887 -3.737 1.00 0.00 H new ATOM 0 HB3 CYS A 97 -4.206 8.322 -3.457 1.00 0.00 H new ATOM 0 HG CYS A 97 -6.671 9.181 -3.119 1.00 0.00 H new ATOM 1499 N LEU A 98 -3.842 11.535 -0.890 1.00 0.00 N ATOM 1500 CA LEU A 98 -3.466 12.887 -0.494 1.00 0.00 C ATOM 1501 C LEU A 98 -2.841 13.643 -1.662 1.00 0.00 C ATOM 1502 O LEU A 98 -1.967 14.489 -1.473 1.00 0.00 O ATOM 1503 CB LEU A 98 -2.489 12.844 0.685 1.00 0.00 C ATOM 1504 CG LEU A 98 -3.143 12.896 2.069 1.00 0.00 C ATOM 1505 CD1 LEU A 98 -2.571 11.816 2.974 1.00 0.00 C ATOM 1506 CD2 LEU A 98 -2.958 14.271 2.694 1.00 0.00 C ATOM 0 H LEU A 98 -4.841 11.340 -0.829 1.00 0.00 H new ATOM 0 HA LEU A 98 -4.370 13.413 -0.188 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -1.897 11.932 0.614 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -1.797 13.681 0.595 1.00 0.00 H new ATOM 0 HG LEU A 98 -4.211 12.712 1.951 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -3.049 11.870 3.952 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -2.756 10.836 2.533 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -1.497 11.966 3.086 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -3.429 14.290 3.677 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -1.894 14.484 2.797 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -3.419 15.025 2.056 1.00 0.00 H new ATOM 1518 N ASN A 99 -3.299 13.334 -2.872 1.00 0.00 N ATOM 1519 CA ASN A 99 -2.787 13.983 -4.073 1.00 0.00 C ATOM 1520 C ASN A 99 -3.886 14.779 -4.770 1.00 0.00 C ATOM 1521 O ASN A 99 -5.028 14.328 -4.865 1.00 0.00 O ATOM 1522 CB ASN A 99 -2.207 12.943 -5.033 1.00 0.00 C ATOM 1523 CG ASN A 99 -1.194 13.542 -5.989 1.00 0.00 C ATOM 1524 OD1 ASN A 99 -0.102 13.943 -5.585 1.00 0.00 O ATOM 1525 ND2 ASN A 99 -1.552 13.605 -7.267 1.00 0.00 N ATOM 0 H ASN A 99 -4.024 12.638 -3.046 1.00 0.00 H new ATOM 0 HA ASN A 99 -1.996 14.672 -3.775 1.00 0.00 H new ATOM 0 HB2 ASN A 99 -1.734 12.146 -4.459 1.00 0.00 H new ATOM 0 HB3 ASN A 99 -3.016 12.488 -5.604 1.00 0.00 H new ATOM 0 HD21 ASN A 99 -0.912 13.997 -7.957 1.00 0.00 H new ATOM 0 HD22 ASN A 99 -2.467 13.261 -7.558 1.00 0.00 H new ATOM 1532 N ASP A 100 -3.535 15.966 -5.253 1.00 0.00 N ATOM 1533 CA ASP A 100 -4.493 16.825 -5.940 1.00 0.00 C ATOM 1534 C ASP A 100 -4.723 16.348 -7.371 1.00 0.00 C ATOM 1535 O ASP A 100 -3.901 16.587 -8.255 1.00 0.00 O ATOM 1536 CB ASP A 100 -3.999 18.272 -5.947 1.00 0.00 C ATOM 1537 CG ASP A 100 -4.000 18.890 -4.562 1.00 0.00 C ATOM 1538 OD1 ASP A 100 -4.870 18.519 -3.747 1.00 0.00 O ATOM 1539 OD2 ASP A 100 -3.129 19.744 -4.293 1.00 0.00 O ATOM 0 H ASP A 100 -2.595 16.355 -5.182 1.00 0.00 H new ATOM 0 HA ASP A 100 -5.439 16.774 -5.402 1.00 0.00 H new ATOM 0 HB2 ASP A 100 -2.989 18.306 -6.356 1.00 0.00 H new ATOM 0 HB3 ASP A 100 -4.631 18.866 -6.607 1.00 0.00 H new ATOM 1544 N TYR A 101 -5.848 15.674 -7.590 1.00 0.00 N ATOM 1545 CA TYR A 101 -6.186 15.164 -8.915 1.00 0.00 C ATOM 1546 C TYR A 101 -7.627 15.509 -9.278 1.00 0.00 C ATOM 1547 O TYR A 101 -8.533 15.380 -8.455 1.00 0.00 O ATOM 1548 CB TYR A 101 -5.981 13.649 -8.969 1.00 0.00 C ATOM 1549 CG TYR A 101 -6.906 12.879 -8.052 1.00 0.00 C ATOM 1550 CD1 TYR A 101 -8.179 12.510 -8.467 1.00 0.00 C ATOM 1551 CD2 TYR A 101 -6.504 12.521 -6.771 1.00 0.00 C ATOM 1552 CE1 TYR A 101 -9.027 11.808 -7.632 1.00 0.00 C ATOM 1553 CE2 TYR A 101 -7.346 11.818 -5.930 1.00 0.00 C ATOM 1554 CZ TYR A 101 -8.605 11.464 -6.365 1.00 0.00 C ATOM 1555 OH TYR A 101 -9.445 10.764 -5.531 1.00 0.00 O ATOM 0 H TYR A 101 -6.540 15.469 -6.869 1.00 0.00 H new ATOM 0 HA TYR A 101 -5.524 15.638 -9.640 1.00 0.00 H new ATOM 0 HB2 TYR A 101 -6.131 13.307 -9.993 1.00 0.00 H new ATOM 0 HB3 TYR A 101 -4.948 13.421 -8.705 1.00 0.00 H new ATOM 0 HD1 TYR A 101 -8.512 12.776 -9.459 1.00 0.00 H new ATOM 0 HD2 TYR A 101 -5.518 12.796 -6.427 1.00 0.00 H new ATOM 0 HE1 TYR A 101 -10.015 11.530 -7.970 1.00 0.00 H new ATOM 0 HE2 TYR A 101 -7.019 11.547 -4.937 1.00 0.00 H new ATOM 0 HH TYR A 101 -8.995 10.600 -4.676 1.00 0.00 H new ATOM 1565 N ARG A 102 -7.831 15.946 -10.516 1.00 0.00 N ATOM 1566 CA ARG A 102 -9.163 16.308 -10.988 1.00 0.00 C ATOM 1567 C ARG A 102 -9.755 15.198 -11.849 1.00 0.00 C ATOM 1568 O ARG A 102 -9.089 14.666 -12.738 1.00 0.00 O ATOM 1569 CB ARG A 102 -9.107 17.613 -11.785 1.00 0.00 C ATOM 1570 CG ARG A 102 -8.810 18.835 -10.930 1.00 0.00 C ATOM 1571 CD ARG A 102 -7.488 19.482 -11.317 1.00 0.00 C ATOM 1572 NE ARG A 102 -6.942 20.301 -10.238 1.00 0.00 N ATOM 1573 CZ ARG A 102 -6.013 21.238 -10.416 1.00 0.00 C ATOM 1574 NH1 ARG A 102 -5.524 21.476 -11.627 1.00 0.00 N ATOM 1575 NH2 ARG A 102 -5.572 21.938 -9.380 1.00 0.00 N ATOM 0 H ARG A 102 -7.092 16.058 -11.210 1.00 0.00 H new ATOM 0 HA ARG A 102 -9.804 16.449 -10.118 1.00 0.00 H new ATOM 0 HB2 ARG A 102 -8.342 17.525 -12.557 1.00 0.00 H new ATOM 0 HB3 ARG A 102 -10.059 17.759 -12.295 1.00 0.00 H new ATOM 0 HG2 ARG A 102 -9.616 19.560 -11.039 1.00 0.00 H new ATOM 0 HG3 ARG A 102 -8.781 18.546 -9.879 1.00 0.00 H new ATOM 0 HD2 ARG A 102 -6.769 18.707 -11.583 1.00 0.00 H new ATOM 0 HD3 ARG A 102 -7.633 20.100 -12.203 1.00 0.00 H new ATOM 0 HE ARG A 102 -7.293 20.146 -9.293 1.00 0.00 H new ATOM 0 HH11 ARG A 102 -5.860 20.940 -12.427 1.00 0.00 H new ATOM 0 HH12 ARG A 102 -4.812 22.195 -11.757 1.00 0.00 H new ATOM 0 HH21 ARG A 102 -5.944 21.758 -8.448 1.00 0.00 H new ATOM 0 HH22 ARG A 102 -4.860 22.656 -9.515 1.00 0.00 H new ATOM 1589 N GLU A 103 -11.010 14.851 -11.579 1.00 0.00 N ATOM 1590 CA GLU A 103 -11.692 13.802 -12.328 1.00 0.00 C ATOM 1591 C GLU A 103 -12.302 14.359 -13.611 1.00 0.00 C ATOM 1592 O GLU A 103 -12.904 15.432 -13.609 1.00 0.00 O ATOM 1593 CB GLU A 103 -12.782 13.160 -11.468 1.00 0.00 C ATOM 1594 CG GLU A 103 -13.718 14.168 -10.820 1.00 0.00 C ATOM 1595 CD GLU A 103 -13.441 14.353 -9.341 1.00 0.00 C ATOM 1596 OE1 GLU A 103 -12.256 14.491 -8.972 1.00 0.00 O ATOM 1597 OE2 GLU A 103 -14.410 14.360 -8.552 1.00 0.00 O ATOM 0 H GLU A 103 -11.575 15.281 -10.847 1.00 0.00 H new ATOM 0 HA GLU A 103 -10.956 13.044 -12.596 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -13.367 12.479 -12.086 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -12.312 12.560 -10.689 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -13.620 15.128 -11.327 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -14.749 13.840 -10.955 1.00 0.00 H new ATOM 1604 N ILE A 104 -12.140 13.621 -14.705 1.00 0.00 N ATOM 1605 CA ILE A 104 -12.675 14.040 -15.995 1.00 0.00 C ATOM 1606 C ILE A 104 -13.268 12.855 -16.753 1.00 0.00 C ATOM 1607 O ILE A 104 -12.600 11.841 -16.962 1.00 0.00 O ATOM 1608 CB ILE A 104 -11.589 14.708 -16.863 1.00 0.00 C ATOM 1609 CG1 ILE A 104 -12.199 15.264 -18.152 1.00 0.00 C ATOM 1610 CG2 ILE A 104 -10.475 13.720 -17.180 1.00 0.00 C ATOM 1611 CD1 ILE A 104 -12.606 16.717 -18.049 1.00 0.00 C ATOM 0 H ILE A 104 -11.643 12.731 -14.723 1.00 0.00 H new ATOM 0 HA ILE A 104 -13.462 14.767 -15.794 1.00 0.00 H new ATOM 0 HB ILE A 104 -11.161 15.538 -16.300 1.00 0.00 H new ATOM 0 HG12 ILE A 104 -11.479 15.153 -18.963 1.00 0.00 H new ATOM 0 HG13 ILE A 104 -13.072 14.668 -18.418 1.00 0.00 H new ATOM 0 HG21 ILE A 104 -9.718 14.209 -17.793 1.00 0.00 H new ATOM 0 HG22 ILE A 104 -10.021 13.373 -16.252 1.00 0.00 H new ATOM 0 HG23 ILE A 104 -10.887 12.869 -17.723 1.00 0.00 H new ATOM 0 HD11 ILE A 104 -13.030 17.044 -18.998 1.00 0.00 H new ATOM 0 HD12 ILE A 104 -13.350 16.831 -17.261 1.00 0.00 H new ATOM 0 HD13 ILE A 104 -11.732 17.324 -17.814 1.00 0.00 H new ATOM 1623 N TYR A 105 -14.525 12.989 -17.161 1.00 0.00 N ATOM 1624 CA TYR A 105 -15.209 11.931 -17.895 1.00 0.00 C ATOM 1625 C TYR A 105 -15.284 10.654 -17.065 1.00 0.00 C ATOM 1626 O TYR A 105 -15.276 9.548 -17.606 1.00 0.00 O ATOM 1627 CB TYR A 105 -14.492 11.652 -19.217 1.00 0.00 C ATOM 1628 CG TYR A 105 -15.376 11.014 -20.265 1.00 0.00 C ATOM 1629 CD1 TYR A 105 -16.151 11.793 -21.116 1.00 0.00 C ATOM 1630 CD2 TYR A 105 -15.437 9.633 -20.403 1.00 0.00 C ATOM 1631 CE1 TYR A 105 -16.960 11.213 -22.075 1.00 0.00 C ATOM 1632 CE2 TYR A 105 -16.244 9.046 -21.359 1.00 0.00 C ATOM 1633 CZ TYR A 105 -17.003 9.840 -22.193 1.00 0.00 C ATOM 1634 OH TYR A 105 -17.806 9.260 -23.146 1.00 0.00 O ATOM 0 H TYR A 105 -15.092 13.821 -16.996 1.00 0.00 H new ATOM 0 HA TYR A 105 -16.224 12.267 -18.105 1.00 0.00 H new ATOM 0 HB2 TYR A 105 -14.096 12.588 -19.610 1.00 0.00 H new ATOM 0 HB3 TYR A 105 -13.640 11.000 -19.027 1.00 0.00 H new ATOM 0 HD1 TYR A 105 -16.121 12.869 -21.027 1.00 0.00 H new ATOM 0 HD2 TYR A 105 -14.844 9.008 -19.752 1.00 0.00 H new ATOM 0 HE1 TYR A 105 -17.556 11.833 -22.729 1.00 0.00 H new ATOM 0 HE2 TYR A 105 -16.280 7.971 -21.453 1.00 0.00 H new ATOM 0 HH TYR A 105 -17.720 8.285 -23.097 1.00 0.00 H new ATOM 1644 N ARG A 106 -15.355 10.814 -15.748 1.00 0.00 N ATOM 1645 CA ARG A 106 -15.431 9.674 -14.842 1.00 0.00 C ATOM 1646 C ARG A 106 -16.033 10.083 -13.501 1.00 0.00 C ATOM 1647 O ARG A 106 -15.704 9.513 -12.461 1.00 0.00 O ATOM 1648 CB ARG A 106 -14.041 9.072 -14.629 1.00 0.00 C ATOM 1649 CG ARG A 106 -13.725 7.924 -15.576 1.00 0.00 C ATOM 1650 CD ARG A 106 -12.927 6.830 -14.882 1.00 0.00 C ATOM 1651 NE ARG A 106 -11.564 6.733 -15.402 1.00 0.00 N ATOM 1652 CZ ARG A 106 -10.578 7.557 -15.056 1.00 0.00 C ATOM 1653 NH1 ARG A 106 -10.797 8.539 -14.190 1.00 0.00 N ATOM 1654 NH2 ARG A 106 -9.369 7.398 -15.577 1.00 0.00 N ATOM 0 H ARG A 106 -15.362 11.722 -15.284 1.00 0.00 H new ATOM 0 HA ARG A 106 -16.078 8.924 -15.296 1.00 0.00 H new ATOM 0 HB2 ARG A 106 -13.292 9.854 -14.756 1.00 0.00 H new ATOM 0 HB3 ARG A 106 -13.961 8.717 -13.601 1.00 0.00 H new ATOM 0 HG2 ARG A 106 -14.654 7.507 -15.966 1.00 0.00 H new ATOM 0 HG3 ARG A 106 -13.162 8.300 -16.430 1.00 0.00 H new ATOM 0 HD2 ARG A 106 -12.893 7.030 -13.811 1.00 0.00 H new ATOM 0 HD3 ARG A 106 -13.434 5.874 -15.012 1.00 0.00 H new ATOM 0 HE ARG A 106 -11.357 5.990 -16.069 1.00 0.00 H new ATOM 0 HH11 ARG A 106 -11.725 8.665 -13.786 1.00 0.00 H new ATOM 0 HH12 ARG A 106 -10.037 9.167 -13.929 1.00 0.00 H new ATOM 0 HH21 ARG A 106 -9.195 6.645 -16.242 1.00 0.00 H new ATOM 0 HH22 ARG A 106 -8.613 8.029 -15.312 1.00 0.00 H new ATOM 1668 N GLU A 107 -16.918 11.075 -13.534 1.00 0.00 N ATOM 1669 CA GLU A 107 -17.567 11.561 -12.321 1.00 0.00 C ATOM 1670 C GLU A 107 -19.043 11.178 -12.304 1.00 0.00 C ATOM 1671 O GLU A 107 -19.752 11.354 -13.295 1.00 0.00 O ATOM 1672 CB GLU A 107 -17.421 13.080 -12.213 1.00 0.00 C ATOM 1673 CG GLU A 107 -17.856 13.824 -13.465 1.00 0.00 C ATOM 1674 CD GLU A 107 -16.682 14.293 -14.302 1.00 0.00 C ATOM 1675 OE1 GLU A 107 -15.714 13.519 -14.453 1.00 0.00 O ATOM 1676 OE2 GLU A 107 -16.732 15.433 -14.808 1.00 0.00 O ATOM 0 H GLU A 107 -17.202 11.557 -14.387 1.00 0.00 H new ATOM 0 HA GLU A 107 -17.079 11.094 -11.465 1.00 0.00 H new ATOM 0 HB2 GLU A 107 -18.010 13.434 -11.367 1.00 0.00 H new ATOM 0 HB3 GLU A 107 -16.380 13.322 -12.000 1.00 0.00 H new ATOM 0 HG2 GLU A 107 -18.490 13.174 -14.068 1.00 0.00 H new ATOM 0 HG3 GLU A 107 -18.461 14.685 -13.180 1.00 0.00 H new ATOM 1683 N HIS A 108 -19.501 10.653 -11.173 1.00 0.00 N ATOM 1684 CA HIS A 108 -20.893 10.245 -11.026 1.00 0.00 C ATOM 1685 C HIS A 108 -21.768 11.429 -10.627 1.00 0.00 C ATOM 1686 O HIS A 108 -22.943 11.494 -10.987 1.00 0.00 O ATOM 1687 CB HIS A 108 -21.014 9.132 -9.984 1.00 0.00 C ATOM 1688 CG HIS A 108 -22.310 8.386 -10.052 1.00 0.00 C ATOM 1689 ND1 HIS A 108 -23.429 8.724 -9.325 1.00 0.00 N ATOM 1690 CD2 HIS A 108 -22.655 7.298 -10.787 1.00 0.00 C ATOM 1691 CE1 HIS A 108 -24.398 7.850 -9.632 1.00 0.00 C ATOM 1692 NE2 HIS A 108 -23.979 6.964 -10.516 1.00 0.00 N ATOM 0 H HIS A 108 -18.928 10.500 -10.343 1.00 0.00 H new ATOM 0 HA HIS A 108 -21.238 9.869 -11.989 1.00 0.00 H new ATOM 0 HB2 HIS A 108 -20.192 8.429 -10.119 1.00 0.00 H new ATOM 0 HB3 HIS A 108 -20.905 9.564 -8.989 1.00 0.00 H new ATOM 0 HD2 HIS A 108 -22.005 6.775 -11.473 1.00 0.00 H new ATOM 0 HE1 HIS A 108 -25.392 7.868 -9.211 1.00 0.00 H new ATOM 0 HE2 HIS A 108 -24.514 6.194 -10.917 1.00 0.00 H new ATOM 1700 N VAL A 109 -21.188 12.362 -9.879 1.00 0.00 N ATOM 1701 CA VAL A 109 -21.915 13.543 -9.430 1.00 0.00 C ATOM 1702 C VAL A 109 -20.986 14.746 -9.307 1.00 0.00 C ATOM 1703 O VAL A 109 -19.775 14.628 -9.489 1.00 0.00 O ATOM 1704 CB VAL A 109 -22.601 13.298 -8.074 1.00 0.00 C ATOM 1705 CG1 VAL A 109 -23.757 12.322 -8.227 1.00 0.00 C ATOM 1706 CG2 VAL A 109 -21.596 12.791 -7.051 1.00 0.00 C ATOM 0 H VAL A 109 -20.216 12.323 -9.571 1.00 0.00 H new ATOM 0 HA VAL A 109 -22.677 13.751 -10.182 1.00 0.00 H new ATOM 0 HB VAL A 109 -23.003 14.246 -7.715 1.00 0.00 H new ATOM 0 HG11 VAL A 109 -24.229 12.162 -7.258 1.00 0.00 H new ATOM 0 HG12 VAL A 109 -24.489 12.731 -8.924 1.00 0.00 H new ATOM 0 HG13 VAL A 109 -23.383 11.372 -8.610 1.00 0.00 H new ATOM 0 HG21 VAL A 109 -22.099 12.624 -6.099 1.00 0.00 H new ATOM 0 HG22 VAL A 109 -21.161 11.855 -7.401 1.00 0.00 H new ATOM 0 HG23 VAL A 109 -20.806 13.531 -6.919 1.00 0.00 H new ATOM 1716 N SER A 110 -21.563 15.903 -8.998 1.00 0.00 N ATOM 1717 CA SER A 110 -20.787 17.128 -8.850 1.00 0.00 C ATOM 1718 C SER A 110 -21.347 17.995 -7.727 1.00 0.00 C ATOM 1719 O SER A 110 -22.293 18.756 -7.929 1.00 0.00 O ATOM 1720 CB SER A 110 -20.782 17.914 -10.162 1.00 0.00 C ATOM 1721 OG SER A 110 -19.769 17.444 -11.036 1.00 0.00 O ATOM 0 H SER A 110 -22.565 16.017 -8.845 1.00 0.00 H new ATOM 0 HA SER A 110 -19.764 16.852 -8.595 1.00 0.00 H new ATOM 0 HB2 SER A 110 -21.754 17.825 -10.646 1.00 0.00 H new ATOM 0 HB3 SER A 110 -20.625 18.973 -9.955 1.00 0.00 H new ATOM 0 HG SER A 110 -19.542 16.519 -10.806 1.00 0.00 H new ATOM 1727 N GLY A 111 -20.757 17.872 -6.542 1.00 0.00 N ATOM 1728 CA GLY A 111 -21.212 18.650 -5.404 1.00 0.00 C ATOM 1729 C GLY A 111 -20.863 20.123 -5.532 1.00 0.00 C ATOM 1730 O GLY A 111 -19.714 20.464 -5.814 1.00 0.00 O ATOM 0 H GLY A 111 -19.973 17.248 -6.350 1.00 0.00 H new ATOM 0 HA2 GLY A 111 -22.292 18.543 -5.303 1.00 0.00 H new ATOM 0 HA3 GLY A 111 -20.765 18.252 -4.493 1.00 0.00 H new ATOM 1734 N PRO A 112 -21.837 21.029 -5.330 1.00 0.00 N ATOM 1735 CA PRO A 112 -21.601 22.474 -5.429 1.00 0.00 C ATOM 1736 C PRO A 112 -20.453 22.935 -4.536 1.00 0.00 C ATOM 1737 O PRO A 112 -19.700 23.839 -4.894 1.00 0.00 O ATOM 1738 CB PRO A 112 -22.923 23.088 -4.960 1.00 0.00 C ATOM 1739 CG PRO A 112 -23.942 22.032 -5.204 1.00 0.00 C ATOM 1740 CD PRO A 112 -23.238 20.722 -4.989 1.00 0.00 C ATOM 0 HA PRO A 112 -21.315 22.770 -6.438 1.00 0.00 H new ATOM 0 HB2 PRO A 112 -22.880 23.360 -3.905 1.00 0.00 H new ATOM 0 HB3 PRO A 112 -23.155 23.997 -5.515 1.00 0.00 H new ATOM 0 HG2 PRO A 112 -24.786 22.138 -4.522 1.00 0.00 H new ATOM 0 HG3 PRO A 112 -24.340 22.100 -6.216 1.00 0.00 H new ATOM 0 HD2 PRO A 112 -23.335 20.378 -3.959 1.00 0.00 H new ATOM 0 HD3 PRO A 112 -23.645 19.937 -5.627 1.00 0.00 H new ATOM 1748 N SER A 113 -20.328 22.307 -3.371 1.00 0.00 N ATOM 1749 CA SER A 113 -19.273 22.652 -2.425 1.00 0.00 C ATOM 1750 C SER A 113 -19.407 24.099 -1.965 1.00 0.00 C ATOM 1751 O SER A 113 -20.039 24.918 -2.634 1.00 0.00 O ATOM 1752 CB SER A 113 -17.898 22.430 -3.059 1.00 0.00 C ATOM 1753 OG SER A 113 -16.975 21.922 -2.111 1.00 0.00 O ATOM 0 H SER A 113 -20.944 21.556 -3.060 1.00 0.00 H new ATOM 0 HA SER A 113 -19.373 22.003 -1.555 1.00 0.00 H new ATOM 0 HB2 SER A 113 -17.987 21.734 -3.893 1.00 0.00 H new ATOM 0 HB3 SER A 113 -17.526 23.370 -3.466 1.00 0.00 H new ATOM 0 HG SER A 113 -16.105 21.787 -2.541 1.00 0.00 H new ATOM 1759 N SER A 114 -18.807 24.409 -0.821 1.00 0.00 N ATOM 1760 CA SER A 114 -18.860 25.758 -0.271 1.00 0.00 C ATOM 1761 C SER A 114 -17.590 26.534 -0.610 1.00 0.00 C ATOM 1762 O SER A 114 -17.118 27.349 0.183 1.00 0.00 O ATOM 1763 CB SER A 114 -19.050 25.707 1.245 1.00 0.00 C ATOM 1764 OG SER A 114 -20.254 25.044 1.587 1.00 0.00 O ATOM 0 H SER A 114 -18.278 23.744 -0.257 1.00 0.00 H new ATOM 0 HA SER A 114 -19.710 26.272 -0.719 1.00 0.00 H new ATOM 0 HB2 SER A 114 -18.205 25.192 1.703 1.00 0.00 H new ATOM 0 HB3 SER A 114 -19.062 26.720 1.647 1.00 0.00 H new ATOM 0 HG SER A 114 -20.351 25.024 2.562 1.00 0.00 H new ATOM 1770 N GLY A 115 -17.041 26.272 -1.792 1.00 0.00 N ATOM 1771 CA GLY A 115 -15.831 26.953 -2.214 1.00 0.00 C ATOM 1772 C GLY A 115 -16.115 28.293 -2.864 1.00 0.00 C ATOM 1773 O GLY A 115 -15.379 28.666 -3.802 1.00 0.00 O ATOM 1774 OXT GLY A 115 -17.074 28.969 -2.436 1.00 0.00 O ATOM 0 H GLY A 115 -17.412 25.601 -2.464 1.00 0.00 H new ATOM 0 HA2 GLY A 115 -15.182 27.102 -1.351 1.00 0.00 H new ATOM 0 HA3 GLY A 115 -15.288 26.320 -2.916 1.00 0.00 H new TER 1778 GLY A 115