USER MOD reduce.3.24.130724 H: found=0, std=0, add=1289, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 1290 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 83 THR OG1 : rot -49:sc= 0.521 USER MOD Set 1.2: B 38 LYS NZ :NH3+ -175:sc= 0.365 (180deg=0) USER MOD Set 2.1: A 61 GLN : amide:sc= 1.26 K(o=2.5,f=-0.16) USER MOD Set 2.2: A 100 GLN : amide:sc= 1.26 K(o=2.5,f=-0.79) USER MOD Set 3.1: A 27 GLN : amide:sc= -0.192 K(o=-0.26,f=-1.7) USER MOD Set 3.2: A 30 LYS NZ :NH3+ -126:sc= -0.0691 (180deg=-0.545) USER MOD Set 3.3: A 31 TYR OH : rot 180:sc= 0 USER MOD Single : A 2 SER OG : rot -28:sc= 0.0883 USER MOD Single : A 5 GLN : amide:sc= 0 X(o=0,f=-0.45) USER MOD Single : A 6 GLN : amide:sc= 0 K(o=0,f=-0.54) USER MOD Single : A 10 HIS : no HD1:sc= -1.19 K(o=-1.2,f=-0.46) USER MOD Single : A 17 TYR OH : rot -50:sc= 0.75 USER MOD Single : A 22 THR OG1 : rot 124:sc= 0.56 USER MOD Single : A 24 SER OG : rot 180:sc= 0.0232 USER MOD Single : A 25 GLN : amide:sc= 0 K(o=0,f=-0.83) USER MOD Single : A 26 ASN : amide:sc= 0 X(o=0,f=-0.39) USER MOD Single : A 35 THR OG1 : rot 64:sc= 1.19 USER MOD Single : A 45 GLN : amide:sc= -0.102 K(o=-0.1,f=-0.69) USER MOD Single : A 57 TYR OH : rot 30:sc= 0.368 USER MOD Single : A 59 MET CE :methyl 155:sc= -0.604 (180deg=-1.31) USER MOD Single : A 66 SER OG : rot 180:sc= 0 USER MOD Single : A 68 ASN : amide:sc= -0.655 K(o=-0.66,f=-1.4) USER MOD Single : A 74 GLN : amide:sc= 0 K(o=0,f=-0.53) USER MOD Single : A 75 THR OG1 : rot 180:sc= -0.0854 USER MOD Single : A 76 SER OG : rot -150:sc= 0 USER MOD Single : A 77 GLN : amide:sc= 0 K(o=0,f=-0.6) USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 94 MET CE :methyl -155:sc= -0.0686 (180deg=-0.316) USER MOD Single : A 95 THR OG1 : rot 180:sc= 0 USER MOD Single : A 98 SER OG : rot 180:sc= 0 USER MOD Single : A 105 THR OG1 : rot -69:sc= 0.00876 USER MOD Single : A 107 MET CE :methyl -167:sc= -3.32! (180deg=-3.6) USER MOD Single : A 111 SER OG : rot -93:sc= 0.223 USER MOD Single : A 117 TYR OH : rot 180:sc= 0 USER MOD Single : A 123 THR OG1 : rot 170:sc= 0 USER MOD Single : A 124 SER OG : rot 180:sc= 0 USER MOD Single : A 128 THR OG1 : rot 78:sc= 0.0155 USER MOD Single : A 131 THR OG1 : rot 95:sc= 1.27 USER MOD Single : A 139 LYS NZ :NH3+ -170:sc=-0.00902 (180deg=-0.129) USER MOD Single : A 140 GLN : amide:sc= 0.981 K(o=0.98,f=-7.4!) USER MOD Single : A 141 THR OG1 : rot -12:sc= 0.978 USER MOD Single : B 28 MET CE :methyl -127:sc= 0 (180deg=-0.106) USER MOD Single : B 34 SER OG : rot 180:sc= 0 USER MOD Single : B 36 TYR OH : rot 180:sc= 0 USER MOD Single : B 37 GLN : amide:sc= 1.73 K(o=1.7,f=-7.1!) USER MOD Single : B 39 THR OG1 : rot 180:sc= 0 USER MOD Single : B 43 GLN : amide:sc= -0.779! C(o=-0.78!,f=-4.1!) USER MOD Single : B 48 MET CE :methyl 175:sc= -1.1 (180deg=-1.14) USER MOD Single : B 53 ASN : amide:sc= -0.0864 K(o=-0.086,f=-1.5!) USER MOD Single : B 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 18 N SER A 2 -7.505 -16.373 -5.864 1.00 0.00 N ATOM 19 CA SER A 2 -7.044 -15.686 -7.065 1.00 0.00 C ATOM 20 C SER A 2 -6.335 -14.376 -6.726 1.00 0.00 C ATOM 21 O SER A 2 -6.084 -13.565 -7.617 1.00 0.00 O ATOM 22 CB SER A 2 -8.230 -15.430 -7.988 1.00 0.00 C ATOM 23 OG SER A 2 -9.195 -14.634 -7.323 1.00 0.00 O ATOM 0 HA SER A 2 -6.319 -16.324 -7.571 1.00 0.00 H new ATOM 0 HB2 SER A 2 -7.894 -14.928 -8.895 1.00 0.00 H new ATOM 0 HB3 SER A 2 -8.675 -16.377 -8.294 1.00 0.00 H new ATOM 0 HG SER A 2 -9.140 -14.791 -6.357 1.00 0.00 H new ATOM 29 N LEU A 3 -6.007 -14.153 -5.449 1.00 0.00 N ATOM 30 CA LEU A 3 -5.358 -12.926 -5.000 1.00 0.00 C ATOM 31 C LEU A 3 -4.069 -12.651 -5.774 1.00 0.00 C ATOM 32 O LEU A 3 -3.727 -11.494 -6.015 1.00 0.00 O ATOM 33 CB LEU A 3 -5.080 -13.048 -3.496 1.00 0.00 C ATOM 34 CG LEU A 3 -4.251 -11.886 -2.938 1.00 0.00 C ATOM 35 CD1 LEU A 3 -4.942 -10.543 -3.158 1.00 0.00 C ATOM 36 CD2 LEU A 3 -4.035 -12.088 -1.438 1.00 0.00 C ATOM 0 H LEU A 3 -6.186 -14.822 -4.700 1.00 0.00 H new ATOM 0 HA LEU A 3 -6.020 -12.081 -5.190 1.00 0.00 H new ATOM 0 HB2 LEU A 3 -6.028 -13.099 -2.961 1.00 0.00 H new ATOM 0 HB3 LEU A 3 -4.556 -13.984 -3.305 1.00 0.00 H new ATOM 0 HG LEU A 3 -3.298 -11.874 -3.467 1.00 0.00 H new ATOM 0 HD11 LEU A 3 -4.323 -9.744 -2.749 1.00 0.00 H new ATOM 0 HD12 LEU A 3 -5.087 -10.379 -4.226 1.00 0.00 H new ATOM 0 HD13 LEU A 3 -5.910 -10.545 -2.657 1.00 0.00 H new ATOM 0 HD21 LEU A 3 -3.445 -11.262 -1.041 1.00 0.00 H new ATOM 0 HD22 LEU A 3 -5.000 -12.121 -0.933 1.00 0.00 H new ATOM 0 HD23 LEU A 3 -3.505 -13.026 -1.270 1.00 0.00 H new ATOM 48 N GLY A 4 -3.341 -13.697 -6.172 1.00 0.00 N ATOM 49 CA GLY A 4 -2.079 -13.524 -6.882 1.00 0.00 C ATOM 50 C GLY A 4 -2.269 -12.817 -8.224 1.00 0.00 C ATOM 51 O GLY A 4 -1.334 -12.205 -8.734 1.00 0.00 O ATOM 0 H GLY A 4 -3.606 -14.669 -6.013 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -1.391 -12.948 -6.263 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -1.620 -14.499 -7.047 1.00 0.00 H new ATOM 55 N GLN A 5 -3.477 -12.894 -8.796 1.00 0.00 N ATOM 56 CA GLN A 5 -3.791 -12.268 -10.072 1.00 0.00 C ATOM 57 C GLN A 5 -4.095 -10.778 -9.897 1.00 0.00 C ATOM 58 O GLN A 5 -4.372 -10.088 -10.878 1.00 0.00 O ATOM 59 CB GLN A 5 -4.996 -12.976 -10.698 1.00 0.00 C ATOM 60 CG GLN A 5 -4.726 -14.472 -10.881 1.00 0.00 C ATOM 61 CD GLN A 5 -5.968 -15.208 -11.381 1.00 0.00 C ATOM 62 OE1 GLN A 5 -6.795 -14.651 -12.097 1.00 0.00 O ATOM 63 NE2 GLN A 5 -6.103 -16.474 -11.004 1.00 0.00 N ATOM 0 H GLN A 5 -4.262 -13.395 -8.380 1.00 0.00 H new ATOM 0 HA GLN A 5 -2.925 -12.359 -10.727 1.00 0.00 H new ATOM 0 HB2 GLN A 5 -5.872 -12.837 -10.065 1.00 0.00 H new ATOM 0 HB3 GLN A 5 -5.225 -12.524 -11.663 1.00 0.00 H new ATOM 0 HG2 GLN A 5 -3.909 -14.611 -11.589 1.00 0.00 H new ATOM 0 HG3 GLN A 5 -4.403 -14.903 -9.933 1.00 0.00 H new ATOM 0 HE21 GLN A 5 -5.397 -16.907 -10.408 1.00 0.00 H new ATOM 0 HE22 GLN A 5 -6.913 -17.014 -11.310 1.00 0.00 H new ATOM 72 N GLN A 6 -4.043 -10.277 -8.659 1.00 0.00 N ATOM 73 CA GLN A 6 -4.332 -8.886 -8.345 1.00 0.00 C ATOM 74 C GLN A 6 -3.272 -8.321 -7.397 1.00 0.00 C ATOM 75 O GLN A 6 -3.376 -7.175 -6.960 1.00 0.00 O ATOM 76 CB GLN A 6 -5.728 -8.778 -7.726 1.00 0.00 C ATOM 77 CG GLN A 6 -6.793 -9.297 -8.698 1.00 0.00 C ATOM 78 CD GLN A 6 -8.201 -9.098 -8.148 1.00 0.00 C ATOM 79 OE1 GLN A 6 -8.419 -9.096 -6.940 1.00 0.00 O ATOM 80 NE2 GLN A 6 -9.177 -8.926 -9.035 1.00 0.00 N ATOM 0 H GLN A 6 -3.796 -10.836 -7.843 1.00 0.00 H new ATOM 0 HA GLN A 6 -4.309 -8.299 -9.263 1.00 0.00 H new ATOM 0 HB2 GLN A 6 -5.765 -9.350 -6.799 1.00 0.00 H new ATOM 0 HB3 GLN A 6 -5.938 -7.740 -7.469 1.00 0.00 H new ATOM 0 HG2 GLN A 6 -6.698 -8.779 -9.652 1.00 0.00 H new ATOM 0 HG3 GLN A 6 -6.624 -10.356 -8.892 1.00 0.00 H new ATOM 0 HE21 GLN A 6 -8.966 -8.932 -10.033 1.00 0.00 H new ATOM 0 HE22 GLN A 6 -10.136 -8.788 -8.717 1.00 0.00 H new ATOM 89 N LEU A 7 -2.257 -9.126 -7.082 1.00 0.00 N ATOM 90 CA LEU A 7 -1.146 -8.734 -6.229 1.00 0.00 C ATOM 91 C LEU A 7 0.096 -8.518 -7.098 1.00 0.00 C ATOM 92 O LEU A 7 0.847 -7.567 -6.895 1.00 0.00 O ATOM 93 CB LEU A 7 -0.936 -9.876 -5.225 1.00 0.00 C ATOM 94 CG LEU A 7 -0.141 -9.550 -3.953 1.00 0.00 C ATOM 95 CD1 LEU A 7 1.254 -9.009 -4.238 1.00 0.00 C ATOM 96 CD2 LEU A 7 -0.901 -8.555 -3.087 1.00 0.00 C ATOM 0 H LEU A 7 -2.187 -10.085 -7.421 1.00 0.00 H new ATOM 0 HA LEU A 7 -1.342 -7.804 -5.696 1.00 0.00 H new ATOM 0 HB2 LEU A 7 -1.916 -10.248 -4.926 1.00 0.00 H new ATOM 0 HB3 LEU A 7 -0.429 -10.692 -5.741 1.00 0.00 H new ATOM 0 HG LEU A 7 -0.021 -10.495 -3.423 1.00 0.00 H new ATOM 0 HD11 LEU A 7 1.762 -8.799 -3.297 1.00 0.00 H new ATOM 0 HD12 LEU A 7 1.823 -9.749 -4.801 1.00 0.00 H new ATOM 0 HD13 LEU A 7 1.176 -8.091 -4.821 1.00 0.00 H new ATOM 0 HD21 LEU A 7 -0.322 -8.336 -2.190 1.00 0.00 H new ATOM 0 HD22 LEU A 7 -1.063 -7.634 -3.648 1.00 0.00 H new ATOM 0 HD23 LEU A 7 -1.863 -8.981 -2.802 1.00 0.00 H new ATOM 108 N ALA A 8 0.308 -9.407 -8.072 1.00 0.00 N ATOM 109 CA ALA A 8 1.469 -9.379 -8.946 1.00 0.00 C ATOM 110 C ALA A 8 1.604 -8.103 -9.788 1.00 0.00 C ATOM 111 O ALA A 8 2.716 -7.583 -9.890 1.00 0.00 O ATOM 112 CB ALA A 8 1.415 -10.602 -9.856 1.00 0.00 C ATOM 0 H ALA A 8 -0.334 -10.174 -8.273 1.00 0.00 H new ATOM 0 HA ALA A 8 2.350 -9.391 -8.304 1.00 0.00 H new ATOM 0 HB1 ALA A 8 2.279 -10.599 -10.521 1.00 0.00 H new ATOM 0 HB2 ALA A 8 1.426 -11.508 -9.249 1.00 0.00 H new ATOM 0 HB3 ALA A 8 0.501 -10.574 -10.449 1.00 0.00 H new ATOM 118 N PRO A 9 0.534 -7.570 -10.399 1.00 0.00 N ATOM 119 CA PRO A 9 0.639 -6.436 -11.310 1.00 0.00 C ATOM 120 C PRO A 9 0.928 -5.113 -10.598 1.00 0.00 C ATOM 121 O PRO A 9 1.119 -4.099 -11.266 1.00 0.00 O ATOM 122 CB PRO A 9 -0.700 -6.390 -12.047 1.00 0.00 C ATOM 123 CG PRO A 9 -1.676 -6.967 -11.028 1.00 0.00 C ATOM 124 CD PRO A 9 -0.844 -8.021 -10.308 1.00 0.00 C ATOM 0 HA PRO A 9 1.483 -6.566 -11.987 1.00 0.00 H new ATOM 0 HB2 PRO A 9 -0.969 -5.373 -12.331 1.00 0.00 H new ATOM 0 HB3 PRO A 9 -0.677 -6.981 -12.962 1.00 0.00 H new ATOM 0 HG2 PRO A 9 -2.040 -6.203 -10.341 1.00 0.00 H new ATOM 0 HG3 PRO A 9 -2.550 -7.404 -11.510 1.00 0.00 H new ATOM 0 HD2 PRO A 9 -1.155 -8.121 -9.268 1.00 0.00 H new ATOM 0 HD3 PRO A 9 -0.966 -9.000 -10.772 1.00 0.00 H new ATOM 132 N HIS A 10 0.961 -5.108 -9.259 1.00 0.00 N ATOM 133 CA HIS A 10 1.242 -3.904 -8.484 1.00 0.00 C ATOM 134 C HIS A 10 2.228 -4.203 -7.355 1.00 0.00 C ATOM 135 O HIS A 10 2.413 -3.391 -6.451 1.00 0.00 O ATOM 136 CB HIS A 10 -0.060 -3.314 -7.945 1.00 0.00 C ATOM 137 CG HIS A 10 -1.048 -3.008 -9.035 1.00 0.00 C ATOM 138 ND1 HIS A 10 -0.943 -1.971 -9.965 1.00 0.00 N ATOM 139 CD2 HIS A 10 -2.190 -3.711 -9.271 1.00 0.00 C ATOM 140 CE1 HIS A 10 -2.029 -2.086 -10.748 1.00 0.00 C ATOM 141 NE2 HIS A 10 -2.793 -3.119 -10.355 1.00 0.00 N ATOM 0 H HIS A 10 0.794 -5.937 -8.689 1.00 0.00 H new ATOM 0 HA HIS A 10 1.707 -3.165 -9.136 1.00 0.00 H new ATOM 0 HB2 HIS A 10 -0.508 -4.014 -7.239 1.00 0.00 H new ATOM 0 HB3 HIS A 10 0.160 -2.401 -7.392 1.00 0.00 H new ATOM 0 HD2 HIS A 10 -2.551 -4.565 -8.716 1.00 0.00 H new ATOM 0 HE1 HIS A 10 -2.257 -1.436 -11.580 1.00 0.00 H new ATOM 0 HE2 HIS A 10 -3.669 -3.413 -10.787 1.00 0.00 H new ATOM 149 N LEU A 11 2.861 -5.376 -7.407 1.00 0.00 N ATOM 150 CA LEU A 11 3.817 -5.824 -6.411 1.00 0.00 C ATOM 151 C LEU A 11 4.987 -4.850 -6.197 1.00 0.00 C ATOM 152 O LEU A 11 5.377 -4.646 -5.048 1.00 0.00 O ATOM 153 CB LEU A 11 4.306 -7.209 -6.849 1.00 0.00 C ATOM 154 CG LEU A 11 5.321 -7.838 -5.896 1.00 0.00 C ATOM 155 CD1 LEU A 11 4.767 -7.964 -4.484 1.00 0.00 C ATOM 156 CD2 LEU A 11 5.646 -9.242 -6.399 1.00 0.00 C ATOM 0 H LEU A 11 2.716 -6.049 -8.160 1.00 0.00 H new ATOM 0 HA LEU A 11 3.325 -5.869 -5.439 1.00 0.00 H new ATOM 0 HB2 LEU A 11 3.447 -7.874 -6.940 1.00 0.00 H new ATOM 0 HB3 LEU A 11 4.754 -7.129 -7.840 1.00 0.00 H new ATOM 0 HG LEU A 11 6.203 -7.199 -5.868 1.00 0.00 H new ATOM 0 HD11 LEU A 11 5.519 -8.416 -3.837 1.00 0.00 H new ATOM 0 HD12 LEU A 11 4.509 -6.975 -4.105 1.00 0.00 H new ATOM 0 HD13 LEU A 11 3.876 -8.591 -4.497 1.00 0.00 H new ATOM 0 HD21 LEU A 11 6.370 -9.709 -5.731 1.00 0.00 H new ATOM 0 HD22 LEU A 11 4.735 -9.840 -6.422 1.00 0.00 H new ATOM 0 HD23 LEU A 11 6.065 -9.181 -7.403 1.00 0.00 H new ATOM 168 N PRO A 12 5.568 -4.237 -7.244 1.00 0.00 N ATOM 169 CA PRO A 12 6.725 -3.373 -7.084 1.00 0.00 C ATOM 170 C PRO A 12 6.343 -1.962 -6.639 1.00 0.00 C ATOM 171 O PRO A 12 7.226 -1.168 -6.312 1.00 0.00 O ATOM 172 CB PRO A 12 7.375 -3.336 -8.463 1.00 0.00 C ATOM 173 CG PRO A 12 6.167 -3.403 -9.393 1.00 0.00 C ATOM 174 CD PRO A 12 5.212 -4.337 -8.650 1.00 0.00 C ATOM 0 HA PRO A 12 7.390 -3.752 -6.308 1.00 0.00 H new ATOM 0 HB2 PRO A 12 7.955 -2.426 -8.615 1.00 0.00 H new ATOM 0 HB3 PRO A 12 8.053 -4.176 -8.616 1.00 0.00 H new ATOM 0 HG2 PRO A 12 5.726 -2.419 -9.553 1.00 0.00 H new ATOM 0 HG3 PRO A 12 6.434 -3.796 -10.374 1.00 0.00 H new ATOM 0 HD2 PRO A 12 4.175 -4.044 -8.812 1.00 0.00 H new ATOM 0 HD3 PRO A 12 5.313 -5.362 -9.006 1.00 0.00 H new ATOM 182 N PHE A 13 5.050 -1.622 -6.611 1.00 0.00 N ATOM 183 CA PHE A 13 4.625 -0.283 -6.226 1.00 0.00 C ATOM 184 C PHE A 13 4.927 -0.020 -4.752 1.00 0.00 C ATOM 185 O PHE A 13 5.017 1.136 -4.341 1.00 0.00 O ATOM 186 CB PHE A 13 3.133 -0.092 -6.507 1.00 0.00 C ATOM 187 CG PHE A 13 2.786 0.098 -7.967 1.00 0.00 C ATOM 188 CD1 PHE A 13 3.053 -0.912 -8.901 1.00 0.00 C ATOM 189 CD2 PHE A 13 2.188 1.297 -8.391 1.00 0.00 C ATOM 190 CE1 PHE A 13 2.724 -0.728 -10.251 1.00 0.00 C ATOM 191 CE2 PHE A 13 1.864 1.482 -9.740 1.00 0.00 C ATOM 192 CZ PHE A 13 2.126 0.468 -10.668 1.00 0.00 C ATOM 0 H PHE A 13 4.287 -2.256 -6.850 1.00 0.00 H new ATOM 0 HA PHE A 13 5.186 0.436 -6.823 1.00 0.00 H new ATOM 0 HB2 PHE A 13 2.592 -0.959 -6.128 1.00 0.00 H new ATOM 0 HB3 PHE A 13 2.779 0.774 -5.947 1.00 0.00 H new ATOM 0 HD1 PHE A 13 3.513 -1.835 -8.580 1.00 0.00 H new ATOM 0 HD2 PHE A 13 1.978 2.077 -7.674 1.00 0.00 H new ATOM 0 HE1 PHE A 13 2.931 -1.508 -10.969 1.00 0.00 H new ATOM 0 HE2 PHE A 13 1.412 2.407 -10.065 1.00 0.00 H new ATOM 0 HZ PHE A 13 1.867 0.608 -11.707 1.00 0.00 H new ATOM 202 N LEU A 14 5.088 -1.078 -3.950 1.00 0.00 N ATOM 203 CA LEU A 14 5.435 -0.922 -2.545 1.00 0.00 C ATOM 204 C LEU A 14 6.894 -0.494 -2.399 1.00 0.00 C ATOM 205 O LEU A 14 7.288 0.026 -1.358 1.00 0.00 O ATOM 206 CB LEU A 14 5.184 -2.241 -1.811 1.00 0.00 C ATOM 207 CG LEU A 14 3.736 -2.715 -1.964 1.00 0.00 C ATOM 208 CD1 LEU A 14 3.524 -3.974 -1.130 1.00 0.00 C ATOM 209 CD2 LEU A 14 2.759 -1.637 -1.502 1.00 0.00 C ATOM 0 H LEU A 14 4.983 -2.046 -4.254 1.00 0.00 H new ATOM 0 HA LEU A 14 4.811 -0.144 -2.105 1.00 0.00 H new ATOM 0 HB2 LEU A 14 5.859 -3.005 -2.197 1.00 0.00 H new ATOM 0 HB3 LEU A 14 5.415 -2.117 -0.753 1.00 0.00 H new ATOM 0 HG LEU A 14 3.551 -2.926 -3.017 1.00 0.00 H new ATOM 0 HD11 LEU A 14 2.494 -4.313 -1.238 1.00 0.00 H new ATOM 0 HD12 LEU A 14 4.201 -4.756 -1.473 1.00 0.00 H new ATOM 0 HD13 LEU A 14 3.726 -3.754 -0.082 1.00 0.00 H new ATOM 0 HD21 LEU A 14 1.737 -1.997 -1.620 1.00 0.00 H new ATOM 0 HD22 LEU A 14 2.943 -1.405 -0.453 1.00 0.00 H new ATOM 0 HD23 LEU A 14 2.899 -0.738 -2.102 1.00 0.00 H new ATOM 221 N ARG A 15 7.700 -0.706 -3.447 1.00 0.00 N ATOM 222 CA ARG A 15 9.103 -0.313 -3.459 1.00 0.00 C ATOM 223 C ARG A 15 9.251 1.024 -4.182 1.00 0.00 C ATOM 224 O ARG A 15 10.256 1.709 -3.993 1.00 0.00 O ATOM 225 CB ARG A 15 9.922 -1.388 -4.182 1.00 0.00 C ATOM 226 CG ARG A 15 9.771 -2.748 -3.501 1.00 0.00 C ATOM 227 CD ARG A 15 10.530 -3.809 -4.298 1.00 0.00 C ATOM 228 NE ARG A 15 10.345 -5.140 -3.705 1.00 0.00 N ATOM 229 CZ ARG A 15 11.228 -5.745 -2.903 1.00 0.00 C ATOM 230 NH1 ARG A 15 12.380 -5.163 -2.579 1.00 0.00 N ATOM 231 NH2 ARG A 15 10.969 -6.950 -2.412 1.00 0.00 N ATOM 0 H ARG A 15 7.391 -1.156 -4.309 1.00 0.00 H new ATOM 0 HA ARG A 15 9.465 -0.209 -2.436 1.00 0.00 H new ATOM 0 HB2 ARG A 15 9.597 -1.460 -5.220 1.00 0.00 H new ATOM 0 HB3 ARG A 15 10.973 -1.100 -4.196 1.00 0.00 H new ATOM 0 HG2 ARG A 15 10.155 -2.700 -2.482 1.00 0.00 H new ATOM 0 HG3 ARG A 15 8.717 -3.016 -3.432 1.00 0.00 H new ATOM 0 HD2 ARG A 15 10.180 -3.814 -5.330 1.00 0.00 H new ATOM 0 HD3 ARG A 15 11.591 -3.561 -4.323 1.00 0.00 H new ATOM 0 HE ARG A 15 9.482 -5.638 -3.920 1.00 0.00 H new ATOM 0 HH11 ARG A 15 12.604 -4.237 -2.944 1.00 0.00 H new ATOM 0 HH12 ARG A 15 13.039 -5.643 -1.966 1.00 0.00 H new ATOM 0 HH21 ARG A 15 10.094 -7.419 -2.646 1.00 0.00 H new ATOM 0 HH22 ARG A 15 11.645 -7.408 -1.801 1.00 0.00 H new ATOM 245 N ARG A 16 8.254 1.387 -4.996 1.00 0.00 N ATOM 246 CA ARG A 16 8.223 2.615 -5.779 1.00 0.00 C ATOM 247 C ARG A 16 8.452 3.848 -4.910 1.00 0.00 C ATOM 248 O ARG A 16 8.945 4.862 -5.390 1.00 0.00 O ATOM 249 CB ARG A 16 6.881 2.690 -6.515 1.00 0.00 C ATOM 250 CG ARG A 16 6.836 3.885 -7.465 1.00 0.00 C ATOM 251 CD ARG A 16 5.552 3.886 -8.292 1.00 0.00 C ATOM 252 NE ARG A 16 4.382 4.217 -7.475 1.00 0.00 N ATOM 253 CZ ARG A 16 3.264 4.758 -7.963 1.00 0.00 C ATOM 254 NH1 ARG A 16 3.136 5.025 -9.261 1.00 0.00 N ATOM 255 NH2 ARG A 16 2.251 5.038 -7.155 1.00 0.00 N ATOM 0 H ARG A 16 7.422 0.812 -5.128 1.00 0.00 H new ATOM 0 HA ARG A 16 9.037 2.599 -6.504 1.00 0.00 H new ATOM 0 HB2 ARG A 16 6.720 1.770 -7.077 1.00 0.00 H new ATOM 0 HB3 ARG A 16 6.070 2.768 -5.791 1.00 0.00 H new ATOM 0 HG2 ARG A 16 6.904 4.810 -6.893 1.00 0.00 H new ATOM 0 HG3 ARG A 16 7.700 3.857 -8.130 1.00 0.00 H new ATOM 0 HD2 ARG A 16 5.643 4.606 -9.105 1.00 0.00 H new ATOM 0 HD3 ARG A 16 5.412 2.906 -8.748 1.00 0.00 H new ATOM 0 HE ARG A 16 4.424 4.023 -6.475 1.00 0.00 H new ATOM 0 HH11 ARG A 16 3.901 4.816 -9.903 1.00 0.00 H new ATOM 0 HH12 ARG A 16 2.273 5.439 -9.614 1.00 0.00 H new ATOM 0 HH21 ARG A 16 2.325 4.840 -6.157 1.00 0.00 H new ATOM 0 HH22 ARG A 16 1.398 5.452 -7.531 1.00 0.00 H new ATOM 269 N TYR A 17 8.091 3.751 -3.626 1.00 0.00 N ATOM 270 CA TYR A 17 8.346 4.813 -2.663 1.00 0.00 C ATOM 271 C TYR A 17 8.775 4.254 -1.306 1.00 0.00 C ATOM 272 O TYR A 17 9.293 4.991 -0.468 1.00 0.00 O ATOM 273 CB TYR A 17 7.090 5.679 -2.521 1.00 0.00 C ATOM 274 CG TYR A 17 5.973 5.015 -1.741 1.00 0.00 C ATOM 275 CD1 TYR A 17 5.248 3.954 -2.307 1.00 0.00 C ATOM 276 CD2 TYR A 17 5.661 5.467 -0.450 1.00 0.00 C ATOM 277 CE1 TYR A 17 4.222 3.332 -1.579 1.00 0.00 C ATOM 278 CE2 TYR A 17 4.631 4.854 0.282 1.00 0.00 C ATOM 279 CZ TYR A 17 3.911 3.780 -0.279 1.00 0.00 C ATOM 280 OH TYR A 17 2.916 3.178 0.432 1.00 0.00 O ATOM 0 H TYR A 17 7.617 2.938 -3.233 1.00 0.00 H new ATOM 0 HA TYR A 17 9.170 5.424 -3.031 1.00 0.00 H new ATOM 0 HB2 TYR A 17 7.358 6.614 -2.028 1.00 0.00 H new ATOM 0 HB3 TYR A 17 6.723 5.936 -3.515 1.00 0.00 H new ATOM 0 HD1 TYR A 17 5.481 3.616 -3.306 1.00 0.00 H new ATOM 0 HD2 TYR A 17 6.214 6.288 -0.018 1.00 0.00 H new ATOM 0 HE1 TYR A 17 3.671 2.511 -2.014 1.00 0.00 H new ATOM 0 HE2 TYR A 17 4.391 5.205 1.275 1.00 0.00 H new ATOM 0 HH TYR A 17 2.110 3.115 -0.122 1.00 0.00 H new ATOM 290 N GLY A 18 8.571 2.951 -1.076 1.00 0.00 N ATOM 291 CA GLY A 18 8.960 2.327 0.177 1.00 0.00 C ATOM 292 C GLY A 18 10.469 2.355 0.373 1.00 0.00 C ATOM 293 O GLY A 18 10.934 2.401 1.506 1.00 0.00 O ATOM 0 H GLY A 18 8.138 2.316 -1.746 1.00 0.00 H new ATOM 0 HA2 GLY A 18 8.475 2.842 1.006 1.00 0.00 H new ATOM 0 HA3 GLY A 18 8.610 1.295 0.194 1.00 0.00 H new ATOM 297 N ARG A 19 11.249 2.331 -0.714 1.00 0.00 N ATOM 298 CA ARG A 19 12.704 2.364 -0.604 1.00 0.00 C ATOM 299 C ARG A 19 13.214 3.731 -0.144 1.00 0.00 C ATOM 300 O ARG A 19 14.412 3.903 0.065 1.00 0.00 O ATOM 301 CB ARG A 19 13.340 1.949 -1.935 1.00 0.00 C ATOM 302 CG ARG A 19 13.238 3.052 -2.990 1.00 0.00 C ATOM 303 CD ARG A 19 13.893 2.583 -4.290 1.00 0.00 C ATOM 304 NE ARG A 19 14.051 3.696 -5.229 1.00 0.00 N ATOM 305 CZ ARG A 19 14.668 3.613 -6.410 1.00 0.00 C ATOM 306 NH1 ARG A 19 15.168 2.455 -6.840 1.00 0.00 N ATOM 307 NH2 ARG A 19 14.785 4.700 -7.163 1.00 0.00 N ATOM 0 H ARG A 19 10.897 2.289 -1.670 1.00 0.00 H new ATOM 0 HA ARG A 19 13.000 1.648 0.163 1.00 0.00 H new ATOM 0 HB2 ARG A 19 14.388 1.699 -1.773 1.00 0.00 H new ATOM 0 HB3 ARG A 19 12.851 1.048 -2.305 1.00 0.00 H new ATOM 0 HG2 ARG A 19 12.192 3.303 -3.168 1.00 0.00 H new ATOM 0 HG3 ARG A 19 13.727 3.958 -2.631 1.00 0.00 H new ATOM 0 HD2 ARG A 19 14.867 2.144 -4.073 1.00 0.00 H new ATOM 0 HD3 ARG A 19 13.286 1.801 -4.746 1.00 0.00 H new ATOM 0 HE ARG A 19 13.661 4.600 -4.961 1.00 0.00 H new ATOM 0 HH11 ARG A 19 15.082 1.617 -6.265 1.00 0.00 H new ATOM 0 HH12 ARG A 19 15.637 2.406 -7.745 1.00 0.00 H new ATOM 0 HH21 ARG A 19 14.405 5.589 -6.838 1.00 0.00 H new ATOM 0 HH22 ARG A 19 15.255 4.646 -8.067 1.00 0.00 H new ATOM 321 N ALA A 20 12.306 4.700 0.015 1.00 0.00 N ATOM 322 CA ALA A 20 12.636 6.051 0.438 1.00 0.00 C ATOM 323 C ALA A 20 11.797 6.449 1.654 1.00 0.00 C ATOM 324 O ALA A 20 11.839 7.597 2.095 1.00 0.00 O ATOM 325 CB ALA A 20 12.408 7.004 -0.733 1.00 0.00 C ATOM 0 H ALA A 20 11.310 4.558 -0.151 1.00 0.00 H new ATOM 0 HA ALA A 20 13.683 6.102 0.736 1.00 0.00 H new ATOM 0 HB1 ALA A 20 12.652 8.021 -0.427 1.00 0.00 H new ATOM 0 HB2 ALA A 20 13.045 6.713 -1.568 1.00 0.00 H new ATOM 0 HB3 ALA A 20 11.363 6.959 -1.041 1.00 0.00 H new ATOM 331 N LEU A 21 11.035 5.491 2.188 1.00 0.00 N ATOM 332 CA LEU A 21 10.203 5.668 3.368 1.00 0.00 C ATOM 333 C LEU A 21 10.814 4.921 4.561 1.00 0.00 C ATOM 334 O LEU A 21 10.208 4.839 5.626 1.00 0.00 O ATOM 335 CB LEU A 21 8.794 5.166 3.016 1.00 0.00 C ATOM 336 CG LEU A 21 7.737 5.398 4.104 1.00 0.00 C ATOM 337 CD1 LEU A 21 7.629 6.872 4.484 1.00 0.00 C ATOM 338 CD2 LEU A 21 6.378 4.939 3.581 1.00 0.00 C ATOM 0 H LEU A 21 10.982 4.550 1.798 1.00 0.00 H new ATOM 0 HA LEU A 21 10.143 6.716 3.662 1.00 0.00 H new ATOM 0 HB2 LEU A 21 8.467 5.658 2.100 1.00 0.00 H new ATOM 0 HB3 LEU A 21 8.847 4.098 2.802 1.00 0.00 H new ATOM 0 HG LEU A 21 8.036 4.833 4.987 1.00 0.00 H new ATOM 0 HD11 LEU A 21 6.870 6.994 5.257 1.00 0.00 H new ATOM 0 HD12 LEU A 21 8.590 7.222 4.861 1.00 0.00 H new ATOM 0 HD13 LEU A 21 7.350 7.455 3.606 1.00 0.00 H new ATOM 0 HD21 LEU A 21 5.620 5.100 4.347 1.00 0.00 H new ATOM 0 HD22 LEU A 21 6.119 5.510 2.689 1.00 0.00 H new ATOM 0 HD23 LEU A 21 6.423 3.879 3.332 1.00 0.00 H new ATOM 350 N THR A 22 12.020 4.372 4.387 1.00 0.00 N ATOM 351 CA THR A 22 12.670 3.557 5.408 1.00 0.00 C ATOM 352 C THR A 22 14.125 3.953 5.631 1.00 0.00 C ATOM 353 O THR A 22 14.701 3.625 6.667 1.00 0.00 O ATOM 354 CB THR A 22 12.647 2.095 4.969 1.00 0.00 C ATOM 355 OG1 THR A 22 13.434 1.967 3.806 1.00 0.00 O ATOM 356 CG2 THR A 22 11.238 1.610 4.659 1.00 0.00 C ATOM 0 H THR A 22 12.569 4.482 3.535 1.00 0.00 H new ATOM 0 HA THR A 22 12.123 3.711 6.338 1.00 0.00 H new ATOM 0 HB THR A 22 13.036 1.489 5.787 1.00 0.00 H new ATOM 0 HG1 THR A 22 14.133 1.296 3.956 1.00 0.00 H new ATOM 0 HG21 THR A 22 11.272 0.565 4.351 1.00 0.00 H new ATOM 0 HG22 THR A 22 10.616 1.706 5.549 1.00 0.00 H new ATOM 0 HG23 THR A 22 10.815 2.211 3.854 1.00 0.00 H new ATOM 364 N GLY A 23 14.728 4.655 4.666 1.00 0.00 N ATOM 365 CA GLY A 23 16.102 5.119 4.770 1.00 0.00 C ATOM 366 C GLY A 23 17.118 4.055 4.351 1.00 0.00 C ATOM 367 O GLY A 23 18.316 4.330 4.336 1.00 0.00 O ATOM 0 H GLY A 23 14.270 4.914 3.792 1.00 0.00 H new ATOM 0 HA2 GLY A 23 16.231 6.004 4.146 1.00 0.00 H new ATOM 0 HA3 GLY A 23 16.302 5.422 5.798 1.00 0.00 H new ATOM 371 N SER A 24 16.661 2.844 4.006 1.00 0.00 N ATOM 372 CA SER A 24 17.555 1.773 3.585 1.00 0.00 C ATOM 373 C SER A 24 16.807 0.736 2.758 1.00 0.00 C ATOM 374 O SER A 24 15.672 0.382 3.080 1.00 0.00 O ATOM 375 CB SER A 24 18.136 1.095 4.825 1.00 0.00 C ATOM 376 OG SER A 24 18.974 0.026 4.436 1.00 0.00 O ATOM 0 H SER A 24 15.674 2.587 4.012 1.00 0.00 H new ATOM 0 HA SER A 24 18.350 2.201 2.974 1.00 0.00 H new ATOM 0 HB2 SER A 24 18.701 1.817 5.414 1.00 0.00 H new ATOM 0 HB3 SER A 24 17.331 0.726 5.460 1.00 0.00 H new ATOM 0 HG SER A 24 19.346 -0.405 5.234 1.00 0.00 H new ATOM 382 N GLN A 25 17.436 0.240 1.687 1.00 0.00 N ATOM 383 CA GLN A 25 16.825 -0.782 0.851 1.00 0.00 C ATOM 384 C GLN A 25 16.640 -2.090 1.623 1.00 0.00 C ATOM 385 O GLN A 25 15.830 -2.927 1.231 1.00 0.00 O ATOM 386 CB GLN A 25 17.660 -1.003 -0.412 1.00 0.00 C ATOM 387 CG GLN A 25 19.061 -1.519 -0.071 1.00 0.00 C ATOM 388 CD GLN A 25 19.914 -1.739 -1.315 1.00 0.00 C ATOM 389 OE1 GLN A 25 19.434 -1.639 -2.441 1.00 0.00 O ATOM 390 NE2 GLN A 25 21.197 -2.040 -1.119 1.00 0.00 N ATOM 0 H GLN A 25 18.365 0.533 1.385 1.00 0.00 H new ATOM 0 HA GLN A 25 15.836 -0.434 0.554 1.00 0.00 H new ATOM 0 HB2 GLN A 25 17.156 -1.717 -1.063 1.00 0.00 H new ATOM 0 HB3 GLN A 25 17.740 -0.068 -0.966 1.00 0.00 H new ATOM 0 HG2 GLN A 25 19.558 -0.806 0.587 1.00 0.00 H new ATOM 0 HG3 GLN A 25 18.977 -2.456 0.480 1.00 0.00 H new ATOM 0 HE21 GLN A 25 21.564 -2.115 -0.170 1.00 0.00 H new ATOM 0 HE22 GLN A 25 21.812 -2.195 -1.918 1.00 0.00 H new ATOM 399 N ASN A 26 17.385 -2.270 2.719 1.00 0.00 N ATOM 400 CA ASN A 26 17.268 -3.462 3.543 1.00 0.00 C ATOM 401 C ASN A 26 15.966 -3.427 4.342 1.00 0.00 C ATOM 402 O ASN A 26 15.351 -4.465 4.578 1.00 0.00 O ATOM 403 CB ASN A 26 18.473 -3.538 4.483 1.00 0.00 C ATOM 404 CG ASN A 26 18.465 -4.815 5.313 1.00 0.00 C ATOM 405 OD1 ASN A 26 18.135 -5.890 4.819 1.00 0.00 O ATOM 406 ND2 ASN A 26 18.831 -4.709 6.587 1.00 0.00 N ATOM 0 H ASN A 26 18.076 -1.598 3.051 1.00 0.00 H new ATOM 0 HA ASN A 26 17.250 -4.347 2.907 1.00 0.00 H new ATOM 0 HB2 ASN A 26 19.392 -3.490 3.900 1.00 0.00 H new ATOM 0 HB3 ASN A 26 18.471 -2.673 5.147 1.00 0.00 H new ATOM 0 HD21 ASN A 26 18.843 -5.536 7.185 1.00 0.00 H new ATOM 0 HD22 ASN A 26 19.099 -3.801 6.967 1.00 0.00 H new ATOM 413 N GLN A 27 15.538 -2.233 4.763 1.00 0.00 N ATOM 414 CA GLN A 27 14.290 -2.070 5.494 1.00 0.00 C ATOM 415 C GLN A 27 13.116 -1.995 4.523 1.00 0.00 C ATOM 416 O GLN A 27 12.007 -2.387 4.874 1.00 0.00 O ATOM 417 CB GLN A 27 14.356 -0.788 6.328 1.00 0.00 C ATOM 418 CG GLN A 27 15.321 -0.936 7.506 1.00 0.00 C ATOM 419 CD GLN A 27 14.864 -2.026 8.466 1.00 0.00 C ATOM 420 OE1 GLN A 27 15.457 -3.097 8.534 1.00 0.00 O ATOM 421 NE2 GLN A 27 13.797 -1.763 9.219 1.00 0.00 N ATOM 0 H GLN A 27 16.046 -1.363 4.606 1.00 0.00 H new ATOM 0 HA GLN A 27 14.145 -2.927 6.151 1.00 0.00 H new ATOM 0 HB2 GLN A 27 14.674 0.042 5.697 1.00 0.00 H new ATOM 0 HB3 GLN A 27 13.361 -0.543 6.700 1.00 0.00 H new ATOM 0 HG2 GLN A 27 16.318 -1.172 7.134 1.00 0.00 H new ATOM 0 HG3 GLN A 27 15.395 0.012 8.039 1.00 0.00 H new ATOM 0 HE21 GLN A 27 13.326 -0.862 9.139 1.00 0.00 H new ATOM 0 HE22 GLN A 27 13.451 -2.463 9.876 1.00 0.00 H new ATOM 430 N GLY A 28 13.356 -1.497 3.304 1.00 0.00 N ATOM 431 CA GLY A 28 12.310 -1.405 2.298 1.00 0.00 C ATOM 432 C GLY A 28 11.937 -2.794 1.800 1.00 0.00 C ATOM 433 O GLY A 28 10.761 -3.085 1.604 1.00 0.00 O ATOM 0 H GLY A 28 14.267 -1.154 2.998 1.00 0.00 H new ATOM 0 HA2 GLY A 28 11.433 -0.914 2.719 1.00 0.00 H new ATOM 0 HA3 GLY A 28 12.650 -0.791 1.464 1.00 0.00 H new ATOM 437 N ASP A 29 12.932 -3.662 1.594 1.00 0.00 N ATOM 438 CA ASP A 29 12.680 -5.028 1.164 1.00 0.00 C ATOM 439 C ASP A 29 12.070 -5.846 2.298 1.00 0.00 C ATOM 440 O ASP A 29 11.253 -6.732 2.058 1.00 0.00 O ATOM 441 CB ASP A 29 14.004 -5.650 0.724 1.00 0.00 C ATOM 442 CG ASP A 29 13.810 -7.087 0.241 1.00 0.00 C ATOM 443 OD1 ASP A 29 13.270 -7.242 -0.875 1.00 0.00 O ATOM 444 OD2 ASP A 29 14.203 -8.011 0.988 1.00 0.00 O ATOM 0 H ASP A 29 13.919 -3.436 1.720 1.00 0.00 H new ATOM 0 HA ASP A 29 11.973 -5.024 0.334 1.00 0.00 H new ATOM 0 HB2 ASP A 29 14.441 -5.052 -0.075 1.00 0.00 H new ATOM 0 HB3 ASP A 29 14.709 -5.636 1.555 1.00 0.00 H new ATOM 449 N LYS A 30 12.467 -5.550 3.540 1.00 0.00 N ATOM 450 CA LYS A 30 11.991 -6.280 4.703 1.00 0.00 C ATOM 451 C LYS A 30 10.521 -5.992 4.978 1.00 0.00 C ATOM 452 O LYS A 30 9.758 -6.923 5.219 1.00 0.00 O ATOM 453 CB LYS A 30 12.879 -5.910 5.893 1.00 0.00 C ATOM 454 CG LYS A 30 12.492 -6.685 7.153 1.00 0.00 C ATOM 455 CD LYS A 30 11.595 -5.861 8.077 1.00 0.00 C ATOM 456 CE LYS A 30 12.395 -4.741 8.746 1.00 0.00 C ATOM 457 NZ LYS A 30 13.454 -5.287 9.622 1.00 0.00 N ATOM 0 H LYS A 30 13.124 -4.801 3.759 1.00 0.00 H new ATOM 0 HA LYS A 30 12.057 -7.353 4.521 1.00 0.00 H new ATOM 0 HB2 LYS A 30 13.921 -6.114 5.646 1.00 0.00 H new ATOM 0 HB3 LYS A 30 12.801 -4.840 6.086 1.00 0.00 H new ATOM 0 HG2 LYS A 30 11.976 -7.603 6.870 1.00 0.00 H new ATOM 0 HG3 LYS A 30 13.394 -6.979 7.690 1.00 0.00 H new ATOM 0 HD2 LYS A 30 10.770 -5.435 7.506 1.00 0.00 H new ATOM 0 HD3 LYS A 30 11.157 -6.507 8.838 1.00 0.00 H new ATOM 0 HE2 LYS A 30 12.843 -4.105 7.982 1.00 0.00 H new ATOM 0 HE3 LYS A 30 11.724 -4.112 9.331 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 13.359 -4.883 10.575 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 13.362 -6.322 9.674 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 14.387 -5.041 9.233 1.00 0.00 H new ATOM 471 N TYR A 31 10.103 -4.721 4.944 1.00 0.00 N ATOM 472 CA TYR A 31 8.705 -4.392 5.198 1.00 0.00 C ATOM 473 C TYR A 31 7.805 -4.911 4.085 1.00 0.00 C ATOM 474 O TYR A 31 6.665 -5.280 4.347 1.00 0.00 O ATOM 475 CB TYR A 31 8.528 -2.880 5.345 1.00 0.00 C ATOM 476 CG TYR A 31 9.169 -2.260 6.571 1.00 0.00 C ATOM 477 CD1 TYR A 31 9.265 -2.971 7.779 1.00 0.00 C ATOM 478 CD2 TYR A 31 9.662 -0.952 6.488 1.00 0.00 C ATOM 479 CE1 TYR A 31 9.856 -2.371 8.900 1.00 0.00 C ATOM 480 CE2 TYR A 31 10.262 -0.352 7.603 1.00 0.00 C ATOM 481 CZ TYR A 31 10.368 -1.062 8.812 1.00 0.00 C ATOM 482 OH TYR A 31 10.963 -0.480 9.889 1.00 0.00 O ATOM 0 H TYR A 31 10.704 -3.921 4.747 1.00 0.00 H new ATOM 0 HA TYR A 31 8.415 -4.878 6.130 1.00 0.00 H new ATOM 0 HB2 TYR A 31 8.939 -2.397 4.459 1.00 0.00 H new ATOM 0 HB3 TYR A 31 7.461 -2.658 5.363 1.00 0.00 H new ATOM 0 HD1 TYR A 31 8.884 -3.979 7.844 1.00 0.00 H new ATOM 0 HD2 TYR A 31 9.579 -0.404 5.561 1.00 0.00 H new ATOM 0 HE1 TYR A 31 9.919 -2.913 9.832 1.00 0.00 H new ATOM 0 HE2 TYR A 31 10.643 0.656 7.534 1.00 0.00 H new ATOM 0 HH TYR A 31 11.259 0.423 9.651 1.00 0.00 H new ATOM 492 N VAL A 32 8.297 -4.951 2.842 1.00 0.00 N ATOM 493 CA VAL A 32 7.499 -5.460 1.728 1.00 0.00 C ATOM 494 C VAL A 32 7.179 -6.939 1.926 1.00 0.00 C ATOM 495 O VAL A 32 6.023 -7.346 1.817 1.00 0.00 O ATOM 496 CB VAL A 32 8.264 -5.232 0.417 1.00 0.00 C ATOM 497 CG1 VAL A 32 7.703 -6.086 -0.717 1.00 0.00 C ATOM 498 CG2 VAL A 32 8.135 -3.763 0.009 1.00 0.00 C ATOM 0 H VAL A 32 9.234 -4.640 2.586 1.00 0.00 H new ATOM 0 HA VAL A 32 6.551 -4.924 1.685 1.00 0.00 H new ATOM 0 HB VAL A 32 9.305 -5.508 0.587 1.00 0.00 H new ATOM 0 HG11 VAL A 32 8.270 -5.898 -1.629 1.00 0.00 H new ATOM 0 HG12 VAL A 32 7.782 -7.140 -0.452 1.00 0.00 H new ATOM 0 HG13 VAL A 32 6.656 -5.831 -0.881 1.00 0.00 H new ATOM 0 HG21 VAL A 32 8.677 -3.595 -0.922 1.00 0.00 H new ATOM 0 HG22 VAL A 32 7.083 -3.516 -0.134 1.00 0.00 H new ATOM 0 HG23 VAL A 32 8.553 -3.130 0.791 1.00 0.00 H new ATOM 508 N ARG A 33 8.198 -7.751 2.218 1.00 0.00 N ATOM 509 CA ARG A 33 7.991 -9.181 2.372 1.00 0.00 C ATOM 510 C ARG A 33 7.329 -9.496 3.710 1.00 0.00 C ATOM 511 O ARG A 33 6.631 -10.501 3.830 1.00 0.00 O ATOM 512 CB ARG A 33 9.336 -9.890 2.214 1.00 0.00 C ATOM 513 CG ARG A 33 9.121 -11.382 1.983 1.00 0.00 C ATOM 514 CD ARG A 33 10.441 -12.044 1.604 1.00 0.00 C ATOM 515 NE ARG A 33 11.406 -12.003 2.709 1.00 0.00 N ATOM 516 CZ ARG A 33 12.655 -12.466 2.627 1.00 0.00 C ATOM 517 NH1 ARG A 33 13.107 -13.013 1.504 1.00 0.00 N ATOM 518 NH2 ARG A 33 13.465 -12.382 3.681 1.00 0.00 N ATOM 0 H ARG A 33 9.161 -7.442 2.350 1.00 0.00 H new ATOM 0 HA ARG A 33 7.311 -9.543 1.601 1.00 0.00 H new ATOM 0 HB2 ARG A 33 9.886 -9.460 1.376 1.00 0.00 H new ATOM 0 HB3 ARG A 33 9.943 -9.736 3.106 1.00 0.00 H new ATOM 0 HG2 ARG A 33 8.718 -11.844 2.884 1.00 0.00 H new ATOM 0 HG3 ARG A 33 8.387 -11.534 1.191 1.00 0.00 H new ATOM 0 HD2 ARG A 33 10.259 -13.080 1.318 1.00 0.00 H new ATOM 0 HD3 ARG A 33 10.863 -11.542 0.733 1.00 0.00 H new ATOM 0 HE ARG A 33 11.104 -11.596 3.594 1.00 0.00 H new ATOM 0 HH11 ARG A 33 12.497 -13.083 0.690 1.00 0.00 H new ATOM 0 HH12 ARG A 33 14.064 -13.363 1.456 1.00 0.00 H new ATOM 0 HH21 ARG A 33 13.130 -11.964 4.549 1.00 0.00 H new ATOM 0 HH22 ARG A 33 14.420 -12.735 3.620 1.00 0.00 H new ATOM 532 N ALA A 34 7.538 -8.643 4.718 1.00 0.00 N ATOM 533 CA ALA A 34 6.892 -8.806 6.008 1.00 0.00 C ATOM 534 C ALA A 34 5.414 -8.428 5.927 1.00 0.00 C ATOM 535 O ALA A 34 4.622 -8.885 6.748 1.00 0.00 O ATOM 536 CB ALA A 34 7.602 -7.943 7.046 1.00 0.00 C ATOM 0 H ALA A 34 8.154 -7.832 4.657 1.00 0.00 H new ATOM 0 HA ALA A 34 6.957 -9.853 6.303 1.00 0.00 H new ATOM 0 HB1 ALA A 34 7.117 -8.066 8.014 1.00 0.00 H new ATOM 0 HB2 ALA A 34 8.645 -8.249 7.122 1.00 0.00 H new ATOM 0 HB3 ALA A 34 7.552 -6.897 6.745 1.00 0.00 H new ATOM 542 N THR A 35 5.034 -7.602 4.944 1.00 0.00 N ATOM 543 CA THR A 35 3.635 -7.243 4.752 1.00 0.00 C ATOM 544 C THR A 35 2.845 -8.490 4.398 1.00 0.00 C ATOM 545 O THR A 35 1.795 -8.731 4.983 1.00 0.00 O ATOM 546 CB THR A 35 3.487 -6.201 3.642 1.00 0.00 C ATOM 547 OG1 THR A 35 4.091 -4.986 4.027 1.00 0.00 O ATOM 548 CG2 THR A 35 2.008 -5.922 3.363 1.00 0.00 C ATOM 0 H THR A 35 5.676 -7.175 4.276 1.00 0.00 H new ATOM 0 HA THR A 35 3.252 -6.811 5.676 1.00 0.00 H new ATOM 0 HB THR A 35 3.970 -6.598 2.749 1.00 0.00 H new ATOM 0 HG1 THR A 35 5.055 -5.122 4.142 1.00 0.00 H new ATOM 0 HG21 THR A 35 1.921 -5.178 2.571 1.00 0.00 H new ATOM 0 HG22 THR A 35 1.516 -6.844 3.051 1.00 0.00 H new ATOM 0 HG23 THR A 35 1.532 -5.545 4.268 1.00 0.00 H new ATOM 556 N LEU A 36 3.341 -9.286 3.445 1.00 0.00 N ATOM 557 CA LEU A 36 2.634 -10.482 3.011 1.00 0.00 C ATOM 558 C LEU A 36 2.674 -11.551 4.107 1.00 0.00 C ATOM 559 O LEU A 36 1.717 -12.298 4.290 1.00 0.00 O ATOM 560 CB LEU A 36 3.287 -10.979 1.718 1.00 0.00 C ATOM 561 CG LEU A 36 2.349 -11.757 0.778 1.00 0.00 C ATOM 562 CD1 LEU A 36 1.667 -12.944 1.448 1.00 0.00 C ATOM 563 CD2 LEU A 36 1.277 -10.829 0.215 1.00 0.00 C ATOM 0 H LEU A 36 4.226 -9.120 2.965 1.00 0.00 H new ATOM 0 HA LEU A 36 1.584 -10.257 2.821 1.00 0.00 H new ATOM 0 HB2 LEU A 36 3.690 -10.122 1.178 1.00 0.00 H new ATOM 0 HB3 LEU A 36 4.131 -11.618 1.976 1.00 0.00 H new ATOM 0 HG LEU A 36 2.981 -12.149 -0.019 1.00 0.00 H new ATOM 0 HD11 LEU A 36 1.021 -13.446 0.728 1.00 0.00 H new ATOM 0 HD12 LEU A 36 2.423 -13.643 1.807 1.00 0.00 H new ATOM 0 HD13 LEU A 36 1.069 -12.593 2.289 1.00 0.00 H new ATOM 0 HD21 LEU A 36 0.620 -11.392 -0.448 1.00 0.00 H new ATOM 0 HD22 LEU A 36 0.693 -10.409 1.034 1.00 0.00 H new ATOM 0 HD23 LEU A 36 1.751 -10.022 -0.343 1.00 0.00 H new ATOM 575 N GLU A 37 3.782 -11.630 4.848 1.00 0.00 N ATOM 576 CA GLU A 37 3.927 -12.604 5.917 1.00 0.00 C ATOM 577 C GLU A 37 2.956 -12.291 7.060 1.00 0.00 C ATOM 578 O GLU A 37 2.693 -13.144 7.907 1.00 0.00 O ATOM 579 CB GLU A 37 5.379 -12.593 6.406 1.00 0.00 C ATOM 580 CG GLU A 37 5.749 -13.858 7.188 1.00 0.00 C ATOM 581 CD GLU A 37 5.901 -15.067 6.263 1.00 0.00 C ATOM 582 OE1 GLU A 37 6.992 -15.194 5.663 1.00 0.00 O ATOM 583 OE2 GLU A 37 4.933 -15.853 6.161 1.00 0.00 O ATOM 0 H GLU A 37 4.593 -11.024 4.721 1.00 0.00 H new ATOM 0 HA GLU A 37 3.685 -13.600 5.545 1.00 0.00 H new ATOM 0 HB2 GLU A 37 6.046 -12.492 5.550 1.00 0.00 H new ATOM 0 HB3 GLU A 37 5.538 -11.720 7.039 1.00 0.00 H new ATOM 0 HG2 GLU A 37 6.681 -13.693 7.728 1.00 0.00 H new ATOM 0 HG3 GLU A 37 4.981 -14.064 7.933 1.00 0.00 H new ATOM 590 N ALA A 38 2.411 -11.070 7.092 1.00 0.00 N ATOM 591 CA ALA A 38 1.394 -10.686 8.055 1.00 0.00 C ATOM 592 C ALA A 38 -0.011 -11.029 7.547 1.00 0.00 C ATOM 593 O ALA A 38 -0.982 -10.884 8.288 1.00 0.00 O ATOM 594 CB ALA A 38 1.515 -9.189 8.340 1.00 0.00 C ATOM 0 H ALA A 38 2.669 -10.324 6.446 1.00 0.00 H new ATOM 0 HA ALA A 38 1.550 -11.246 8.977 1.00 0.00 H new ATOM 0 HB1 ALA A 38 0.754 -8.894 9.062 1.00 0.00 H new ATOM 0 HB2 ALA A 38 2.504 -8.975 8.746 1.00 0.00 H new ATOM 0 HB3 ALA A 38 1.374 -8.630 7.415 1.00 0.00 H new ATOM 600 N ILE A 39 -0.130 -11.477 6.291 1.00 0.00 N ATOM 601 CA ILE A 39 -1.418 -11.825 5.706 1.00 0.00 C ATOM 602 C ILE A 39 -1.650 -13.332 5.771 1.00 0.00 C ATOM 603 O ILE A 39 -2.797 -13.768 5.819 1.00 0.00 O ATOM 604 CB ILE A 39 -1.476 -11.364 4.244 1.00 0.00 C ATOM 605 CG1 ILE A 39 -1.147 -9.878 4.071 1.00 0.00 C ATOM 606 CG2 ILE A 39 -2.860 -11.646 3.656 1.00 0.00 C ATOM 607 CD1 ILE A 39 -1.983 -8.941 4.939 1.00 0.00 C ATOM 0 H ILE A 39 0.662 -11.606 5.661 1.00 0.00 H new ATOM 0 HA ILE A 39 -2.198 -11.322 6.278 1.00 0.00 H new ATOM 0 HB ILE A 39 -0.713 -11.932 3.711 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -0.093 -9.723 4.301 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -1.288 -9.607 3.025 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -2.889 -11.314 2.618 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -3.063 -12.716 3.701 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -3.615 -11.109 4.230 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -1.684 -7.909 4.753 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -3.038 -9.063 4.694 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -1.824 -9.181 5.990 1.00 0.00 H new ATOM 619 N VAL A 40 -0.586 -14.138 5.775 1.00 0.00 N ATOM 620 CA VAL A 40 -0.752 -15.589 5.819 1.00 0.00 C ATOM 621 C VAL A 40 -1.351 -16.071 7.141 1.00 0.00 C ATOM 622 O VAL A 40 -1.672 -17.250 7.271 1.00 0.00 O ATOM 623 CB VAL A 40 0.569 -16.313 5.532 1.00 0.00 C ATOM 624 CG1 VAL A 40 1.102 -15.894 4.164 1.00 0.00 C ATOM 625 CG2 VAL A 40 1.625 -16.006 6.590 1.00 0.00 C ATOM 0 H VAL A 40 0.382 -13.817 5.749 1.00 0.00 H new ATOM 0 HA VAL A 40 -1.462 -15.840 5.031 1.00 0.00 H new ATOM 0 HB VAL A 40 0.366 -17.384 5.550 1.00 0.00 H new ATOM 0 HG11 VAL A 40 2.041 -16.411 3.965 1.00 0.00 H new ATOM 0 HG12 VAL A 40 0.375 -16.154 3.395 1.00 0.00 H new ATOM 0 HG13 VAL A 40 1.272 -14.817 4.154 1.00 0.00 H new ATOM 0 HG21 VAL A 40 2.546 -16.538 6.350 1.00 0.00 H new ATOM 0 HG22 VAL A 40 1.820 -14.934 6.609 1.00 0.00 H new ATOM 0 HG23 VAL A 40 1.265 -16.327 7.567 1.00 0.00 H new ATOM 635 N ALA A 41 -1.510 -15.178 8.122 1.00 0.00 N ATOM 636 CA ALA A 41 -2.159 -15.519 9.380 1.00 0.00 C ATOM 637 C ALA A 41 -3.665 -15.270 9.292 1.00 0.00 C ATOM 638 O ALA A 41 -4.421 -15.759 10.131 1.00 0.00 O ATOM 639 CB ALA A 41 -1.549 -14.669 10.493 1.00 0.00 C ATOM 0 H ALA A 41 -1.194 -14.210 8.063 1.00 0.00 H new ATOM 0 HA ALA A 41 -2.004 -16.576 9.594 1.00 0.00 H new ATOM 0 HB1 ALA A 41 -2.026 -14.915 11.442 1.00 0.00 H new ATOM 0 HB2 ALA A 41 -0.480 -14.872 10.562 1.00 0.00 H new ATOM 0 HB3 ALA A 41 -1.704 -13.613 10.271 1.00 0.00 H new ATOM 645 N ALA A 42 -4.098 -14.510 8.280 1.00 0.00 N ATOM 646 CA ALA A 42 -5.493 -14.161 8.058 1.00 0.00 C ATOM 647 C ALA A 42 -5.634 -13.498 6.684 1.00 0.00 C ATOM 648 O ALA A 42 -5.525 -12.275 6.586 1.00 0.00 O ATOM 649 CB ALA A 42 -5.953 -13.199 9.154 1.00 0.00 C ATOM 0 H ALA A 42 -3.469 -14.115 7.581 1.00 0.00 H new ATOM 0 HA ALA A 42 -6.111 -15.058 8.088 1.00 0.00 H new ATOM 0 HB1 ALA A 42 -6.998 -12.935 8.991 1.00 0.00 H new ATOM 0 HB2 ALA A 42 -5.847 -13.679 10.127 1.00 0.00 H new ATOM 0 HB3 ALA A 42 -5.342 -12.297 9.126 1.00 0.00 H new ATOM 655 N PRO A 43 -5.872 -14.268 5.614 1.00 0.00 N ATOM 656 CA PRO A 43 -5.969 -13.739 4.262 1.00 0.00 C ATOM 657 C PRO A 43 -7.204 -12.853 4.074 1.00 0.00 C ATOM 658 O PRO A 43 -7.371 -12.238 3.021 1.00 0.00 O ATOM 659 CB PRO A 43 -5.999 -14.965 3.348 1.00 0.00 C ATOM 660 CG PRO A 43 -6.577 -16.060 4.244 1.00 0.00 C ATOM 661 CD PRO A 43 -6.051 -15.708 5.630 1.00 0.00 C ATOM 0 HA PRO A 43 -5.126 -13.088 4.030 1.00 0.00 H new ATOM 0 HB2 PRO A 43 -6.620 -14.796 2.469 1.00 0.00 H new ATOM 0 HB3 PRO A 43 -5.003 -15.223 2.989 1.00 0.00 H new ATOM 0 HG2 PRO A 43 -7.667 -16.064 4.219 1.00 0.00 H new ATOM 0 HG3 PRO A 43 -6.247 -17.050 3.930 1.00 0.00 H new ATOM 0 HD2 PRO A 43 -6.754 -16.009 6.406 1.00 0.00 H new ATOM 0 HD3 PRO A 43 -5.111 -16.220 5.836 1.00 0.00 H new ATOM 669 N ASP A 44 -8.071 -12.779 5.089 1.00 0.00 N ATOM 670 CA ASP A 44 -9.209 -11.871 5.081 1.00 0.00 C ATOM 671 C ASP A 44 -8.760 -10.439 5.400 1.00 0.00 C ATOM 672 O ASP A 44 -9.511 -9.491 5.185 1.00 0.00 O ATOM 673 CB ASP A 44 -10.229 -12.354 6.113 1.00 0.00 C ATOM 674 CG ASP A 44 -11.508 -11.521 6.074 1.00 0.00 C ATOM 675 OD1 ASP A 44 -12.172 -11.528 5.013 1.00 0.00 O ATOM 676 OD2 ASP A 44 -11.815 -10.884 7.107 1.00 0.00 O ATOM 0 H ASP A 44 -7.999 -13.347 5.933 1.00 0.00 H new ATOM 0 HA ASP A 44 -9.663 -11.864 4.090 1.00 0.00 H new ATOM 0 HB2 ASP A 44 -10.470 -13.400 5.925 1.00 0.00 H new ATOM 0 HB3 ASP A 44 -9.791 -12.302 7.110 1.00 0.00 H new ATOM 681 N GLN A 45 -7.535 -10.279 5.915 1.00 0.00 N ATOM 682 CA GLN A 45 -6.973 -8.977 6.252 1.00 0.00 C ATOM 683 C GLN A 45 -6.351 -8.305 5.027 1.00 0.00 C ATOM 684 O GLN A 45 -5.682 -7.284 5.160 1.00 0.00 O ATOM 685 CB GLN A 45 -5.919 -9.136 7.352 1.00 0.00 C ATOM 686 CG GLN A 45 -6.533 -9.706 8.633 1.00 0.00 C ATOM 687 CD GLN A 45 -7.578 -8.774 9.238 1.00 0.00 C ATOM 688 OE1 GLN A 45 -7.480 -7.555 9.129 1.00 0.00 O ATOM 689 NE2 GLN A 45 -8.596 -9.341 9.883 1.00 0.00 N ATOM 0 H GLN A 45 -6.906 -11.058 6.109 1.00 0.00 H new ATOM 0 HA GLN A 45 -7.782 -8.341 6.610 1.00 0.00 H new ATOM 0 HB2 GLN A 45 -5.123 -9.794 7.004 1.00 0.00 H new ATOM 0 HB3 GLN A 45 -5.463 -8.169 7.564 1.00 0.00 H new ATOM 0 HG2 GLN A 45 -6.992 -10.670 8.415 1.00 0.00 H new ATOM 0 HG3 GLN A 45 -5.744 -9.886 9.363 1.00 0.00 H new ATOM 0 HE21 GLN A 45 -8.650 -10.357 9.957 1.00 0.00 H new ATOM 0 HE22 GLN A 45 -9.321 -8.759 10.303 1.00 0.00 H new ATOM 698 N PHE A 46 -6.567 -8.871 3.836 1.00 0.00 N ATOM 699 CA PHE A 46 -6.051 -8.318 2.598 1.00 0.00 C ATOM 700 C PHE A 46 -7.178 -8.235 1.575 1.00 0.00 C ATOM 701 O PHE A 46 -7.296 -9.093 0.700 1.00 0.00 O ATOM 702 CB PHE A 46 -4.873 -9.148 2.098 1.00 0.00 C ATOM 703 CG PHE A 46 -4.002 -8.405 1.111 1.00 0.00 C ATOM 704 CD1 PHE A 46 -4.352 -8.322 -0.245 1.00 0.00 C ATOM 705 CD2 PHE A 46 -2.828 -7.789 1.563 1.00 0.00 C ATOM 706 CE1 PHE A 46 -3.530 -7.619 -1.138 1.00 0.00 C ATOM 707 CE2 PHE A 46 -2.003 -7.094 0.672 1.00 0.00 C ATOM 708 CZ PHE A 46 -2.354 -7.012 -0.681 1.00 0.00 C ATOM 0 H PHE A 46 -7.107 -9.727 3.712 1.00 0.00 H new ATOM 0 HA PHE A 46 -5.677 -7.308 2.767 1.00 0.00 H new ATOM 0 HB2 PHE A 46 -4.266 -9.456 2.949 1.00 0.00 H new ATOM 0 HB3 PHE A 46 -5.250 -10.057 1.629 1.00 0.00 H new ATOM 0 HD1 PHE A 46 -5.253 -8.799 -0.601 1.00 0.00 H new ATOM 0 HD2 PHE A 46 -2.558 -7.851 2.607 1.00 0.00 H new ATOM 0 HE1 PHE A 46 -3.805 -7.546 -2.180 1.00 0.00 H new ATOM 0 HE2 PHE A 46 -1.098 -6.622 1.027 1.00 0.00 H new ATOM 0 HZ PHE A 46 -1.717 -6.480 -1.372 1.00 0.00 H new ATOM 718 N PRO A 47 -8.022 -7.202 1.677 1.00 0.00 N ATOM 719 CA PRO A 47 -9.214 -7.065 0.864 1.00 0.00 C ATOM 720 C PRO A 47 -8.864 -6.804 -0.598 1.00 0.00 C ATOM 721 O PRO A 47 -7.772 -6.334 -0.921 1.00 0.00 O ATOM 722 CB PRO A 47 -9.979 -5.890 1.475 1.00 0.00 C ATOM 723 CG PRO A 47 -8.883 -5.042 2.119 1.00 0.00 C ATOM 724 CD PRO A 47 -7.886 -6.091 2.601 1.00 0.00 C ATOM 0 HA PRO A 47 -9.810 -7.978 0.862 1.00 0.00 H new ATOM 0 HB2 PRO A 47 -10.525 -5.330 0.716 1.00 0.00 H new ATOM 0 HB3 PRO A 47 -10.710 -6.227 2.211 1.00 0.00 H new ATOM 0 HG2 PRO A 47 -8.432 -4.353 1.405 1.00 0.00 H new ATOM 0 HG3 PRO A 47 -9.268 -4.441 2.943 1.00 0.00 H new ATOM 0 HD2 PRO A 47 -6.869 -5.698 2.597 1.00 0.00 H new ATOM 0 HD3 PRO A 47 -8.104 -6.401 3.623 1.00 0.00 H new ATOM 732 N ARG A 48 -9.817 -7.121 -1.480 1.00 0.00 N ATOM 733 CA ARG A 48 -9.703 -6.920 -2.917 1.00 0.00 C ATOM 734 C ARG A 48 -11.009 -6.368 -3.485 1.00 0.00 C ATOM 735 O ARG A 48 -11.173 -6.252 -4.697 1.00 0.00 O ATOM 736 CB ARG A 48 -9.291 -8.219 -3.617 1.00 0.00 C ATOM 737 CG ARG A 48 -10.015 -9.471 -3.112 1.00 0.00 C ATOM 738 CD ARG A 48 -9.256 -10.093 -1.937 1.00 0.00 C ATOM 739 NE ARG A 48 -9.961 -11.271 -1.416 1.00 0.00 N ATOM 740 CZ ARG A 48 -9.626 -11.911 -0.291 1.00 0.00 C ATOM 741 NH1 ARG A 48 -8.608 -11.499 0.456 1.00 0.00 N ATOM 742 NH2 ARG A 48 -10.323 -12.980 0.091 1.00 0.00 N ATOM 0 H ARG A 48 -10.707 -7.534 -1.202 1.00 0.00 H new ATOM 0 HA ARG A 48 -8.921 -6.184 -3.104 1.00 0.00 H new ATOM 0 HB2 ARG A 48 -9.475 -8.115 -4.686 1.00 0.00 H new ATOM 0 HB3 ARG A 48 -8.218 -8.360 -3.491 1.00 0.00 H new ATOM 0 HG2 ARG A 48 -11.028 -9.212 -2.802 1.00 0.00 H new ATOM 0 HG3 ARG A 48 -10.104 -10.197 -3.920 1.00 0.00 H new ATOM 0 HD2 ARG A 48 -8.254 -10.377 -2.257 1.00 0.00 H new ATOM 0 HD3 ARG A 48 -9.140 -9.355 -1.144 1.00 0.00 H new ATOM 0 HE ARG A 48 -10.758 -11.624 -1.947 1.00 0.00 H new ATOM 0 HH11 ARG A 48 -8.067 -10.681 0.175 1.00 0.00 H new ATOM 0 HH12 ARG A 48 -8.367 -12.000 1.311 1.00 0.00 H new ATOM 0 HH21 ARG A 48 -11.107 -13.306 -0.474 1.00 0.00 H new ATOM 0 HH22 ARG A 48 -10.072 -13.473 0.948 1.00 0.00 H new ATOM 756 N ASP A 49 -11.938 -6.026 -2.592 1.00 0.00 N ATOM 757 CA ASP A 49 -13.203 -5.381 -2.919 1.00 0.00 C ATOM 758 C ASP A 49 -12.988 -3.901 -3.264 1.00 0.00 C ATOM 759 O ASP A 49 -13.945 -3.139 -3.398 1.00 0.00 O ATOM 760 CB ASP A 49 -14.152 -5.537 -1.728 1.00 0.00 C ATOM 761 CG ASP A 49 -15.575 -5.091 -2.061 1.00 0.00 C ATOM 762 OD1 ASP A 49 -16.122 -5.599 -3.067 1.00 0.00 O ATOM 763 OD2 ASP A 49 -16.110 -4.248 -1.306 1.00 0.00 O ATOM 0 H ASP A 49 -11.825 -6.197 -1.593 1.00 0.00 H new ATOM 0 HA ASP A 49 -13.641 -5.855 -3.797 1.00 0.00 H new ATOM 0 HB2 ASP A 49 -14.165 -6.580 -1.410 1.00 0.00 H new ATOM 0 HB3 ASP A 49 -13.777 -4.952 -0.888 1.00 0.00 H new ATOM 768 N VAL A 50 -11.724 -3.492 -3.407 1.00 0.00 N ATOM 769 CA VAL A 50 -11.328 -2.120 -3.707 1.00 0.00 C ATOM 770 C VAL A 50 -10.316 -2.126 -4.853 1.00 0.00 C ATOM 771 O VAL A 50 -10.072 -3.171 -5.455 1.00 0.00 O ATOM 772 CB VAL A 50 -10.745 -1.439 -2.458 1.00 0.00 C ATOM 773 CG1 VAL A 50 -11.793 -1.363 -1.347 1.00 0.00 C ATOM 774 CG2 VAL A 50 -9.510 -2.176 -1.932 1.00 0.00 C ATOM 0 H VAL A 50 -10.930 -4.125 -3.314 1.00 0.00 H new ATOM 0 HA VAL A 50 -12.205 -1.549 -4.013 1.00 0.00 H new ATOM 0 HB VAL A 50 -10.448 -0.433 -2.754 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -11.361 -0.878 -0.472 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -12.651 -0.787 -1.695 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -12.115 -2.370 -1.082 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -9.129 -1.663 -1.049 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -9.781 -3.198 -1.669 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -8.740 -2.192 -2.703 1.00 0.00 H new ATOM 784 N ASP A 51 -9.725 -0.970 -5.161 1.00 0.00 N ATOM 785 CA ASP A 51 -8.776 -0.860 -6.258 1.00 0.00 C ATOM 786 C ASP A 51 -7.605 -1.818 -6.033 1.00 0.00 C ATOM 787 O ASP A 51 -7.242 -2.087 -4.888 1.00 0.00 O ATOM 788 CB ASP A 51 -8.273 0.578 -6.361 1.00 0.00 C ATOM 789 CG ASP A 51 -9.365 1.504 -6.888 1.00 0.00 C ATOM 790 OD1 ASP A 51 -10.177 1.971 -6.060 1.00 0.00 O ATOM 791 OD2 ASP A 51 -9.378 1.736 -8.118 1.00 0.00 O ATOM 0 H ASP A 51 -9.891 -0.097 -4.661 1.00 0.00 H new ATOM 0 HA ASP A 51 -9.271 -1.128 -7.191 1.00 0.00 H new ATOM 0 HB2 ASP A 51 -7.941 0.922 -5.381 1.00 0.00 H new ATOM 0 HB3 ASP A 51 -7.407 0.618 -7.022 1.00 0.00 H new ATOM 796 N PRO A 52 -7.005 -2.333 -7.114 1.00 0.00 N ATOM 797 CA PRO A 52 -5.918 -3.298 -7.063 1.00 0.00 C ATOM 798 C PRO A 52 -4.619 -2.686 -6.525 1.00 0.00 C ATOM 799 O PRO A 52 -3.560 -3.297 -6.647 1.00 0.00 O ATOM 800 CB PRO A 52 -5.781 -3.817 -8.493 1.00 0.00 C ATOM 801 CG PRO A 52 -6.252 -2.643 -9.348 1.00 0.00 C ATOM 802 CD PRO A 52 -7.354 -2.025 -8.488 1.00 0.00 C ATOM 0 HA PRO A 52 -6.131 -4.109 -6.367 1.00 0.00 H new ATOM 0 HB2 PRO A 52 -4.752 -4.093 -8.723 1.00 0.00 H new ATOM 0 HB3 PRO A 52 -6.393 -4.704 -8.658 1.00 0.00 H new ATOM 0 HG2 PRO A 52 -5.446 -1.936 -9.544 1.00 0.00 H new ATOM 0 HG3 PRO A 52 -6.630 -2.972 -10.316 1.00 0.00 H new ATOM 0 HD2 PRO A 52 -7.413 -0.948 -8.644 1.00 0.00 H new ATOM 0 HD3 PRO A 52 -8.329 -2.439 -8.746 1.00 0.00 H new ATOM 810 N ARG A 53 -4.688 -1.488 -5.931 1.00 0.00 N ATOM 811 CA ARG A 53 -3.532 -0.855 -5.303 1.00 0.00 C ATOM 812 C ARG A 53 -3.852 -0.398 -3.879 1.00 0.00 C ATOM 813 O ARG A 53 -2.931 -0.141 -3.109 1.00 0.00 O ATOM 814 CB ARG A 53 -3.040 0.345 -6.121 1.00 0.00 C ATOM 815 CG ARG A 53 -2.649 -0.017 -7.557 1.00 0.00 C ATOM 816 CD ARG A 53 -3.783 0.268 -8.545 1.00 0.00 C ATOM 817 NE ARG A 53 -4.132 1.694 -8.589 1.00 0.00 N ATOM 818 CZ ARG A 53 -3.360 2.655 -9.115 1.00 0.00 C ATOM 819 NH1 ARG A 53 -2.188 2.374 -9.672 1.00 0.00 N ATOM 820 NH2 ARG A 53 -3.761 3.920 -9.085 1.00 0.00 N ATOM 0 H ARG A 53 -5.544 -0.936 -5.875 1.00 0.00 H new ATOM 0 HA ARG A 53 -2.743 -1.606 -5.265 1.00 0.00 H new ATOM 0 HB2 ARG A 53 -3.822 1.104 -6.146 1.00 0.00 H new ATOM 0 HB3 ARG A 53 -2.180 0.789 -5.619 1.00 0.00 H new ATOM 0 HG2 ARG A 53 -1.764 0.550 -7.846 1.00 0.00 H new ATOM 0 HG3 ARG A 53 -2.382 -1.073 -7.606 1.00 0.00 H new ATOM 0 HD2 ARG A 53 -3.488 -0.063 -9.541 1.00 0.00 H new ATOM 0 HD3 ARG A 53 -4.662 -0.312 -8.264 1.00 0.00 H new ATOM 0 HE ARG A 53 -5.028 1.974 -8.190 1.00 0.00 H new ATOM 0 HH11 ARG A 53 -1.858 1.410 -9.706 1.00 0.00 H new ATOM 0 HH12 ARG A 53 -1.618 3.123 -10.066 1.00 0.00 H new ATOM 0 HH21 ARG A 53 -4.657 4.161 -8.661 1.00 0.00 H new ATOM 0 HH22 ARG A 53 -3.173 4.651 -9.485 1.00 0.00 H new ATOM 834 N LEU A 54 -5.133 -0.294 -3.512 1.00 0.00 N ATOM 835 CA LEU A 54 -5.481 0.125 -2.166 1.00 0.00 C ATOM 836 C LEU A 54 -5.159 -0.978 -1.164 1.00 0.00 C ATOM 837 O LEU A 54 -4.690 -0.689 -0.067 1.00 0.00 O ATOM 838 CB LEU A 54 -6.968 0.486 -2.081 1.00 0.00 C ATOM 839 CG LEU A 54 -7.280 1.880 -2.626 1.00 0.00 C ATOM 840 CD1 LEU A 54 -8.752 2.200 -2.401 1.00 0.00 C ATOM 841 CD2 LEU A 54 -6.457 2.954 -1.927 1.00 0.00 C ATOM 0 H LEU A 54 -5.927 -0.492 -4.121 1.00 0.00 H new ATOM 0 HA LEU A 54 -4.890 1.008 -1.922 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -7.547 -0.252 -2.636 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -7.291 0.428 -1.041 1.00 0.00 H new ATOM 0 HG LEU A 54 -7.035 1.876 -3.688 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -8.972 3.194 -2.790 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -9.368 1.464 -2.918 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -8.972 2.172 -1.334 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -6.706 3.931 -2.341 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -6.679 2.945 -0.860 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -5.396 2.756 -2.079 1.00 0.00 H new ATOM 853 N GLY A 55 -5.404 -2.241 -1.528 1.00 0.00 N ATOM 854 CA GLY A 55 -5.065 -3.351 -0.652 1.00 0.00 C ATOM 855 C GLY A 55 -3.552 -3.464 -0.484 1.00 0.00 C ATOM 856 O GLY A 55 -3.062 -3.745 0.609 1.00 0.00 O ATOM 0 H GLY A 55 -5.831 -2.511 -2.414 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -5.534 -3.209 0.321 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -5.460 -4.280 -1.064 1.00 0.00 H new ATOM 860 N LEU A 56 -2.813 -3.235 -1.577 1.00 0.00 N ATOM 861 CA LEU A 56 -1.358 -3.288 -1.590 1.00 0.00 C ATOM 862 C LEU A 56 -0.785 -2.264 -0.610 1.00 0.00 C ATOM 863 O LEU A 56 0.008 -2.612 0.264 1.00 0.00 O ATOM 864 CB LEU A 56 -0.861 -2.976 -3.010 1.00 0.00 C ATOM 865 CG LEU A 56 -0.933 -4.138 -4.012 1.00 0.00 C ATOM 866 CD1 LEU A 56 0.147 -5.167 -3.688 1.00 0.00 C ATOM 867 CD2 LEU A 56 -2.298 -4.824 -4.026 1.00 0.00 C ATOM 0 H LEU A 56 -3.220 -3.006 -2.484 1.00 0.00 H new ATOM 0 HA LEU A 56 -1.029 -4.283 -1.290 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -1.444 -2.144 -3.404 1.00 0.00 H new ATOM 0 HB3 LEU A 56 0.174 -2.639 -2.947 1.00 0.00 H new ATOM 0 HG LEU A 56 -0.772 -3.713 -5.003 1.00 0.00 H new ATOM 0 HD11 LEU A 56 0.092 -5.989 -4.401 1.00 0.00 H new ATOM 0 HD12 LEU A 56 1.128 -4.697 -3.751 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -0.007 -5.551 -2.679 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -2.289 -5.637 -4.752 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -2.514 -5.225 -3.036 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -3.066 -4.101 -4.300 1.00 0.00 H new ATOM 879 N TYR A 57 -1.185 -0.997 -0.756 1.00 0.00 N ATOM 880 CA TYR A 57 -0.641 0.079 0.059 1.00 0.00 C ATOM 881 C TYR A 57 -1.149 0.014 1.496 1.00 0.00 C ATOM 882 O TYR A 57 -0.396 0.321 2.416 1.00 0.00 O ATOM 883 CB TYR A 57 -1.034 1.428 -0.550 1.00 0.00 C ATOM 884 CG TYR A 57 -0.192 1.879 -1.725 1.00 0.00 C ATOM 885 CD1 TYR A 57 -0.028 1.064 -2.857 1.00 0.00 C ATOM 886 CD2 TYR A 57 0.427 3.138 -1.685 1.00 0.00 C ATOM 887 CE1 TYR A 57 0.751 1.503 -3.939 1.00 0.00 C ATOM 888 CE2 TYR A 57 1.205 3.588 -2.758 1.00 0.00 C ATOM 889 CZ TYR A 57 1.370 2.769 -3.890 1.00 0.00 C ATOM 890 OH TYR A 57 2.129 3.196 -4.936 1.00 0.00 O ATOM 0 H TYR A 57 -1.885 -0.697 -1.434 1.00 0.00 H new ATOM 0 HA TYR A 57 0.443 -0.032 0.077 1.00 0.00 H new ATOM 0 HB2 TYR A 57 -2.075 1.374 -0.870 1.00 0.00 H new ATOM 0 HB3 TYR A 57 -0.979 2.189 0.228 1.00 0.00 H new ATOM 0 HD1 TYR A 57 -0.503 0.095 -2.895 1.00 0.00 H new ATOM 0 HD2 TYR A 57 0.302 3.767 -0.816 1.00 0.00 H new ATOM 0 HE1 TYR A 57 0.876 0.873 -4.807 1.00 0.00 H new ATOM 0 HE2 TYR A 57 1.676 4.559 -2.717 1.00 0.00 H new ATOM 0 HH TYR A 57 1.790 2.804 -5.768 1.00 0.00 H new ATOM 900 N ARG A 58 -2.409 -0.380 1.713 1.00 0.00 N ATOM 901 CA ARG A 58 -2.990 -0.343 3.049 1.00 0.00 C ATOM 902 C ARG A 58 -2.219 -1.236 4.016 1.00 0.00 C ATOM 903 O ARG A 58 -1.989 -0.838 5.159 1.00 0.00 O ATOM 904 CB ARG A 58 -4.462 -0.757 2.984 1.00 0.00 C ATOM 905 CG ARG A 58 -5.119 -0.740 4.370 1.00 0.00 C ATOM 906 CD ARG A 58 -5.116 0.665 4.969 1.00 0.00 C ATOM 907 NE ARG A 58 -5.703 0.673 6.313 1.00 0.00 N ATOM 908 CZ ARG A 58 -5.038 0.348 7.424 1.00 0.00 C ATOM 909 NH1 ARG A 58 -3.762 -0.034 7.378 1.00 0.00 N ATOM 910 NH2 ARG A 58 -5.648 0.402 8.602 1.00 0.00 N ATOM 0 H ARG A 58 -3.036 -0.724 0.986 1.00 0.00 H new ATOM 0 HA ARG A 58 -2.923 0.678 3.426 1.00 0.00 H new ATOM 0 HB2 ARG A 58 -5.000 -0.083 2.318 1.00 0.00 H new ATOM 0 HB3 ARG A 58 -4.540 -1.757 2.557 1.00 0.00 H new ATOM 0 HG2 ARG A 58 -6.144 -1.103 4.293 1.00 0.00 H new ATOM 0 HG3 ARG A 58 -4.589 -1.422 5.035 1.00 0.00 H new ATOM 0 HD2 ARG A 58 -4.094 1.041 5.014 1.00 0.00 H new ATOM 0 HD3 ARG A 58 -5.676 1.340 4.321 1.00 0.00 H new ATOM 0 HE ARG A 58 -6.682 0.944 6.405 1.00 0.00 H new ATOM 0 HH11 ARG A 58 -3.276 -0.082 6.483 1.00 0.00 H new ATOM 0 HH12 ARG A 58 -3.271 -0.278 8.238 1.00 0.00 H new ATOM 0 HH21 ARG A 58 -6.624 0.692 8.658 1.00 0.00 H new ATOM 0 HH22 ARG A 58 -5.140 0.154 9.451 1.00 0.00 H new ATOM 924 N MET A 59 -1.820 -2.433 3.578 1.00 0.00 N ATOM 925 CA MET A 59 -1.111 -3.341 4.465 1.00 0.00 C ATOM 926 C MET A 59 0.371 -2.991 4.556 1.00 0.00 C ATOM 927 O MET A 59 0.997 -3.285 5.573 1.00 0.00 O ATOM 928 CB MET A 59 -1.323 -4.780 4.000 1.00 0.00 C ATOM 929 CG MET A 59 -2.817 -5.112 4.017 1.00 0.00 C ATOM 930 SD MET A 59 -3.651 -4.792 5.595 1.00 0.00 S ATOM 931 CE MET A 59 -2.841 -6.041 6.629 1.00 0.00 C ATOM 0 H MET A 59 -1.974 -2.785 2.633 1.00 0.00 H new ATOM 0 HA MET A 59 -1.517 -3.237 5.471 1.00 0.00 H new ATOM 0 HB2 MET A 59 -0.923 -4.910 2.994 1.00 0.00 H new ATOM 0 HB3 MET A 59 -0.781 -5.466 4.650 1.00 0.00 H new ATOM 0 HG2 MET A 59 -3.312 -4.533 3.237 1.00 0.00 H new ATOM 0 HG3 MET A 59 -2.944 -6.164 3.762 1.00 0.00 H new ATOM 0 HE1 MET A 59 -2.876 -5.728 7.672 1.00 0.00 H new ATOM 0 HE2 MET A 59 -3.357 -6.995 6.519 1.00 0.00 H new ATOM 0 HE3 MET A 59 -1.802 -6.153 6.318 1.00 0.00 H new ATOM 941 N PHE A 60 0.948 -2.366 3.523 1.00 0.00 N ATOM 942 CA PHE A 60 2.328 -1.915 3.610 1.00 0.00 C ATOM 943 C PHE A 60 2.450 -0.772 4.615 1.00 0.00 C ATOM 944 O PHE A 60 3.428 -0.690 5.355 1.00 0.00 O ATOM 945 CB PHE A 60 2.809 -1.462 2.231 1.00 0.00 C ATOM 946 CG PHE A 60 4.236 -0.956 2.244 1.00 0.00 C ATOM 947 CD1 PHE A 60 5.300 -1.864 2.373 1.00 0.00 C ATOM 948 CD2 PHE A 60 4.501 0.418 2.125 1.00 0.00 C ATOM 949 CE1 PHE A 60 6.620 -1.398 2.390 1.00 0.00 C ATOM 950 CE2 PHE A 60 5.825 0.881 2.138 1.00 0.00 C ATOM 951 CZ PHE A 60 6.884 -0.027 2.271 1.00 0.00 C ATOM 0 H PHE A 60 0.485 -2.167 2.636 1.00 0.00 H new ATOM 0 HA PHE A 60 2.951 -2.741 3.951 1.00 0.00 H new ATOM 0 HB2 PHE A 60 2.730 -2.295 1.532 1.00 0.00 H new ATOM 0 HB3 PHE A 60 2.152 -0.674 1.863 1.00 0.00 H new ATOM 0 HD1 PHE A 60 5.100 -2.922 2.459 1.00 0.00 H new ATOM 0 HD2 PHE A 60 3.685 1.118 2.023 1.00 0.00 H new ATOM 0 HE1 PHE A 60 7.437 -2.097 2.495 1.00 0.00 H new ATOM 0 HE2 PHE A 60 6.028 1.938 2.045 1.00 0.00 H new ATOM 0 HZ PHE A 60 7.903 0.330 2.282 1.00 0.00 H new ATOM 961 N GLN A 61 1.448 0.115 4.643 1.00 0.00 N ATOM 962 CA GLN A 61 1.395 1.202 5.606 1.00 0.00 C ATOM 963 C GLN A 61 1.179 0.651 7.013 1.00 0.00 C ATOM 964 O GLN A 61 1.548 1.297 7.992 1.00 0.00 O ATOM 965 CB GLN A 61 0.252 2.149 5.230 1.00 0.00 C ATOM 966 CG GLN A 61 0.518 2.882 3.912 1.00 0.00 C ATOM 967 CD GLN A 61 1.543 3.996 4.071 1.00 0.00 C ATOM 968 OE1 GLN A 61 2.743 3.747 4.138 1.00 0.00 O ATOM 969 NE2 GLN A 61 1.076 5.240 4.131 1.00 0.00 N ATOM 0 H GLN A 61 0.658 0.093 3.998 1.00 0.00 H new ATOM 0 HA GLN A 61 2.339 1.746 5.591 1.00 0.00 H new ATOM 0 HB2 GLN A 61 -0.675 1.582 5.148 1.00 0.00 H new ATOM 0 HB3 GLN A 61 0.110 2.879 6.027 1.00 0.00 H new ATOM 0 HG2 GLN A 61 0.871 2.169 3.167 1.00 0.00 H new ATOM 0 HG3 GLN A 61 -0.416 3.300 3.536 1.00 0.00 H new ATOM 0 HE21 GLN A 61 0.072 5.411 4.072 1.00 0.00 H new ATOM 0 HE22 GLN A 61 1.722 6.023 4.236 1.00 0.00 H new ATOM 978 N GLY A 62 0.584 -0.544 7.124 1.00 0.00 N ATOM 979 CA GLY A 62 0.346 -1.174 8.411 1.00 0.00 C ATOM 980 C GLY A 62 1.646 -1.645 9.062 1.00 0.00 C ATOM 981 O GLY A 62 1.791 -1.540 10.277 1.00 0.00 O ATOM 0 H GLY A 62 0.260 -1.090 6.326 1.00 0.00 H new ATOM 0 HA2 GLY A 62 -0.157 -0.469 9.073 1.00 0.00 H new ATOM 0 HA3 GLY A 62 -0.324 -2.024 8.281 1.00 0.00 H new ATOM 985 N ILE A 63 2.594 -2.162 8.270 1.00 0.00 N ATOM 986 CA ILE A 63 3.873 -2.602 8.815 1.00 0.00 C ATOM 987 C ILE A 63 4.713 -1.396 9.210 1.00 0.00 C ATOM 988 O ILE A 63 5.378 -1.420 10.246 1.00 0.00 O ATOM 989 CB ILE A 63 4.634 -3.444 7.785 1.00 0.00 C ATOM 990 CG1 ILE A 63 3.813 -4.653 7.317 1.00 0.00 C ATOM 991 CG2 ILE A 63 5.961 -3.923 8.377 1.00 0.00 C ATOM 992 CD1 ILE A 63 3.406 -5.586 8.458 1.00 0.00 C ATOM 0 H ILE A 63 2.497 -2.283 7.262 1.00 0.00 H new ATOM 0 HA ILE A 63 3.681 -3.213 9.697 1.00 0.00 H new ATOM 0 HB ILE A 63 4.823 -2.810 6.919 1.00 0.00 H new ATOM 0 HG12 ILE A 63 2.916 -4.299 6.809 1.00 0.00 H new ATOM 0 HG13 ILE A 63 4.393 -5.216 6.586 1.00 0.00 H new ATOM 0 HG21 ILE A 63 6.495 -4.520 7.638 1.00 0.00 H new ATOM 0 HG22 ILE A 63 6.568 -3.061 8.654 1.00 0.00 H new ATOM 0 HG23 ILE A 63 5.767 -4.529 9.262 1.00 0.00 H new ATOM 0 HD11 ILE A 63 2.828 -6.419 8.058 1.00 0.00 H new ATOM 0 HD12 ILE A 63 4.299 -5.968 8.952 1.00 0.00 H new ATOM 0 HD13 ILE A 63 2.800 -5.037 9.178 1.00 0.00 H new ATOM 1004 N TRP A 64 4.691 -0.338 8.394 1.00 0.00 N ATOM 1005 CA TRP A 64 5.476 0.856 8.668 1.00 0.00 C ATOM 1006 C TRP A 64 4.928 1.599 9.887 1.00 0.00 C ATOM 1007 O TRP A 64 5.697 2.166 10.660 1.00 0.00 O ATOM 1008 CB TRP A 64 5.458 1.765 7.440 1.00 0.00 C ATOM 1009 CG TRP A 64 6.339 2.967 7.561 1.00 0.00 C ATOM 1010 CD1 TRP A 64 7.671 2.985 7.350 1.00 0.00 C ATOM 1011 CD2 TRP A 64 5.978 4.337 7.922 1.00 0.00 C ATOM 1012 NE1 TRP A 64 8.158 4.257 7.552 1.00 0.00 N ATOM 1013 CE2 TRP A 64 7.156 5.133 7.913 1.00 0.00 C ATOM 1014 CE3 TRP A 64 4.773 4.983 8.261 1.00 0.00 C ATOM 1015 CZ2 TRP A 64 7.146 6.499 8.223 1.00 0.00 C ATOM 1016 CZ3 TRP A 64 4.753 6.352 8.577 1.00 0.00 C ATOM 1017 CH2 TRP A 64 5.933 7.111 8.557 1.00 0.00 C ATOM 0 H TRP A 64 4.136 -0.290 7.540 1.00 0.00 H new ATOM 0 HA TRP A 64 6.502 0.562 8.888 1.00 0.00 H new ATOM 0 HB2 TRP A 64 5.766 1.187 6.568 1.00 0.00 H new ATOM 0 HB3 TRP A 64 4.435 2.094 7.259 1.00 0.00 H new ATOM 0 HD1 TRP A 64 8.266 2.130 7.065 1.00 0.00 H new ATOM 0 HE1 TRP A 64 9.138 4.519 7.448 1.00 0.00 H new ATOM 0 HE3 TRP A 64 3.852 4.419 8.278 1.00 0.00 H new ATOM 0 HZ2 TRP A 64 8.062 7.072 8.204 1.00 0.00 H new ATOM 0 HZ3 TRP A 64 3.818 6.826 8.838 1.00 0.00 H new ATOM 0 HH2 TRP A 64 5.905 8.163 8.798 1.00 0.00 H new ATOM 1028 N ALA A 65 3.604 1.598 10.067 1.00 0.00 N ATOM 1029 CA ALA A 65 2.987 2.228 11.219 1.00 0.00 C ATOM 1030 C ALA A 65 3.295 1.443 12.493 1.00 0.00 C ATOM 1031 O ALA A 65 3.330 2.020 13.577 1.00 0.00 O ATOM 1032 CB ALA A 65 1.476 2.307 11.009 1.00 0.00 C ATOM 0 H ALA A 65 2.944 1.164 9.422 1.00 0.00 H new ATOM 0 HA ALA A 65 3.393 3.233 11.329 1.00 0.00 H new ATOM 0 HB1 ALA A 65 1.013 2.780 11.875 1.00 0.00 H new ATOM 0 HB2 ALA A 65 1.263 2.895 10.116 1.00 0.00 H new ATOM 0 HB3 ALA A 65 1.073 1.302 10.886 1.00 0.00 H new ATOM 1038 N SER A 66 3.523 0.131 12.369 1.00 0.00 N ATOM 1039 CA SER A 66 3.864 -0.709 13.506 1.00 0.00 C ATOM 1040 C SER A 66 5.357 -0.617 13.817 1.00 0.00 C ATOM 1041 O SER A 66 5.787 -0.972 14.912 1.00 0.00 O ATOM 1042 CB SER A 66 3.484 -2.152 13.194 1.00 0.00 C ATOM 1043 OG SER A 66 3.669 -2.966 14.335 1.00 0.00 O ATOM 0 H SER A 66 3.475 -0.369 11.481 1.00 0.00 H new ATOM 0 HA SER A 66 3.313 -0.364 14.381 1.00 0.00 H new ATOM 0 HB2 SER A 66 2.444 -2.199 12.870 1.00 0.00 H new ATOM 0 HB3 SER A 66 4.092 -2.525 12.370 1.00 0.00 H new ATOM 0 HG SER A 66 3.420 -3.890 14.122 1.00 0.00 H new ATOM 1049 N ALA A 67 6.156 -0.140 12.855 1.00 0.00 N ATOM 1050 CA ALA A 67 7.594 -0.024 13.026 1.00 0.00 C ATOM 1051 C ALA A 67 7.940 1.165 13.917 1.00 0.00 C ATOM 1052 O ALA A 67 8.750 1.037 14.835 1.00 0.00 O ATOM 1053 CB ALA A 67 8.234 0.146 11.649 1.00 0.00 C ATOM 0 H ALA A 67 5.819 0.172 11.945 1.00 0.00 H new ATOM 0 HA ALA A 67 7.976 -0.924 13.509 1.00 0.00 H new ATOM 0 HB1 ALA A 67 9.315 0.235 11.759 1.00 0.00 H new ATOM 0 HB2 ALA A 67 8.002 -0.721 11.030 1.00 0.00 H new ATOM 0 HB3 ALA A 67 7.842 1.046 11.174 1.00 0.00 H new ATOM 1059 N ASN A 68 7.331 2.327 13.659 1.00 0.00 N ATOM 1060 CA ASN A 68 7.589 3.510 14.471 1.00 0.00 C ATOM 1061 C ASN A 68 6.845 3.439 15.803 1.00 0.00 C ATOM 1062 O ASN A 68 7.159 4.179 16.733 1.00 0.00 O ATOM 1063 CB ASN A 68 7.216 4.768 13.683 1.00 0.00 C ATOM 1064 CG ASN A 68 5.740 4.828 13.323 1.00 0.00 C ATOM 1065 OD1 ASN A 68 4.880 4.934 14.196 1.00 0.00 O ATOM 1066 ND2 ASN A 68 5.437 4.760 12.032 1.00 0.00 N ATOM 0 H ASN A 68 6.663 2.469 12.901 1.00 0.00 H new ATOM 0 HA ASN A 68 8.653 3.552 14.705 1.00 0.00 H new ATOM 0 HB2 ASN A 68 7.477 5.648 14.270 1.00 0.00 H new ATOM 0 HB3 ASN A 68 7.809 4.807 12.769 1.00 0.00 H new ATOM 0 HD21 ASN A 68 4.462 4.795 11.734 1.00 0.00 H new ATOM 0 HD22 ASN A 68 6.179 4.672 11.338 1.00 0.00 H new ATOM 1073 N ALA A 69 5.859 2.541 15.898 1.00 0.00 N ATOM 1074 CA ALA A 69 5.115 2.296 17.122 1.00 0.00 C ATOM 1075 C ALA A 69 5.903 1.394 18.080 1.00 0.00 C ATOM 1076 O ALA A 69 5.404 1.052 19.153 1.00 0.00 O ATOM 1077 CB ALA A 69 3.768 1.667 16.771 1.00 0.00 C ATOM 0 H ALA A 69 5.558 1.961 15.115 1.00 0.00 H new ATOM 0 HA ALA A 69 4.951 3.245 17.633 1.00 0.00 H new ATOM 0 HB1 ALA A 69 3.204 1.480 17.685 1.00 0.00 H new ATOM 0 HB2 ALA A 69 3.205 2.346 16.130 1.00 0.00 H new ATOM 0 HB3 ALA A 69 3.932 0.725 16.247 1.00 0.00 H new ATOM 1083 N ASP A 70 7.125 1.008 17.701 1.00 0.00 N ATOM 1084 CA ASP A 70 7.980 0.160 18.519 1.00 0.00 C ATOM 1085 C ASP A 70 9.432 0.651 18.504 1.00 0.00 C ATOM 1086 O ASP A 70 10.304 0.047 19.128 1.00 0.00 O ATOM 1087 CB ASP A 70 7.870 -1.283 18.021 1.00 0.00 C ATOM 1088 CG ASP A 70 8.566 -2.268 18.957 1.00 0.00 C ATOM 1089 OD1 ASP A 70 8.182 -2.303 20.147 1.00 0.00 O ATOM 1090 OD2 ASP A 70 9.478 -2.979 18.476 1.00 0.00 O ATOM 0 H ASP A 70 7.546 1.279 16.812 1.00 0.00 H new ATOM 0 HA ASP A 70 7.647 0.206 19.556 1.00 0.00 H new ATOM 0 HB2 ASP A 70 6.819 -1.554 17.927 1.00 0.00 H new ATOM 0 HB3 ASP A 70 8.309 -1.357 17.026 1.00 0.00 H new ATOM 1095 N GLY A 71 9.701 1.751 17.791 1.00 0.00 N ATOM 1096 CA GLY A 71 11.017 2.372 17.773 1.00 0.00 C ATOM 1097 C GLY A 71 11.947 1.788 16.711 1.00 0.00 C ATOM 1098 O GLY A 71 13.120 2.151 16.662 1.00 0.00 O ATOM 0 H GLY A 71 9.010 2.230 17.214 1.00 0.00 H new ATOM 0 HA2 GLY A 71 10.904 3.442 17.598 1.00 0.00 H new ATOM 0 HA3 GLY A 71 11.479 2.257 18.754 1.00 0.00 H new ATOM 1102 N GLU A 72 11.444 0.891 15.856 1.00 0.00 N ATOM 1103 CA GLU A 72 12.259 0.277 14.812 1.00 0.00 C ATOM 1104 C GLU A 72 12.651 1.293 13.741 1.00 0.00 C ATOM 1105 O GLU A 72 13.555 1.041 12.946 1.00 0.00 O ATOM 1106 CB GLU A 72 11.508 -0.894 14.174 1.00 0.00 C ATOM 1107 CG GLU A 72 11.188 -1.968 15.212 1.00 0.00 C ATOM 1108 CD GLU A 72 10.553 -3.188 14.547 1.00 0.00 C ATOM 1109 OE1 GLU A 72 9.320 -3.164 14.345 1.00 0.00 O ATOM 1110 OE2 GLU A 72 11.310 -4.138 14.244 1.00 0.00 O ATOM 0 H GLU A 72 10.474 0.576 15.870 1.00 0.00 H new ATOM 0 HA GLU A 72 13.173 -0.093 15.277 1.00 0.00 H new ATOM 0 HB2 GLU A 72 10.584 -0.535 13.720 1.00 0.00 H new ATOM 0 HB3 GLU A 72 12.110 -1.324 13.374 1.00 0.00 H new ATOM 0 HG2 GLU A 72 12.100 -2.263 15.730 1.00 0.00 H new ATOM 0 HG3 GLU A 72 10.511 -1.564 15.964 1.00 0.00 H new ATOM 1117 N ALA A 73 11.974 2.445 13.716 1.00 0.00 N ATOM 1118 CA ALA A 73 12.265 3.531 12.798 1.00 0.00 C ATOM 1119 C ALA A 73 11.676 4.835 13.337 1.00 0.00 C ATOM 1120 O ALA A 73 10.698 4.810 14.083 1.00 0.00 O ATOM 1121 CB ALA A 73 11.656 3.204 11.433 1.00 0.00 C ATOM 0 H ALA A 73 11.197 2.644 14.346 1.00 0.00 H new ATOM 0 HA ALA A 73 13.344 3.651 12.696 1.00 0.00 H new ATOM 0 HB1 ALA A 73 11.869 4.014 10.736 1.00 0.00 H new ATOM 0 HB2 ALA A 73 12.087 2.277 11.055 1.00 0.00 H new ATOM 0 HB3 ALA A 73 10.577 3.087 11.535 1.00 0.00 H new ATOM 1127 N GLN A 74 12.266 5.969 12.955 1.00 0.00 N ATOM 1128 CA GLN A 74 11.781 7.284 13.358 1.00 0.00 C ATOM 1129 C GLN A 74 12.002 8.338 12.267 1.00 0.00 C ATOM 1130 O GLN A 74 11.495 9.453 12.385 1.00 0.00 O ATOM 1131 CB GLN A 74 12.497 7.730 14.640 1.00 0.00 C ATOM 1132 CG GLN A 74 12.186 6.815 15.830 1.00 0.00 C ATOM 1133 CD GLN A 74 12.798 7.340 17.121 1.00 0.00 C ATOM 1134 OE1 GLN A 74 13.809 8.038 17.107 1.00 0.00 O ATOM 1135 NE2 GLN A 74 12.188 7.008 18.256 1.00 0.00 N ATOM 0 H GLN A 74 13.093 5.998 12.358 1.00 0.00 H new ATOM 0 HA GLN A 74 10.708 7.197 13.532 1.00 0.00 H new ATOM 0 HB2 GLN A 74 13.573 7.743 14.466 1.00 0.00 H new ATOM 0 HB3 GLN A 74 12.201 8.751 14.882 1.00 0.00 H new ATOM 0 HG2 GLN A 74 11.106 6.728 15.949 1.00 0.00 H new ATOM 0 HG3 GLN A 74 12.567 5.814 15.628 1.00 0.00 H new ATOM 0 HE21 GLN A 74 11.350 6.427 18.234 1.00 0.00 H new ATOM 0 HE22 GLN A 74 12.558 7.335 19.148 1.00 0.00 H new ATOM 1144 N THR A 75 12.751 8.006 11.210 1.00 0.00 N ATOM 1145 CA THR A 75 13.058 8.928 10.122 1.00 0.00 C ATOM 1146 C THR A 75 13.620 8.151 8.932 1.00 0.00 C ATOM 1147 O THR A 75 13.808 6.938 9.017 1.00 0.00 O ATOM 1148 CB THR A 75 14.059 9.981 10.614 1.00 0.00 C ATOM 1149 OG1 THR A 75 14.246 10.966 9.620 1.00 0.00 O ATOM 1150 CG2 THR A 75 15.414 9.361 10.962 1.00 0.00 C ATOM 0 H THR A 75 13.163 7.081 11.089 1.00 0.00 H new ATOM 0 HA THR A 75 12.150 9.437 9.799 1.00 0.00 H new ATOM 0 HB THR A 75 13.645 10.428 11.518 1.00 0.00 H new ATOM 0 HG1 THR A 75 14.885 11.637 9.940 1.00 0.00 H new ATOM 0 HG21 THR A 75 16.093 10.141 11.306 1.00 0.00 H new ATOM 0 HG22 THR A 75 15.283 8.620 11.750 1.00 0.00 H new ATOM 0 HG23 THR A 75 15.832 8.880 10.078 1.00 0.00 H new ATOM 1158 N SER A 76 13.896 8.837 7.820 1.00 0.00 N ATOM 1159 CA SER A 76 14.486 8.220 6.638 1.00 0.00 C ATOM 1160 C SER A 76 15.285 9.250 5.840 1.00 0.00 C ATOM 1161 O SER A 76 15.032 10.451 5.931 1.00 0.00 O ATOM 1162 CB SER A 76 13.384 7.609 5.771 1.00 0.00 C ATOM 1163 OG SER A 76 12.446 8.594 5.392 1.00 0.00 O ATOM 0 H SER A 76 13.715 9.836 7.718 1.00 0.00 H new ATOM 0 HA SER A 76 15.168 7.430 6.953 1.00 0.00 H new ATOM 0 HB2 SER A 76 13.823 7.156 4.882 1.00 0.00 H new ATOM 0 HB3 SER A 76 12.881 6.813 6.320 1.00 0.00 H new ATOM 0 HG SER A 76 11.565 8.180 5.278 1.00 0.00 H new ATOM 1169 N GLN A 77 16.252 8.769 5.057 1.00 0.00 N ATOM 1170 CA GLN A 77 17.112 9.599 4.222 1.00 0.00 C ATOM 1171 C GLN A 77 17.671 8.734 3.090 1.00 0.00 C ATOM 1172 O GLN A 77 17.646 7.508 3.184 1.00 0.00 O ATOM 1173 CB GLN A 77 18.239 10.168 5.094 1.00 0.00 C ATOM 1174 CG GLN A 77 19.123 11.161 4.334 1.00 0.00 C ATOM 1175 CD GLN A 77 20.149 11.824 5.249 1.00 0.00 C ATOM 1176 OE1 GLN A 77 19.869 12.125 6.406 1.00 0.00 O ATOM 1177 NE2 GLN A 77 21.354 12.058 4.738 1.00 0.00 N ATOM 0 H GLN A 77 16.461 7.773 4.986 1.00 0.00 H new ATOM 0 HA GLN A 77 16.557 10.430 3.785 1.00 0.00 H new ATOM 0 HB2 GLN A 77 17.807 10.663 5.964 1.00 0.00 H new ATOM 0 HB3 GLN A 77 18.855 9.349 5.466 1.00 0.00 H new ATOM 0 HG2 GLN A 77 19.639 10.643 3.525 1.00 0.00 H new ATOM 0 HG3 GLN A 77 18.498 11.926 3.875 1.00 0.00 H new ATOM 0 HE21 GLN A 77 21.558 11.797 3.773 1.00 0.00 H new ATOM 0 HE22 GLN A 77 22.074 12.498 5.311 1.00 0.00 H new ATOM 1186 N SER A 78 18.179 9.353 2.022 1.00 0.00 N ATOM 1187 CA SER A 78 18.686 8.615 0.871 1.00 0.00 C ATOM 1188 C SER A 78 19.973 9.244 0.349 1.00 0.00 C ATOM 1189 O SER A 78 20.309 10.374 0.700 1.00 0.00 O ATOM 1190 CB SER A 78 17.622 8.586 -0.226 1.00 0.00 C ATOM 1191 OG SER A 78 16.446 7.974 0.260 1.00 0.00 O ATOM 0 H SER A 78 18.249 10.367 1.934 1.00 0.00 H new ATOM 0 HA SER A 78 18.913 7.594 1.178 1.00 0.00 H new ATOM 0 HB2 SER A 78 17.403 9.601 -0.559 1.00 0.00 H new ATOM 0 HB3 SER A 78 17.995 8.040 -1.092 1.00 0.00 H new ATOM 0 HG SER A 78 15.768 7.960 -0.447 1.00 0.00 H new ATOM 1197 N ASP A 79 20.693 8.506 -0.499 1.00 0.00 N ATOM 1198 CA ASP A 79 21.986 8.931 -1.015 1.00 0.00 C ATOM 1199 C ASP A 79 22.226 8.373 -2.422 1.00 0.00 C ATOM 1200 O ASP A 79 23.370 8.196 -2.837 1.00 0.00 O ATOM 1201 CB ASP A 79 23.077 8.480 -0.035 1.00 0.00 C ATOM 1202 CG ASP A 79 24.431 9.112 -0.350 1.00 0.00 C ATOM 1203 OD1 ASP A 79 24.458 10.349 -0.546 1.00 0.00 O ATOM 1204 OD2 ASP A 79 25.429 8.356 -0.391 1.00 0.00 O ATOM 0 H ASP A 79 20.391 7.595 -0.845 1.00 0.00 H new ATOM 0 HA ASP A 79 22.010 10.017 -1.101 1.00 0.00 H new ATOM 0 HB2 ASP A 79 22.782 8.743 0.981 1.00 0.00 H new ATOM 0 HB3 ASP A 79 23.168 7.394 -0.069 1.00 0.00 H new ATOM 1209 N ALA A 80 21.144 8.089 -3.161 1.00 0.00 N ATOM 1210 CA ALA A 80 21.238 7.578 -4.519 1.00 0.00 C ATOM 1211 C ALA A 80 22.041 8.523 -5.414 1.00 0.00 C ATOM 1212 O ALA A 80 22.279 9.679 -5.063 1.00 0.00 O ATOM 1213 CB ALA A 80 19.835 7.358 -5.085 1.00 0.00 C ATOM 0 H ALA A 80 20.187 8.209 -2.828 1.00 0.00 H new ATOM 0 HA ALA A 80 21.766 6.625 -4.494 1.00 0.00 H new ATOM 0 HB1 ALA A 80 19.909 6.975 -6.103 1.00 0.00 H new ATOM 0 HB2 ALA A 80 19.301 6.638 -4.465 1.00 0.00 H new ATOM 0 HB3 ALA A 80 19.293 8.304 -5.092 1.00 0.00 H new ATOM 1219 N GLU A 81 22.459 8.026 -6.580 1.00 0.00 N ATOM 1220 CA GLU A 81 23.334 8.764 -7.481 1.00 0.00 C ATOM 1221 C GLU A 81 22.688 10.028 -8.053 1.00 0.00 C ATOM 1222 O GLU A 81 23.381 10.840 -8.665 1.00 0.00 O ATOM 1223 CB GLU A 81 23.789 7.846 -8.620 1.00 0.00 C ATOM 1224 CG GLU A 81 24.574 6.653 -8.076 1.00 0.00 C ATOM 1225 CD GLU A 81 25.078 5.763 -9.211 1.00 0.00 C ATOM 1226 OE1 GLU A 81 24.321 4.851 -9.613 1.00 0.00 O ATOM 1227 OE2 GLU A 81 26.218 6.003 -9.670 1.00 0.00 O ATOM 0 H GLU A 81 22.198 7.101 -6.922 1.00 0.00 H new ATOM 0 HA GLU A 81 24.190 9.094 -6.893 1.00 0.00 H new ATOM 0 HB2 GLU A 81 22.921 7.492 -9.177 1.00 0.00 H new ATOM 0 HB3 GLU A 81 24.409 8.407 -9.319 1.00 0.00 H new ATOM 0 HG2 GLU A 81 25.419 7.008 -7.486 1.00 0.00 H new ATOM 0 HG3 GLU A 81 23.940 6.071 -7.407 1.00 0.00 H new ATOM 1234 N GLY A 82 21.378 10.211 -7.866 1.00 0.00 N ATOM 1235 CA GLY A 82 20.692 11.398 -8.361 1.00 0.00 C ATOM 1236 C GLY A 82 19.190 11.195 -8.556 1.00 0.00 C ATOM 1237 O GLY A 82 18.578 11.937 -9.321 1.00 0.00 O ATOM 0 H GLY A 82 20.775 9.550 -7.375 1.00 0.00 H new ATOM 0 HA2 GLY A 82 20.852 12.219 -7.662 1.00 0.00 H new ATOM 0 HA3 GLY A 82 21.137 11.696 -9.310 1.00 0.00 H new ATOM 1241 N THR A 83 18.588 10.207 -7.883 1.00 0.00 N ATOM 1242 CA THR A 83 17.177 9.890 -8.092 1.00 0.00 C ATOM 1243 C THR A 83 16.428 9.613 -6.787 1.00 0.00 C ATOM 1244 O THR A 83 15.268 9.214 -6.818 1.00 0.00 O ATOM 1245 CB THR A 83 17.067 8.736 -9.089 1.00 0.00 C ATOM 1246 OG1 THR A 83 15.748 8.630 -9.571 1.00 0.00 O ATOM 1247 CG2 THR A 83 17.496 7.400 -8.481 1.00 0.00 C ATOM 0 H THR A 83 19.056 9.618 -7.194 1.00 0.00 H new ATOM 0 HA THR A 83 16.684 10.767 -8.512 1.00 0.00 H new ATOM 0 HB THR A 83 17.746 8.962 -9.911 1.00 0.00 H new ATOM 0 HG1 THR A 83 15.122 8.639 -8.817 1.00 0.00 H new ATOM 0 HG21 THR A 83 17.400 6.612 -9.228 1.00 0.00 H new ATOM 0 HG22 THR A 83 18.534 7.465 -8.154 1.00 0.00 H new ATOM 0 HG23 THR A 83 16.861 7.169 -7.626 1.00 0.00 H new ATOM 1255 N GLU A 84 17.084 9.823 -5.639 1.00 0.00 N ATOM 1256 CA GLU A 84 16.438 9.727 -4.331 1.00 0.00 C ATOM 1257 C GLU A 84 16.998 10.793 -3.391 1.00 0.00 C ATOM 1258 O GLU A 84 16.264 11.348 -2.573 1.00 0.00 O ATOM 1259 CB GLU A 84 16.666 8.347 -3.706 1.00 0.00 C ATOM 1260 CG GLU A 84 16.024 7.197 -4.483 1.00 0.00 C ATOM 1261 CD GLU A 84 14.496 7.263 -4.485 1.00 0.00 C ATOM 1262 OE1 GLU A 84 13.939 8.059 -3.691 1.00 0.00 O ATOM 1263 OE2 GLU A 84 13.895 6.512 -5.285 1.00 0.00 O ATOM 0 H GLU A 84 18.074 10.063 -5.594 1.00 0.00 H new ATOM 0 HA GLU A 84 15.368 9.880 -4.475 1.00 0.00 H new ATOM 0 HB2 GLU A 84 17.738 8.167 -3.631 1.00 0.00 H new ATOM 0 HB3 GLU A 84 16.271 8.350 -2.690 1.00 0.00 H new ATOM 0 HG2 GLU A 84 16.385 7.213 -5.511 1.00 0.00 H new ATOM 0 HG3 GLU A 84 16.342 6.249 -4.049 1.00 0.00 H new ATOM 1270 N ALA A 85 18.298 11.093 -3.499 1.00 0.00 N ATOM 1271 CA ALA A 85 18.899 12.149 -2.705 1.00 0.00 C ATOM 1272 C ALA A 85 18.324 13.503 -3.124 1.00 0.00 C ATOM 1273 O ALA A 85 18.280 14.430 -2.321 1.00 0.00 O ATOM 1274 CB ALA A 85 20.416 12.127 -2.894 1.00 0.00 C ATOM 0 H ALA A 85 18.944 10.616 -4.128 1.00 0.00 H new ATOM 0 HA ALA A 85 18.673 11.989 -1.651 1.00 0.00 H new ATOM 0 HB1 ALA A 85 20.868 12.920 -2.298 1.00 0.00 H new ATOM 0 HB2 ALA A 85 20.809 11.162 -2.573 1.00 0.00 H new ATOM 0 HB3 ALA A 85 20.654 12.283 -3.946 1.00 0.00 H new ATOM 1280 N VAL A 86 17.879 13.613 -4.379 1.00 0.00 N ATOM 1281 CA VAL A 86 17.278 14.837 -4.893 1.00 0.00 C ATOM 1282 C VAL A 86 15.948 15.114 -4.191 1.00 0.00 C ATOM 1283 O VAL A 86 15.530 16.263 -4.075 1.00 0.00 O ATOM 1284 CB VAL A 86 17.095 14.702 -6.410 1.00 0.00 C ATOM 1285 CG1 VAL A 86 16.083 13.612 -6.774 1.00 0.00 C ATOM 1286 CG2 VAL A 86 16.637 16.026 -7.023 1.00 0.00 C ATOM 0 H VAL A 86 17.927 12.856 -5.061 1.00 0.00 H new ATOM 0 HA VAL A 86 17.933 15.685 -4.692 1.00 0.00 H new ATOM 0 HB VAL A 86 18.067 14.422 -6.815 1.00 0.00 H new ATOM 0 HG11 VAL A 86 15.986 13.553 -7.858 1.00 0.00 H new ATOM 0 HG12 VAL A 86 16.427 12.653 -6.387 1.00 0.00 H new ATOM 0 HG13 VAL A 86 15.115 13.854 -6.336 1.00 0.00 H new ATOM 0 HG21 VAL A 86 16.514 15.905 -8.099 1.00 0.00 H new ATOM 0 HG22 VAL A 86 15.686 16.322 -6.580 1.00 0.00 H new ATOM 0 HG23 VAL A 86 17.384 16.795 -6.827 1.00 0.00 H new ATOM 1296 N ALA A 87 15.282 14.053 -3.723 1.00 0.00 N ATOM 1297 CA ALA A 87 13.981 14.152 -3.082 1.00 0.00 C ATOM 1298 C ALA A 87 14.100 14.456 -1.585 1.00 0.00 C ATOM 1299 O ALA A 87 13.079 14.577 -0.909 1.00 0.00 O ATOM 1300 CB ALA A 87 13.217 12.847 -3.311 1.00 0.00 C ATOM 0 H ALA A 87 15.639 13.099 -3.782 1.00 0.00 H new ATOM 0 HA ALA A 87 13.436 14.985 -3.527 1.00 0.00 H new ATOM 0 HB1 ALA A 87 12.239 12.910 -2.834 1.00 0.00 H new ATOM 0 HB2 ALA A 87 13.089 12.683 -4.381 1.00 0.00 H new ATOM 0 HB3 ALA A 87 13.778 12.017 -2.881 1.00 0.00 H new ATOM 1306 N ARG A 88 15.324 14.580 -1.062 1.00 0.00 N ATOM 1307 CA ARG A 88 15.533 14.934 0.336 1.00 0.00 C ATOM 1308 C ARG A 88 16.527 16.079 0.495 1.00 0.00 C ATOM 1309 O ARG A 88 16.559 16.721 1.542 1.00 0.00 O ATOM 1310 CB ARG A 88 15.920 13.684 1.141 1.00 0.00 C ATOM 1311 CG ARG A 88 17.265 13.058 0.758 1.00 0.00 C ATOM 1312 CD ARG A 88 18.460 13.814 1.348 1.00 0.00 C ATOM 1313 NE ARG A 88 19.706 13.071 1.125 1.00 0.00 N ATOM 1314 CZ ARG A 88 20.930 13.567 1.314 1.00 0.00 C ATOM 1315 NH1 ARG A 88 21.106 14.818 1.736 1.00 0.00 N ATOM 1316 NH2 ARG A 88 21.990 12.801 1.077 1.00 0.00 N ATOM 0 H ARG A 88 16.184 14.439 -1.592 1.00 0.00 H new ATOM 0 HA ARG A 88 14.595 15.311 0.744 1.00 0.00 H new ATOM 0 HB2 ARG A 88 15.946 13.945 2.199 1.00 0.00 H new ATOM 0 HB3 ARG A 88 15.139 12.934 1.017 1.00 0.00 H new ATOM 0 HG2 ARG A 88 17.290 12.024 1.101 1.00 0.00 H new ATOM 0 HG3 ARG A 88 17.355 13.036 -0.328 1.00 0.00 H new ATOM 0 HD2 ARG A 88 18.533 14.801 0.892 1.00 0.00 H new ATOM 0 HD3 ARG A 88 18.308 13.967 2.417 1.00 0.00 H new ATOM 0 HE ARG A 88 19.631 12.106 0.802 1.00 0.00 H new ATOM 0 HH11 ARG A 88 20.298 15.413 1.920 1.00 0.00 H new ATOM 0 HH12 ARG A 88 22.049 15.181 1.875 1.00 0.00 H new ATOM 0 HH21 ARG A 88 21.864 11.842 0.753 1.00 0.00 H new ATOM 0 HH22 ARG A 88 22.929 13.172 1.219 1.00 0.00 H new ATOM 1330 N ALA A 89 17.341 16.352 -0.530 1.00 0.00 N ATOM 1331 CA ALA A 89 18.254 17.487 -0.531 1.00 0.00 C ATOM 1332 C ALA A 89 17.497 18.784 -0.815 1.00 0.00 C ATOM 1333 O ALA A 89 18.091 19.861 -0.828 1.00 0.00 O ATOM 1334 CB ALA A 89 19.338 17.255 -1.583 1.00 0.00 C ATOM 0 H ALA A 89 17.381 15.789 -1.380 1.00 0.00 H new ATOM 0 HA ALA A 89 18.718 17.580 0.451 1.00 0.00 H new ATOM 0 HB1 ALA A 89 20.025 18.101 -1.590 1.00 0.00 H new ATOM 0 HB2 ALA A 89 19.886 16.343 -1.345 1.00 0.00 H new ATOM 0 HB3 ALA A 89 18.876 17.155 -2.565 1.00 0.00 H new ATOM 1340 N ARG A 90 16.183 18.681 -1.047 1.00 0.00 N ATOM 1341 CA ARG A 90 15.344 19.824 -1.376 1.00 0.00 C ATOM 1342 C ARG A 90 14.085 19.887 -0.513 1.00 0.00 C ATOM 1343 O ARG A 90 13.410 20.914 -0.498 1.00 0.00 O ATOM 1344 CB ARG A 90 14.956 19.720 -2.854 1.00 0.00 C ATOM 1345 CG ARG A 90 16.180 19.780 -3.769 1.00 0.00 C ATOM 1346 CD ARG A 90 15.729 19.607 -5.218 1.00 0.00 C ATOM 1347 NE ARG A 90 16.870 19.666 -6.138 1.00 0.00 N ATOM 1348 CZ ARG A 90 16.762 19.570 -7.465 1.00 0.00 C ATOM 1349 NH1 ARG A 90 15.573 19.415 -8.044 1.00 0.00 N ATOM 1350 NH2 ARG A 90 17.852 19.630 -8.228 1.00 0.00 N ATOM 0 H ARG A 90 15.676 17.796 -1.010 1.00 0.00 H new ATOM 0 HA ARG A 90 15.907 20.737 -1.180 1.00 0.00 H new ATOM 0 HB2 ARG A 90 14.421 18.786 -3.024 1.00 0.00 H new ATOM 0 HB3 ARG A 90 14.272 20.530 -3.108 1.00 0.00 H new ATOM 0 HG2 ARG A 90 16.695 20.733 -3.647 1.00 0.00 H new ATOM 0 HG3 ARG A 90 16.890 18.998 -3.500 1.00 0.00 H new ATOM 0 HD2 ARG A 90 15.216 18.652 -5.331 1.00 0.00 H new ATOM 0 HD3 ARG A 90 15.011 20.386 -5.474 1.00 0.00 H new ATOM 0 HE ARG A 90 17.801 19.788 -5.740 1.00 0.00 H new ATOM 0 HH11 ARG A 90 14.730 19.368 -7.472 1.00 0.00 H new ATOM 0 HH12 ARG A 90 15.506 19.343 -9.059 1.00 0.00 H new ATOM 0 HH21 ARG A 90 18.769 19.749 -7.798 1.00 0.00 H new ATOM 0 HH22 ARG A 90 17.769 19.557 -9.242 1.00 0.00 H new ATOM 1364 N LEU A 91 13.761 18.803 0.203 1.00 0.00 N ATOM 1365 CA LEU A 91 12.506 18.668 0.937 1.00 0.00 C ATOM 1366 C LEU A 91 12.744 18.233 2.386 1.00 0.00 C ATOM 1367 O LEU A 91 11.813 17.799 3.061 1.00 0.00 O ATOM 1368 CB LEU A 91 11.598 17.651 0.231 1.00 0.00 C ATOM 1369 CG LEU A 91 10.879 18.150 -1.030 1.00 0.00 C ATOM 1370 CD1 LEU A 91 11.800 18.552 -2.180 1.00 0.00 C ATOM 1371 CD2 LEU A 91 10.028 17.001 -1.549 1.00 0.00 C ATOM 0 H LEU A 91 14.371 17.990 0.287 1.00 0.00 H new ATOM 0 HA LEU A 91 12.022 19.644 0.956 1.00 0.00 H new ATOM 0 HB2 LEU A 91 12.199 16.783 -0.038 1.00 0.00 H new ATOM 0 HB3 LEU A 91 10.846 17.310 0.943 1.00 0.00 H new ATOM 0 HG LEU A 91 10.322 19.039 -0.733 1.00 0.00 H new ATOM 0 HD11 LEU A 91 11.200 18.890 -3.025 1.00 0.00 H new ATOM 0 HD12 LEU A 91 12.457 19.359 -1.855 1.00 0.00 H new ATOM 0 HD13 LEU A 91 12.401 17.694 -2.482 1.00 0.00 H new ATOM 0 HD21 LEU A 91 9.499 17.317 -2.448 1.00 0.00 H new ATOM 0 HD22 LEU A 91 10.669 16.151 -1.785 1.00 0.00 H new ATOM 0 HD23 LEU A 91 9.306 16.710 -0.786 1.00 0.00 H new ATOM 1383 N ALA A 92 13.984 18.343 2.879 1.00 0.00 N ATOM 1384 CA ALA A 92 14.348 18.012 4.259 1.00 0.00 C ATOM 1385 C ALA A 92 13.605 18.847 5.314 1.00 0.00 C ATOM 1386 O ALA A 92 13.953 18.786 6.494 1.00 0.00 O ATOM 1387 CB ALA A 92 15.855 18.190 4.444 1.00 0.00 C ATOM 0 H ALA A 92 14.773 18.669 2.321 1.00 0.00 H new ATOM 0 HA ALA A 92 14.051 16.975 4.416 1.00 0.00 H new ATOM 0 HB1 ALA A 92 16.127 17.944 5.470 1.00 0.00 H new ATOM 0 HB2 ALA A 92 16.386 17.529 3.759 1.00 0.00 H new ATOM 0 HB3 ALA A 92 16.128 19.224 4.234 1.00 0.00 H new ATOM 1393 N ARG A 93 12.594 19.623 4.910 1.00 0.00 N ATOM 1394 CA ARG A 93 11.859 20.516 5.798 1.00 0.00 C ATOM 1395 C ARG A 93 10.360 20.221 5.749 1.00 0.00 C ATOM 1396 O ARG A 93 9.554 21.033 6.202 1.00 0.00 O ATOM 1397 CB ARG A 93 12.177 21.965 5.438 1.00 0.00 C ATOM 1398 CG ARG A 93 13.680 22.199 5.585 1.00 0.00 C ATOM 1399 CD ARG A 93 13.964 23.686 5.435 1.00 0.00 C ATOM 1400 NE ARG A 93 15.403 23.948 5.497 1.00 0.00 N ATOM 1401 CZ ARG A 93 16.152 24.325 4.459 1.00 0.00 C ATOM 1402 NH1 ARG A 93 15.626 24.516 3.252 1.00 0.00 N ATOM 1403 NH2 ARG A 93 17.454 24.513 4.637 1.00 0.00 N ATOM 0 H ARG A 93 12.263 19.646 3.945 1.00 0.00 H new ATOM 0 HA ARG A 93 12.174 20.347 6.828 1.00 0.00 H new ATOM 0 HB2 ARG A 93 11.862 22.176 4.416 1.00 0.00 H new ATOM 0 HB3 ARG A 93 11.625 22.644 6.089 1.00 0.00 H new ATOM 0 HG2 ARG A 93 14.023 21.846 6.557 1.00 0.00 H new ATOM 0 HG3 ARG A 93 14.225 21.633 4.830 1.00 0.00 H new ATOM 0 HD2 ARG A 93 13.565 24.043 4.486 1.00 0.00 H new ATOM 0 HD3 ARG A 93 13.454 24.240 6.224 1.00 0.00 H new ATOM 0 HE ARG A 93 15.866 23.834 6.398 1.00 0.00 H new ATOM 0 HH11 ARG A 93 14.627 24.374 3.103 1.00 0.00 H new ATOM 0 HH12 ARG A 93 16.222 24.804 2.476 1.00 0.00 H new ATOM 0 HH21 ARG A 93 17.869 24.369 5.558 1.00 0.00 H new ATOM 0 HH22 ARG A 93 18.040 24.801 3.853 1.00 0.00 H new ATOM 1417 N MET A 94 9.987 19.057 5.201 1.00 0.00 N ATOM 1418 CA MET A 94 8.609 18.618 5.087 1.00 0.00 C ATOM 1419 C MET A 94 8.401 17.368 5.939 1.00 0.00 C ATOM 1420 O MET A 94 9.282 16.512 6.019 1.00 0.00 O ATOM 1421 CB MET A 94 8.328 18.318 3.614 1.00 0.00 C ATOM 1422 CG MET A 94 6.855 17.987 3.399 1.00 0.00 C ATOM 1423 SD MET A 94 6.427 17.435 1.724 1.00 0.00 S ATOM 1424 CE MET A 94 7.093 18.802 0.740 1.00 0.00 C ATOM 0 H MET A 94 10.656 18.388 4.820 1.00 0.00 H new ATOM 0 HA MET A 94 7.926 19.390 5.441 1.00 0.00 H new ATOM 0 HB2 MET A 94 8.605 19.178 3.004 1.00 0.00 H new ATOM 0 HB3 MET A 94 8.945 17.482 3.285 1.00 0.00 H new ATOM 0 HG2 MET A 94 6.566 17.209 4.106 1.00 0.00 H new ATOM 0 HG3 MET A 94 6.262 18.870 3.637 1.00 0.00 H new ATOM 0 HE1 MET A 94 6.558 18.863 -0.208 1.00 0.00 H new ATOM 0 HE2 MET A 94 6.970 19.737 1.286 1.00 0.00 H new ATOM 0 HE3 MET A 94 8.152 18.630 0.548 1.00 0.00 H new ATOM 1434 N THR A 95 7.235 17.260 6.579 1.00 0.00 N ATOM 1435 CA THR A 95 6.917 16.111 7.419 1.00 0.00 C ATOM 1436 C THR A 95 6.761 14.853 6.561 1.00 0.00 C ATOM 1437 O THR A 95 6.196 14.927 5.469 1.00 0.00 O ATOM 1438 CB THR A 95 5.656 16.393 8.242 1.00 0.00 C ATOM 1439 OG1 THR A 95 5.330 15.244 8.992 1.00 0.00 O ATOM 1440 CG2 THR A 95 4.456 16.758 7.372 1.00 0.00 C ATOM 0 H THR A 95 6.494 17.960 6.529 1.00 0.00 H new ATOM 0 HA THR A 95 7.738 15.937 8.115 1.00 0.00 H new ATOM 0 HB THR A 95 5.874 17.244 8.887 1.00 0.00 H new ATOM 0 HG1 THR A 95 4.525 15.417 9.523 1.00 0.00 H new ATOM 0 HG21 THR A 95 3.590 16.947 8.007 1.00 0.00 H new ATOM 0 HG22 THR A 95 4.685 17.653 6.794 1.00 0.00 H new ATOM 0 HG23 THR A 95 4.235 15.934 6.693 1.00 0.00 H new ATOM 1448 N PRO A 96 7.252 13.696 7.029 1.00 0.00 N ATOM 1449 CA PRO A 96 7.171 12.430 6.315 1.00 0.00 C ATOM 1450 C PRO A 96 5.760 12.044 5.871 1.00 0.00 C ATOM 1451 O PRO A 96 5.617 11.258 4.936 1.00 0.00 O ATOM 1452 CB PRO A 96 7.721 11.380 7.282 1.00 0.00 C ATOM 1453 CG PRO A 96 8.653 12.175 8.188 1.00 0.00 C ATOM 1454 CD PRO A 96 7.951 13.525 8.292 1.00 0.00 C ATOM 0 HA PRO A 96 7.737 12.507 5.387 1.00 0.00 H new ATOM 0 HB2 PRO A 96 6.923 10.902 7.850 1.00 0.00 H new ATOM 0 HB3 PRO A 96 8.254 10.590 6.754 1.00 0.00 H new ATOM 0 HG2 PRO A 96 8.769 11.703 9.164 1.00 0.00 H new ATOM 0 HG3 PRO A 96 9.651 12.270 7.759 1.00 0.00 H new ATOM 0 HD2 PRO A 96 7.256 13.542 9.131 1.00 0.00 H new ATOM 0 HD3 PRO A 96 8.668 14.329 8.456 1.00 0.00 H new ATOM 1462 N LEU A 97 4.720 12.577 6.521 1.00 0.00 N ATOM 1463 CA LEU A 97 3.349 12.220 6.185 1.00 0.00 C ATOM 1464 C LEU A 97 2.900 12.982 4.937 1.00 0.00 C ATOM 1465 O LEU A 97 2.324 12.395 4.025 1.00 0.00 O ATOM 1466 CB LEU A 97 2.465 12.537 7.399 1.00 0.00 C ATOM 1467 CG LEU A 97 1.072 11.884 7.413 1.00 0.00 C ATOM 1468 CD1 LEU A 97 0.137 12.459 6.353 1.00 0.00 C ATOM 1469 CD2 LEU A 97 1.155 10.370 7.229 1.00 0.00 C ATOM 0 H LEU A 97 4.807 13.254 7.279 1.00 0.00 H new ATOM 0 HA LEU A 97 3.268 11.158 5.955 1.00 0.00 H new ATOM 0 HB2 LEU A 97 2.997 12.230 8.300 1.00 0.00 H new ATOM 0 HB3 LEU A 97 2.337 13.618 7.457 1.00 0.00 H new ATOM 0 HG LEU A 97 0.658 12.110 8.396 1.00 0.00 H new ATOM 0 HD11 LEU A 97 -0.830 11.960 6.411 1.00 0.00 H new ATOM 0 HD12 LEU A 97 0.005 13.527 6.525 1.00 0.00 H new ATOM 0 HD13 LEU A 97 0.568 12.302 5.364 1.00 0.00 H new ATOM 0 HD21 LEU A 97 0.151 9.946 7.245 1.00 0.00 H new ATOM 0 HD22 LEU A 97 1.629 10.145 6.274 1.00 0.00 H new ATOM 0 HD23 LEU A 97 1.744 9.937 8.037 1.00 0.00 H new ATOM 1481 N SER A 98 3.166 14.291 4.886 1.00 0.00 N ATOM 1482 CA SER A 98 2.784 15.110 3.744 1.00 0.00 C ATOM 1483 C SER A 98 3.583 14.731 2.503 1.00 0.00 C ATOM 1484 O SER A 98 3.136 14.975 1.385 1.00 0.00 O ATOM 1485 CB SER A 98 3.000 16.588 4.066 1.00 0.00 C ATOM 1486 OG SER A 98 2.205 16.949 5.175 1.00 0.00 O ATOM 0 H SER A 98 3.646 14.802 5.627 1.00 0.00 H new ATOM 0 HA SER A 98 1.728 14.932 3.539 1.00 0.00 H new ATOM 0 HB2 SER A 98 4.052 16.774 4.283 1.00 0.00 H new ATOM 0 HB3 SER A 98 2.739 17.201 3.203 1.00 0.00 H new ATOM 0 HG SER A 98 2.345 17.896 5.383 1.00 0.00 H new ATOM 1492 N ARG A 99 4.766 14.134 2.685 1.00 0.00 N ATOM 1493 CA ARG A 99 5.575 13.674 1.566 1.00 0.00 C ATOM 1494 C ARG A 99 4.881 12.506 0.868 1.00 0.00 C ATOM 1495 O ARG A 99 4.994 12.352 -0.347 1.00 0.00 O ATOM 1496 CB ARG A 99 6.959 13.272 2.084 1.00 0.00 C ATOM 1497 CG ARG A 99 7.875 12.860 0.928 1.00 0.00 C ATOM 1498 CD ARG A 99 9.290 12.586 1.434 1.00 0.00 C ATOM 1499 NE ARG A 99 9.313 11.497 2.422 1.00 0.00 N ATOM 1500 CZ ARG A 99 10.210 10.503 2.443 1.00 0.00 C ATOM 1501 NH1 ARG A 99 11.169 10.422 1.528 1.00 0.00 N ATOM 1502 NH2 ARG A 99 10.149 9.573 3.393 1.00 0.00 N ATOM 0 H ARG A 99 5.180 13.961 3.601 1.00 0.00 H new ATOM 0 HA ARG A 99 5.695 14.474 0.835 1.00 0.00 H new ATOM 0 HB2 ARG A 99 7.405 14.105 2.628 1.00 0.00 H new ATOM 0 HB3 ARG A 99 6.862 12.446 2.789 1.00 0.00 H new ATOM 0 HG2 ARG A 99 7.478 11.969 0.442 1.00 0.00 H new ATOM 0 HG3 ARG A 99 7.898 13.649 0.176 1.00 0.00 H new ATOM 0 HD2 ARG A 99 9.934 12.328 0.593 1.00 0.00 H new ATOM 0 HD3 ARG A 99 9.698 13.492 1.882 1.00 0.00 H new ATOM 0 HE ARG A 99 8.593 11.499 3.144 1.00 0.00 H new ATOM 0 HH11 ARG A 99 11.232 11.125 0.792 1.00 0.00 H new ATOM 0 HH12 ARG A 99 11.843 9.657 1.562 1.00 0.00 H new ATOM 0 HH21 ARG A 99 9.419 9.618 4.104 1.00 0.00 H new ATOM 0 HH22 ARG A 99 10.832 8.815 3.410 1.00 0.00 H new ATOM 1516 N GLN A 100 4.160 11.678 1.633 1.00 0.00 N ATOM 1517 CA GLN A 100 3.417 10.564 1.068 1.00 0.00 C ATOM 1518 C GLN A 100 2.163 11.088 0.377 1.00 0.00 C ATOM 1519 O GLN A 100 1.777 10.574 -0.671 1.00 0.00 O ATOM 1520 CB GLN A 100 3.022 9.591 2.180 1.00 0.00 C ATOM 1521 CG GLN A 100 4.257 8.972 2.830 1.00 0.00 C ATOM 1522 CD GLN A 100 3.889 8.187 4.082 1.00 0.00 C ATOM 1523 OE1 GLN A 100 3.046 7.294 4.043 1.00 0.00 O ATOM 1524 NE2 GLN A 100 4.516 8.512 5.207 1.00 0.00 N ATOM 0 H GLN A 100 4.080 11.765 2.646 1.00 0.00 H new ATOM 0 HA GLN A 100 4.042 10.044 0.341 1.00 0.00 H new ATOM 0 HB2 GLN A 100 2.434 10.114 2.934 1.00 0.00 H new ATOM 0 HB3 GLN A 100 2.389 8.804 1.771 1.00 0.00 H new ATOM 0 HG2 GLN A 100 4.754 8.313 2.118 1.00 0.00 H new ATOM 0 HG3 GLN A 100 4.968 9.758 3.087 1.00 0.00 H new ATOM 0 HE21 GLN A 100 5.211 9.259 5.206 1.00 0.00 H new ATOM 0 HE22 GLN A 100 4.302 8.015 6.072 1.00 0.00 H new ATOM 1533 N ALA A 101 1.526 12.112 0.954 1.00 0.00 N ATOM 1534 CA ALA A 101 0.341 12.702 0.354 1.00 0.00 C ATOM 1535 C ALA A 101 0.695 13.352 -0.983 1.00 0.00 C ATOM 1536 O ALA A 101 -0.119 13.345 -1.906 1.00 0.00 O ATOM 1537 CB ALA A 101 -0.253 13.729 1.316 1.00 0.00 C ATOM 0 H ALA A 101 1.815 12.543 1.832 1.00 0.00 H new ATOM 0 HA ALA A 101 -0.399 11.924 0.165 1.00 0.00 H new ATOM 0 HB1 ALA A 101 -1.142 14.174 0.870 1.00 0.00 H new ATOM 0 HB2 ALA A 101 -0.523 13.238 2.251 1.00 0.00 H new ATOM 0 HB3 ALA A 101 0.482 14.509 1.515 1.00 0.00 H new ATOM 1543 N LEU A 102 1.906 13.912 -1.094 1.00 0.00 N ATOM 1544 CA LEU A 102 2.351 14.529 -2.332 1.00 0.00 C ATOM 1545 C LEU A 102 2.394 13.488 -3.443 1.00 0.00 C ATOM 1546 O LEU A 102 1.837 13.708 -4.516 1.00 0.00 O ATOM 1547 CB LEU A 102 3.741 15.138 -2.127 1.00 0.00 C ATOM 1548 CG LEU A 102 4.249 15.883 -3.368 1.00 0.00 C ATOM 1549 CD1 LEU A 102 3.318 17.030 -3.764 1.00 0.00 C ATOM 1550 CD2 LEU A 102 5.628 16.464 -3.060 1.00 0.00 C ATOM 0 H LEU A 102 2.589 13.946 -0.337 1.00 0.00 H new ATOM 0 HA LEU A 102 1.653 15.316 -2.616 1.00 0.00 H new ATOM 0 HB2 LEU A 102 3.711 15.826 -1.282 1.00 0.00 H new ATOM 0 HB3 LEU A 102 4.445 14.347 -1.869 1.00 0.00 H new ATOM 0 HG LEU A 102 4.290 15.174 -4.195 1.00 0.00 H new ATOM 0 HD11 LEU A 102 3.714 17.532 -4.647 1.00 0.00 H new ATOM 0 HD12 LEU A 102 2.327 16.634 -3.985 1.00 0.00 H new ATOM 0 HD13 LEU A 102 3.249 17.743 -2.942 1.00 0.00 H new ATOM 0 HD21 LEU A 102 6.002 16.997 -3.934 1.00 0.00 H new ATOM 0 HD22 LEU A 102 5.553 17.154 -2.219 1.00 0.00 H new ATOM 0 HD23 LEU A 102 6.315 15.656 -2.806 1.00 0.00 H new ATOM 1562 N LEU A 103 3.049 12.352 -3.192 1.00 0.00 N ATOM 1563 CA LEU A 103 3.159 11.320 -4.211 1.00 0.00 C ATOM 1564 C LEU A 103 1.889 10.474 -4.327 1.00 0.00 C ATOM 1565 O LEU A 103 1.832 9.548 -5.134 1.00 0.00 O ATOM 1566 CB LEU A 103 4.435 10.491 -4.045 1.00 0.00 C ATOM 1567 CG LEU A 103 4.559 9.747 -2.709 1.00 0.00 C ATOM 1568 CD1 LEU A 103 3.610 8.556 -2.609 1.00 0.00 C ATOM 1569 CD2 LEU A 103 5.988 9.227 -2.570 1.00 0.00 C ATOM 0 H LEU A 103 3.502 12.131 -2.306 1.00 0.00 H new ATOM 0 HA LEU A 103 3.253 11.825 -5.173 1.00 0.00 H new ATOM 0 HB2 LEU A 103 4.484 9.763 -4.855 1.00 0.00 H new ATOM 0 HB3 LEU A 103 5.295 11.151 -4.157 1.00 0.00 H new ATOM 0 HG LEU A 103 4.301 10.451 -1.918 1.00 0.00 H new ATOM 0 HD11 LEU A 103 3.740 8.067 -1.644 1.00 0.00 H new ATOM 0 HD12 LEU A 103 2.581 8.902 -2.704 1.00 0.00 H new ATOM 0 HD13 LEU A 103 3.830 7.847 -3.407 1.00 0.00 H new ATOM 0 HD21 LEU A 103 6.091 8.695 -1.624 1.00 0.00 H new ATOM 0 HD22 LEU A 103 6.210 8.549 -3.394 1.00 0.00 H new ATOM 0 HD23 LEU A 103 6.684 10.065 -2.593 1.00 0.00 H new ATOM 1581 N LEU A 104 0.866 10.784 -3.524 1.00 0.00 N ATOM 1582 CA LEU A 104 -0.400 10.078 -3.593 1.00 0.00 C ATOM 1583 C LEU A 104 -1.420 10.842 -4.442 1.00 0.00 C ATOM 1584 O LEU A 104 -2.501 10.325 -4.706 1.00 0.00 O ATOM 1585 CB LEU A 104 -0.891 9.826 -2.166 1.00 0.00 C ATOM 1586 CG LEU A 104 -2.124 8.924 -2.073 1.00 0.00 C ATOM 1587 CD1 LEU A 104 -1.992 7.659 -2.923 1.00 0.00 C ATOM 1588 CD2 LEU A 104 -2.282 8.511 -0.612 1.00 0.00 C ATOM 0 H LEU A 104 0.898 11.522 -2.820 1.00 0.00 H new ATOM 0 HA LEU A 104 -0.266 9.118 -4.091 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -0.082 9.376 -1.590 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -1.120 10.784 -1.699 1.00 0.00 H new ATOM 0 HG LEU A 104 -2.985 9.479 -2.445 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -2.894 7.056 -2.820 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -1.858 7.936 -3.969 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -1.130 7.083 -2.587 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -3.154 7.865 -0.509 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -1.391 7.973 -0.288 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -2.413 9.400 0.005 1.00 0.00 H new ATOM 1600 N THR A 105 -1.093 12.064 -4.876 1.00 0.00 N ATOM 1601 CA THR A 105 -1.994 12.828 -5.740 1.00 0.00 C ATOM 1602 C THR A 105 -1.270 13.601 -6.842 1.00 0.00 C ATOM 1603 O THR A 105 -1.919 14.017 -7.803 1.00 0.00 O ATOM 1604 CB THR A 105 -2.819 13.814 -4.907 1.00 0.00 C ATOM 1605 OG1 THR A 105 -1.955 14.752 -4.303 1.00 0.00 O ATOM 1606 CG2 THR A 105 -3.628 13.112 -3.816 1.00 0.00 C ATOM 0 H THR A 105 -0.221 12.540 -4.645 1.00 0.00 H new ATOM 0 HA THR A 105 -2.639 12.094 -6.223 1.00 0.00 H new ATOM 0 HB THR A 105 -3.520 14.308 -5.581 1.00 0.00 H new ATOM 0 HG1 THR A 105 -1.419 14.307 -3.614 1.00 0.00 H new ATOM 0 HG21 THR A 105 -4.196 13.851 -3.252 1.00 0.00 H new ATOM 0 HG22 THR A 105 -4.314 12.399 -4.273 1.00 0.00 H new ATOM 0 HG23 THR A 105 -2.951 12.585 -3.144 1.00 0.00 H new ATOM 1614 N ALA A 106 0.047 13.809 -6.743 1.00 0.00 N ATOM 1615 CA ALA A 106 0.772 14.590 -7.737 1.00 0.00 C ATOM 1616 C ALA A 106 1.132 13.783 -8.987 1.00 0.00 C ATOM 1617 O ALA A 106 1.528 14.377 -9.989 1.00 0.00 O ATOM 1618 CB ALA A 106 2.037 15.169 -7.106 1.00 0.00 C ATOM 0 H ALA A 106 0.626 13.447 -5.986 1.00 0.00 H new ATOM 0 HA ALA A 106 0.109 15.391 -8.063 1.00 0.00 H new ATOM 0 HB1 ALA A 106 2.580 15.753 -7.849 1.00 0.00 H new ATOM 0 HB2 ALA A 106 1.765 15.811 -6.268 1.00 0.00 H new ATOM 0 HB3 ALA A 106 2.671 14.357 -6.750 1.00 0.00 H new ATOM 1624 N MET A 107 1.008 12.452 -8.957 1.00 0.00 N ATOM 1625 CA MET A 107 1.353 11.631 -10.113 1.00 0.00 C ATOM 1626 C MET A 107 0.602 10.296 -10.161 1.00 0.00 C ATOM 1627 O MET A 107 0.996 9.410 -10.917 1.00 0.00 O ATOM 1628 CB MET A 107 2.867 11.390 -10.165 1.00 0.00 C ATOM 1629 CG MET A 107 3.365 10.403 -9.107 1.00 0.00 C ATOM 1630 SD MET A 107 3.196 11.002 -7.415 1.00 0.00 S ATOM 1631 CE MET A 107 4.388 12.363 -7.443 1.00 0.00 C ATOM 0 H MET A 107 0.673 11.927 -8.149 1.00 0.00 H new ATOM 0 HA MET A 107 1.038 12.194 -10.992 1.00 0.00 H new ATOM 0 HB2 MET A 107 3.134 11.016 -11.153 1.00 0.00 H new ATOM 0 HB3 MET A 107 3.383 12.341 -10.034 1.00 0.00 H new ATOM 0 HG2 MET A 107 2.814 9.468 -9.208 1.00 0.00 H new ATOM 0 HG3 MET A 107 4.414 10.177 -9.299 1.00 0.00 H new ATOM 0 HE1 MET A 107 4.583 12.697 -6.424 1.00 0.00 H new ATOM 0 HE2 MET A 107 5.318 12.023 -7.898 1.00 0.00 H new ATOM 0 HE3 MET A 107 3.982 13.191 -8.024 1.00 0.00 H new ATOM 1641 N GLU A 108 -0.469 10.136 -9.373 1.00 0.00 N ATOM 1642 CA GLU A 108 -1.210 8.880 -9.342 1.00 0.00 C ATOM 1643 C GLU A 108 -2.716 9.096 -9.523 1.00 0.00 C ATOM 1644 O GLU A 108 -3.457 8.140 -9.745 1.00 0.00 O ATOM 1645 CB GLU A 108 -0.883 8.145 -8.038 1.00 0.00 C ATOM 1646 CG GLU A 108 -1.349 6.687 -8.056 1.00 0.00 C ATOM 1647 CD GLU A 108 -0.707 5.894 -9.192 1.00 0.00 C ATOM 1648 OE1 GLU A 108 0.537 5.950 -9.305 1.00 0.00 O ATOM 1649 OE2 GLU A 108 -1.463 5.233 -9.941 1.00 0.00 O ATOM 0 H GLU A 108 -0.836 10.859 -8.754 1.00 0.00 H new ATOM 0 HA GLU A 108 -0.900 8.262 -10.185 1.00 0.00 H new ATOM 0 HB2 GLU A 108 0.193 8.177 -7.866 1.00 0.00 H new ATOM 0 HB3 GLU A 108 -1.355 8.664 -7.204 1.00 0.00 H new ATOM 0 HG2 GLU A 108 -1.105 6.217 -7.103 1.00 0.00 H new ATOM 0 HG3 GLU A 108 -2.434 6.655 -8.159 1.00 0.00 H new ATOM 1656 N GLY A 109 -3.175 10.349 -9.434 1.00 0.00 N ATOM 1657 CA GLY A 109 -4.548 10.713 -9.756 1.00 0.00 C ATOM 1658 C GLY A 109 -5.599 10.174 -8.783 1.00 0.00 C ATOM 1659 O GLY A 109 -6.791 10.315 -9.057 1.00 0.00 O ATOM 0 H GLY A 109 -2.599 11.136 -9.136 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -4.624 11.800 -9.785 1.00 0.00 H new ATOM 0 HA3 GLY A 109 -4.780 10.350 -10.757 1.00 0.00 H new ATOM 1663 N PHE A 110 -5.202 9.564 -7.661 1.00 0.00 N ATOM 1664 CA PHE A 110 -6.168 9.099 -6.672 1.00 0.00 C ATOM 1665 C PHE A 110 -7.025 10.259 -6.170 1.00 0.00 C ATOM 1666 O PHE A 110 -6.577 11.405 -6.130 1.00 0.00 O ATOM 1667 CB PHE A 110 -5.455 8.452 -5.483 1.00 0.00 C ATOM 1668 CG PHE A 110 -5.163 6.979 -5.646 1.00 0.00 C ATOM 1669 CD1 PHE A 110 -6.222 6.057 -5.640 1.00 0.00 C ATOM 1670 CD2 PHE A 110 -3.846 6.527 -5.790 1.00 0.00 C ATOM 1671 CE1 PHE A 110 -5.961 4.686 -5.759 1.00 0.00 C ATOM 1672 CE2 PHE A 110 -3.583 5.154 -5.908 1.00 0.00 C ATOM 1673 CZ PHE A 110 -4.640 4.234 -5.889 1.00 0.00 C ATOM 0 H PHE A 110 -4.227 9.384 -7.420 1.00 0.00 H new ATOM 0 HA PHE A 110 -6.808 8.360 -7.154 1.00 0.00 H new ATOM 0 HB2 PHE A 110 -4.516 8.978 -5.310 1.00 0.00 H new ATOM 0 HB3 PHE A 110 -6.066 8.591 -4.591 1.00 0.00 H new ATOM 0 HD1 PHE A 110 -7.240 6.406 -5.543 1.00 0.00 H new ATOM 0 HD2 PHE A 110 -3.032 7.236 -5.810 1.00 0.00 H new ATOM 0 HE1 PHE A 110 -6.776 3.978 -5.751 1.00 0.00 H new ATOM 0 HE2 PHE A 110 -2.566 4.806 -6.013 1.00 0.00 H new ATOM 0 HZ PHE A 110 -4.437 3.177 -5.974 1.00 0.00 H new ATOM 1683 N SER A 111 -8.264 9.953 -5.783 1.00 0.00 N ATOM 1684 CA SER A 111 -9.160 10.929 -5.185 1.00 0.00 C ATOM 1685 C SER A 111 -8.679 11.251 -3.770 1.00 0.00 C ATOM 1686 O SER A 111 -7.911 10.478 -3.193 1.00 0.00 O ATOM 1687 CB SER A 111 -10.574 10.350 -5.151 1.00 0.00 C ATOM 1688 OG SER A 111 -10.621 9.253 -4.262 1.00 0.00 O ATOM 0 H SER A 111 -8.669 9.022 -5.877 1.00 0.00 H new ATOM 0 HA SER A 111 -9.166 11.848 -5.772 1.00 0.00 H new ATOM 0 HB2 SER A 111 -11.283 11.116 -4.836 1.00 0.00 H new ATOM 0 HB3 SER A 111 -10.871 10.033 -6.151 1.00 0.00 H new ATOM 0 HG SER A 111 -10.459 8.423 -4.758 1.00 0.00 H new ATOM 1694 N PRO A 112 -9.113 12.375 -3.189 1.00 0.00 N ATOM 1695 CA PRO A 112 -8.760 12.723 -1.825 1.00 0.00 C ATOM 1696 C PRO A 112 -9.400 11.757 -0.830 1.00 0.00 C ATOM 1697 O PRO A 112 -8.981 11.702 0.322 1.00 0.00 O ATOM 1698 CB PRO A 112 -9.252 14.157 -1.635 1.00 0.00 C ATOM 1699 CG PRO A 112 -10.416 14.268 -2.618 1.00 0.00 C ATOM 1700 CD PRO A 112 -9.970 13.384 -3.783 1.00 0.00 C ATOM 0 HA PRO A 112 -7.687 12.651 -1.646 1.00 0.00 H new ATOM 0 HB2 PRO A 112 -9.574 14.338 -0.610 1.00 0.00 H new ATOM 0 HB3 PRO A 112 -8.469 14.883 -1.856 1.00 0.00 H new ATOM 0 HG2 PRO A 112 -11.350 13.916 -2.179 1.00 0.00 H new ATOM 0 HG3 PRO A 112 -10.581 15.298 -2.933 1.00 0.00 H new ATOM 0 HD2 PRO A 112 -10.826 12.929 -4.282 1.00 0.00 H new ATOM 0 HD3 PRO A 112 -9.434 13.964 -4.534 1.00 0.00 H new ATOM 1708 N GLU A 113 -10.410 10.993 -1.261 1.00 0.00 N ATOM 1709 CA GLU A 113 -11.070 10.020 -0.402 1.00 0.00 C ATOM 1710 C GLU A 113 -10.233 8.747 -0.291 1.00 0.00 C ATOM 1711 O GLU A 113 -10.054 8.217 0.805 1.00 0.00 O ATOM 1712 CB GLU A 113 -12.446 9.675 -0.981 1.00 0.00 C ATOM 1713 CG GLU A 113 -13.348 10.907 -1.055 1.00 0.00 C ATOM 1714 CD GLU A 113 -14.716 10.549 -1.636 1.00 0.00 C ATOM 1715 OE1 GLU A 113 -15.592 10.136 -0.841 1.00 0.00 O ATOM 1716 OE2 GLU A 113 -14.878 10.690 -2.868 1.00 0.00 O ATOM 0 H GLU A 113 -10.786 11.035 -2.208 1.00 0.00 H new ATOM 0 HA GLU A 113 -11.184 10.453 0.592 1.00 0.00 H new ATOM 0 HB2 GLU A 113 -12.326 9.250 -1.978 1.00 0.00 H new ATOM 0 HB3 GLU A 113 -12.921 8.912 -0.364 1.00 0.00 H new ATOM 0 HG2 GLU A 113 -13.472 11.332 -0.059 1.00 0.00 H new ATOM 0 HG3 GLU A 113 -12.876 11.672 -1.672 1.00 0.00 H new ATOM 1723 N ASP A 114 -9.715 8.251 -1.419 1.00 0.00 N ATOM 1724 CA ASP A 114 -8.892 7.051 -1.418 1.00 0.00 C ATOM 1725 C ASP A 114 -7.513 7.371 -0.849 1.00 0.00 C ATOM 1726 O ASP A 114 -6.882 6.522 -0.216 1.00 0.00 O ATOM 1727 CB ASP A 114 -8.757 6.518 -2.846 1.00 0.00 C ATOM 1728 CG ASP A 114 -10.090 6.025 -3.407 1.00 0.00 C ATOM 1729 OD1 ASP A 114 -10.933 5.561 -2.606 1.00 0.00 O ATOM 1730 OD2 ASP A 114 -10.257 6.115 -4.644 1.00 0.00 O ATOM 0 H ASP A 114 -9.854 8.666 -2.340 1.00 0.00 H new ATOM 0 HA ASP A 114 -9.365 6.291 -0.796 1.00 0.00 H new ATOM 0 HB2 ASP A 114 -8.363 7.304 -3.490 1.00 0.00 H new ATOM 0 HB3 ASP A 114 -8.035 5.702 -2.861 1.00 0.00 H new ATOM 1735 N ALA A 115 -7.038 8.601 -1.068 1.00 0.00 N ATOM 1736 CA ALA A 115 -5.766 9.044 -0.536 1.00 0.00 C ATOM 1737 C ALA A 115 -5.832 9.199 0.984 1.00 0.00 C ATOM 1738 O ALA A 115 -4.800 9.154 1.652 1.00 0.00 O ATOM 1739 CB ALA A 115 -5.390 10.369 -1.194 1.00 0.00 C ATOM 0 H ALA A 115 -7.529 9.307 -1.617 1.00 0.00 H new ATOM 0 HA ALA A 115 -5.005 8.296 -0.756 1.00 0.00 H new ATOM 0 HB1 ALA A 115 -4.433 10.712 -0.800 1.00 0.00 H new ATOM 0 HB2 ALA A 115 -5.310 10.230 -2.272 1.00 0.00 H new ATOM 0 HB3 ALA A 115 -6.158 11.112 -0.980 1.00 0.00 H new ATOM 1745 N ALA A 116 -7.038 9.381 1.535 1.00 0.00 N ATOM 1746 CA ALA A 116 -7.216 9.521 2.971 1.00 0.00 C ATOM 1747 C ALA A 116 -7.222 8.155 3.649 1.00 0.00 C ATOM 1748 O ALA A 116 -6.822 8.030 4.804 1.00 0.00 O ATOM 1749 CB ALA A 116 -8.541 10.239 3.231 1.00 0.00 C ATOM 0 H ALA A 116 -7.904 9.434 0.999 1.00 0.00 H new ATOM 0 HA ALA A 116 -6.389 10.099 3.384 1.00 0.00 H new ATOM 0 HB1 ALA A 116 -8.689 10.352 4.305 1.00 0.00 H new ATOM 0 HB2 ALA A 116 -8.520 11.223 2.762 1.00 0.00 H new ATOM 0 HB3 ALA A 116 -9.360 9.655 2.811 1.00 0.00 H new ATOM 1755 N TYR A 117 -7.677 7.128 2.930 1.00 0.00 N ATOM 1756 CA TYR A 117 -7.723 5.771 3.444 1.00 0.00 C ATOM 1757 C TYR A 117 -6.316 5.200 3.635 1.00 0.00 C ATOM 1758 O TYR A 117 -6.063 4.498 4.612 1.00 0.00 O ATOM 1759 CB TYR A 117 -8.524 4.932 2.447 1.00 0.00 C ATOM 1760 CG TYR A 117 -8.461 3.436 2.645 1.00 0.00 C ATOM 1761 CD1 TYR A 117 -8.626 2.866 3.916 1.00 0.00 C ATOM 1762 CD2 TYR A 117 -8.246 2.617 1.530 1.00 0.00 C ATOM 1763 CE1 TYR A 117 -8.589 1.470 4.067 1.00 0.00 C ATOM 1764 CE2 TYR A 117 -8.212 1.223 1.668 1.00 0.00 C ATOM 1765 CZ TYR A 117 -8.391 0.645 2.942 1.00 0.00 C ATOM 1766 OH TYR A 117 -8.378 -0.710 3.083 1.00 0.00 O ATOM 0 H TYR A 117 -8.023 7.220 1.975 1.00 0.00 H new ATOM 0 HA TYR A 117 -8.199 5.756 4.425 1.00 0.00 H new ATOM 0 HB2 TYR A 117 -9.568 5.242 2.496 1.00 0.00 H new ATOM 0 HB3 TYR A 117 -8.171 5.161 1.442 1.00 0.00 H new ATOM 0 HD1 TYR A 117 -8.781 3.499 4.777 1.00 0.00 H new ATOM 0 HD2 TYR A 117 -8.105 3.063 0.556 1.00 0.00 H new ATOM 0 HE1 TYR A 117 -8.712 1.029 5.045 1.00 0.00 H new ATOM 0 HE2 TYR A 117 -8.050 0.595 0.804 1.00 0.00 H new ATOM 0 HH TYR A 117 -8.231 -1.128 2.209 1.00 0.00 H new ATOM 1776 N LEU A 118 -5.398 5.496 2.711 1.00 0.00 N ATOM 1777 CA LEU A 118 -4.031 4.984 2.781 1.00 0.00 C ATOM 1778 C LEU A 118 -3.178 5.646 3.870 1.00 0.00 C ATOM 1779 O LEU A 118 -2.033 5.237 4.067 1.00 0.00 O ATOM 1780 CB LEU A 118 -3.342 5.148 1.424 1.00 0.00 C ATOM 1781 CG LEU A 118 -3.986 4.292 0.329 1.00 0.00 C ATOM 1782 CD1 LEU A 118 -3.147 4.437 -0.939 1.00 0.00 C ATOM 1783 CD2 LEU A 118 -4.033 2.819 0.734 1.00 0.00 C ATOM 0 H LEU A 118 -5.580 6.091 1.903 1.00 0.00 H new ATOM 0 HA LEU A 118 -4.115 3.930 3.047 1.00 0.00 H new ATOM 0 HB2 LEU A 118 -3.376 6.196 1.128 1.00 0.00 H new ATOM 0 HB3 LEU A 118 -2.290 4.878 1.520 1.00 0.00 H new ATOM 0 HG LEU A 118 -5.009 4.630 0.166 1.00 0.00 H new ATOM 0 HD11 LEU A 118 -3.585 3.836 -1.736 1.00 0.00 H new ATOM 0 HD12 LEU A 118 -3.126 5.483 -1.244 1.00 0.00 H new ATOM 0 HD13 LEU A 118 -2.131 4.095 -0.744 1.00 0.00 H new ATOM 0 HD21 LEU A 118 -4.495 2.237 -0.063 1.00 0.00 H new ATOM 0 HD22 LEU A 118 -3.020 2.457 0.907 1.00 0.00 H new ATOM 0 HD23 LEU A 118 -4.618 2.711 1.648 1.00 0.00 H new ATOM 1795 N ILE A 119 -3.700 6.652 4.580 1.00 0.00 N ATOM 1796 CA ILE A 119 -2.970 7.293 5.673 1.00 0.00 C ATOM 1797 C ILE A 119 -3.869 7.501 6.895 1.00 0.00 C ATOM 1798 O ILE A 119 -3.495 8.212 7.825 1.00 0.00 O ATOM 1799 CB ILE A 119 -2.292 8.594 5.210 1.00 0.00 C ATOM 1800 CG1 ILE A 119 -3.342 9.640 4.819 1.00 0.00 C ATOM 1801 CG2 ILE A 119 -1.314 8.320 4.062 1.00 0.00 C ATOM 1802 CD1 ILE A 119 -2.718 10.886 4.189 1.00 0.00 C ATOM 0 H ILE A 119 -4.629 7.039 4.414 1.00 0.00 H new ATOM 0 HA ILE A 119 -2.170 6.620 5.983 1.00 0.00 H new ATOM 0 HB ILE A 119 -1.715 8.999 6.042 1.00 0.00 H new ATOM 0 HG12 ILE A 119 -4.049 9.197 4.117 1.00 0.00 H new ATOM 0 HG13 ILE A 119 -3.910 9.929 5.703 1.00 0.00 H new ATOM 0 HG21 ILE A 119 -0.847 9.254 3.751 1.00 0.00 H new ATOM 0 HG22 ILE A 119 -0.545 7.624 4.397 1.00 0.00 H new ATOM 0 HG23 ILE A 119 -1.854 7.887 3.220 1.00 0.00 H new ATOM 0 HD11 ILE A 119 -3.504 11.595 3.930 1.00 0.00 H new ATOM 0 HD12 ILE A 119 -2.032 11.348 4.899 1.00 0.00 H new ATOM 0 HD13 ILE A 119 -2.173 10.604 3.288 1.00 0.00 H new ATOM 1814 N GLU A 120 -5.054 6.881 6.892 1.00 0.00 N ATOM 1815 CA GLU A 120 -6.010 6.901 7.995 1.00 0.00 C ATOM 1816 C GLU A 120 -6.350 8.311 8.495 1.00 0.00 C ATOM 1817 O GLU A 120 -6.133 8.634 9.664 1.00 0.00 O ATOM 1818 CB GLU A 120 -5.527 5.986 9.124 1.00 0.00 C ATOM 1819 CG GLU A 120 -5.370 4.547 8.627 1.00 0.00 C ATOM 1820 CD GLU A 120 -4.948 3.629 9.768 1.00 0.00 C ATOM 1821 OE1 GLU A 120 -5.847 3.171 10.505 1.00 0.00 O ATOM 1822 OE2 GLU A 120 -3.725 3.391 9.896 1.00 0.00 O ATOM 0 H GLU A 120 -5.381 6.335 6.095 1.00 0.00 H new ATOM 0 HA GLU A 120 -6.952 6.513 7.608 1.00 0.00 H new ATOM 0 HB2 GLU A 120 -4.574 6.348 9.510 1.00 0.00 H new ATOM 0 HB3 GLU A 120 -6.237 6.015 9.951 1.00 0.00 H new ATOM 0 HG2 GLU A 120 -6.311 4.199 8.202 1.00 0.00 H new ATOM 0 HG3 GLU A 120 -4.627 4.511 7.830 1.00 0.00 H new ATOM 1829 N VAL A 121 -6.886 9.151 7.604 1.00 0.00 N ATOM 1830 CA VAL A 121 -7.344 10.501 7.939 1.00 0.00 C ATOM 1831 C VAL A 121 -8.685 10.779 7.262 1.00 0.00 C ATOM 1832 O VAL A 121 -9.229 9.910 6.583 1.00 0.00 O ATOM 1833 CB VAL A 121 -6.317 11.561 7.516 1.00 0.00 C ATOM 1834 CG1 VAL A 121 -4.974 11.346 8.206 1.00 0.00 C ATOM 1835 CG2 VAL A 121 -6.123 11.556 5.999 1.00 0.00 C ATOM 0 H VAL A 121 -7.015 8.910 6.621 1.00 0.00 H new ATOM 0 HA VAL A 121 -7.463 10.558 9.021 1.00 0.00 H new ATOM 0 HB VAL A 121 -6.710 12.530 7.823 1.00 0.00 H new ATOM 0 HG11 VAL A 121 -4.272 12.114 7.883 1.00 0.00 H new ATOM 0 HG12 VAL A 121 -5.106 11.406 9.286 1.00 0.00 H new ATOM 0 HG13 VAL A 121 -4.583 10.363 7.943 1.00 0.00 H new ATOM 0 HG21 VAL A 121 -5.391 12.315 5.723 1.00 0.00 H new ATOM 0 HG22 VAL A 121 -5.767 10.576 5.681 1.00 0.00 H new ATOM 0 HG23 VAL A 121 -7.073 11.773 5.510 1.00 0.00 H new ATOM 1845 N ASP A 122 -9.224 11.988 7.444 1.00 0.00 N ATOM 1846 CA ASP A 122 -10.448 12.406 6.778 1.00 0.00 C ATOM 1847 C ASP A 122 -10.131 12.912 5.373 1.00 0.00 C ATOM 1848 O ASP A 122 -8.990 13.267 5.077 1.00 0.00 O ATOM 1849 CB ASP A 122 -11.115 13.514 7.594 1.00 0.00 C ATOM 1850 CG ASP A 122 -12.486 13.868 7.028 1.00 0.00 C ATOM 1851 OD1 ASP A 122 -13.440 13.103 7.298 1.00 0.00 O ATOM 1852 OD2 ASP A 122 -12.569 14.901 6.328 1.00 0.00 O ATOM 0 H ASP A 122 -8.821 12.698 8.056 1.00 0.00 H new ATOM 0 HA ASP A 122 -11.126 11.556 6.699 1.00 0.00 H new ATOM 0 HB2 ASP A 122 -11.219 13.193 8.631 1.00 0.00 H new ATOM 0 HB3 ASP A 122 -10.480 14.400 7.596 1.00 0.00 H new ATOM 1857 N THR A 123 -11.134 12.952 4.493 1.00 0.00 N ATOM 1858 CA THR A 123 -10.937 13.430 3.131 1.00 0.00 C ATOM 1859 C THR A 123 -10.459 14.882 3.135 1.00 0.00 C ATOM 1860 O THR A 123 -9.624 15.266 2.314 1.00 0.00 O ATOM 1861 CB THR A 123 -12.258 13.321 2.368 1.00 0.00 C ATOM 1862 OG1 THR A 123 -12.703 11.981 2.373 1.00 0.00 O ATOM 1863 CG2 THR A 123 -12.092 13.765 0.917 1.00 0.00 C ATOM 0 H THR A 123 -12.088 12.659 4.703 1.00 0.00 H new ATOM 0 HA THR A 123 -10.176 12.820 2.645 1.00 0.00 H new ATOM 0 HB THR A 123 -12.983 13.968 2.862 1.00 0.00 H new ATOM 0 HG1 THR A 123 -13.619 11.939 2.028 1.00 0.00 H new ATOM 0 HG21 THR A 123 -13.047 13.677 0.398 1.00 0.00 H new ATOM 0 HG22 THR A 123 -11.758 14.802 0.890 1.00 0.00 H new ATOM 0 HG23 THR A 123 -11.352 13.133 0.425 1.00 0.00 H new ATOM 1871 N SER A 124 -10.981 15.695 4.058 1.00 0.00 N ATOM 1872 CA SER A 124 -10.620 17.102 4.145 1.00 0.00 C ATOM 1873 C SER A 124 -9.189 17.270 4.646 1.00 0.00 C ATOM 1874 O SER A 124 -8.555 18.287 4.369 1.00 0.00 O ATOM 1875 CB SER A 124 -11.599 17.809 5.084 1.00 0.00 C ATOM 1876 OG SER A 124 -11.348 19.200 5.105 1.00 0.00 O ATOM 0 H SER A 124 -11.659 15.394 4.758 1.00 0.00 H new ATOM 0 HA SER A 124 -10.676 17.546 3.151 1.00 0.00 H new ATOM 0 HB2 SER A 124 -12.623 17.623 4.759 1.00 0.00 H new ATOM 0 HB3 SER A 124 -11.505 17.401 6.091 1.00 0.00 H new ATOM 0 HG SER A 124 -11.983 19.638 5.709 1.00 0.00 H new ATOM 1882 N GLU A 125 -8.663 16.285 5.380 1.00 0.00 N ATOM 1883 CA GLU A 125 -7.295 16.379 5.866 1.00 0.00 C ATOM 1884 C GLU A 125 -6.316 16.208 4.712 1.00 0.00 C ATOM 1885 O GLU A 125 -5.286 16.880 4.689 1.00 0.00 O ATOM 1886 CB GLU A 125 -7.024 15.312 6.929 1.00 0.00 C ATOM 1887 CG GLU A 125 -7.790 15.599 8.219 1.00 0.00 C ATOM 1888 CD GLU A 125 -7.298 16.884 8.882 1.00 0.00 C ATOM 1889 OE1 GLU A 125 -6.187 16.846 9.458 1.00 0.00 O ATOM 1890 OE2 GLU A 125 -8.033 17.895 8.811 1.00 0.00 O ATOM 0 H GLU A 125 -9.157 15.432 5.643 1.00 0.00 H new ATOM 0 HA GLU A 125 -7.159 17.364 6.313 1.00 0.00 H new ATOM 0 HB2 GLU A 125 -7.311 14.333 6.545 1.00 0.00 H new ATOM 0 HB3 GLU A 125 -5.956 15.271 7.141 1.00 0.00 H new ATOM 0 HG2 GLU A 125 -8.855 15.684 8.001 1.00 0.00 H new ATOM 0 HG3 GLU A 125 -7.672 14.763 8.908 1.00 0.00 H new ATOM 1897 N VAL A 126 -6.613 15.326 3.751 1.00 0.00 N ATOM 1898 CA VAL A 126 -5.717 15.141 2.615 1.00 0.00 C ATOM 1899 C VAL A 126 -5.662 16.416 1.788 1.00 0.00 C ATOM 1900 O VAL A 126 -4.597 16.781 1.300 1.00 0.00 O ATOM 1901 CB VAL A 126 -6.181 13.981 1.733 1.00 0.00 C ATOM 1902 CG1 VAL A 126 -5.240 13.798 0.540 1.00 0.00 C ATOM 1903 CG2 VAL A 126 -6.179 12.685 2.538 1.00 0.00 C ATOM 0 H VAL A 126 -7.450 14.743 3.739 1.00 0.00 H new ATOM 0 HA VAL A 126 -4.724 14.908 3.000 1.00 0.00 H new ATOM 0 HB VAL A 126 -7.186 14.211 1.378 1.00 0.00 H new ATOM 0 HG11 VAL A 126 -5.588 12.968 -0.074 1.00 0.00 H new ATOM 0 HG12 VAL A 126 -5.227 14.710 -0.056 1.00 0.00 H new ATOM 0 HG13 VAL A 126 -4.233 13.586 0.900 1.00 0.00 H new ATOM 0 HG21 VAL A 126 -6.510 11.862 1.904 1.00 0.00 H new ATOM 0 HG22 VAL A 126 -5.170 12.482 2.898 1.00 0.00 H new ATOM 0 HG23 VAL A 126 -6.855 12.783 3.388 1.00 0.00 H new ATOM 1913 N GLU A 127 -6.802 17.093 1.632 1.00 0.00 N ATOM 1914 CA GLU A 127 -6.871 18.327 0.863 1.00 0.00 C ATOM 1915 C GLU A 127 -5.928 19.374 1.447 1.00 0.00 C ATOM 1916 O GLU A 127 -5.298 20.130 0.708 1.00 0.00 O ATOM 1917 CB GLU A 127 -8.314 18.830 0.868 1.00 0.00 C ATOM 1918 CG GLU A 127 -9.209 17.880 0.071 1.00 0.00 C ATOM 1919 CD GLU A 127 -10.687 18.266 0.166 1.00 0.00 C ATOM 1920 OE1 GLU A 127 -10.975 19.392 0.628 1.00 0.00 O ATOM 1921 OE2 GLU A 127 -11.524 17.425 -0.228 1.00 0.00 O ATOM 0 H GLU A 127 -7.693 16.801 2.033 1.00 0.00 H new ATOM 0 HA GLU A 127 -6.558 18.139 -0.164 1.00 0.00 H new ATOM 0 HB2 GLU A 127 -8.676 18.907 1.893 1.00 0.00 H new ATOM 0 HB3 GLU A 127 -8.359 19.830 0.438 1.00 0.00 H new ATOM 0 HG2 GLU A 127 -8.900 17.883 -0.974 1.00 0.00 H new ATOM 0 HG3 GLU A 127 -9.076 16.863 0.439 1.00 0.00 H new ATOM 1928 N THR A 128 -5.824 19.422 2.777 1.00 0.00 N ATOM 1929 CA THR A 128 -4.923 20.351 3.447 1.00 0.00 C ATOM 1930 C THR A 128 -3.485 19.844 3.387 1.00 0.00 C ATOM 1931 O THR A 128 -2.561 20.637 3.217 1.00 0.00 O ATOM 1932 CB THR A 128 -5.355 20.522 4.904 1.00 0.00 C ATOM 1933 OG1 THR A 128 -6.692 20.967 4.948 1.00 0.00 O ATOM 1934 CG2 THR A 128 -4.481 21.551 5.617 1.00 0.00 C ATOM 0 H THR A 128 -6.356 18.825 3.410 1.00 0.00 H new ATOM 0 HA THR A 128 -4.970 21.314 2.938 1.00 0.00 H new ATOM 0 HB THR A 128 -5.252 19.558 5.403 1.00 0.00 H new ATOM 0 HG1 THR A 128 -7.294 20.212 4.781 1.00 0.00 H new ATOM 0 HG21 THR A 128 -4.810 21.653 6.651 1.00 0.00 H new ATOM 0 HG22 THR A 128 -3.442 21.222 5.597 1.00 0.00 H new ATOM 0 HG23 THR A 128 -4.567 22.513 5.112 1.00 0.00 H new ATOM 1942 N LEU A 129 -3.277 18.530 3.526 1.00 0.00 N ATOM 1943 CA LEU A 129 -1.937 17.960 3.536 1.00 0.00 C ATOM 1944 C LEU A 129 -1.235 18.147 2.194 1.00 0.00 C ATOM 1945 O LEU A 129 -0.017 18.317 2.169 1.00 0.00 O ATOM 1946 CB LEU A 129 -2.016 16.474 3.897 1.00 0.00 C ATOM 1947 CG LEU A 129 -2.319 16.264 5.385 1.00 0.00 C ATOM 1948 CD1 LEU A 129 -2.722 14.810 5.619 1.00 0.00 C ATOM 1949 CD2 LEU A 129 -1.090 16.576 6.236 1.00 0.00 C ATOM 0 H LEU A 129 -4.025 17.845 3.633 1.00 0.00 H new ATOM 0 HA LEU A 129 -1.347 18.486 4.286 1.00 0.00 H new ATOM 0 HB2 LEU A 129 -2.790 15.995 3.297 1.00 0.00 H new ATOM 0 HB3 LEU A 129 -1.073 15.989 3.646 1.00 0.00 H new ATOM 0 HG LEU A 129 -3.130 16.935 5.670 1.00 0.00 H new ATOM 0 HD11 LEU A 129 -2.938 14.658 6.677 1.00 0.00 H new ATOM 0 HD12 LEU A 129 -3.610 14.579 5.030 1.00 0.00 H new ATOM 0 HD13 LEU A 129 -1.906 14.153 5.317 1.00 0.00 H new ATOM 0 HD21 LEU A 129 -1.327 16.420 7.288 1.00 0.00 H new ATOM 0 HD22 LEU A 129 -0.271 15.917 5.947 1.00 0.00 H new ATOM 0 HD23 LEU A 129 -0.793 17.613 6.080 1.00 0.00 H new ATOM 1961 N VAL A 130 -1.971 18.122 1.078 1.00 0.00 N ATOM 1962 CA VAL A 130 -1.358 18.357 -0.223 1.00 0.00 C ATOM 1963 C VAL A 130 -1.173 19.848 -0.464 1.00 0.00 C ATOM 1964 O VAL A 130 -0.254 20.241 -1.181 1.00 0.00 O ATOM 1965 CB VAL A 130 -2.187 17.738 -1.353 1.00 0.00 C ATOM 1966 CG1 VAL A 130 -2.281 16.224 -1.157 1.00 0.00 C ATOM 1967 CG2 VAL A 130 -3.591 18.337 -1.442 1.00 0.00 C ATOM 0 H VAL A 130 -2.975 17.944 1.053 1.00 0.00 H new ATOM 0 HA VAL A 130 -0.381 17.875 -0.219 1.00 0.00 H new ATOM 0 HB VAL A 130 -1.678 17.963 -2.290 1.00 0.00 H new ATOM 0 HG11 VAL A 130 -2.872 15.789 -1.963 1.00 0.00 H new ATOM 0 HG12 VAL A 130 -1.280 15.793 -1.167 1.00 0.00 H new ATOM 0 HG13 VAL A 130 -2.759 16.010 -0.201 1.00 0.00 H new ATOM 0 HG21 VAL A 130 -4.137 17.864 -2.258 1.00 0.00 H new ATOM 0 HG22 VAL A 130 -4.120 18.166 -0.504 1.00 0.00 H new ATOM 0 HG23 VAL A 130 -3.518 19.409 -1.627 1.00 0.00 H new ATOM 1977 N THR A 131 -2.032 20.686 0.128 1.00 0.00 N ATOM 1978 CA THR A 131 -1.899 22.129 -0.010 1.00 0.00 C ATOM 1979 C THR A 131 -0.650 22.605 0.724 1.00 0.00 C ATOM 1980 O THR A 131 0.048 23.496 0.245 1.00 0.00 O ATOM 1981 CB THR A 131 -3.139 22.828 0.549 1.00 0.00 C ATOM 1982 OG1 THR A 131 -4.278 22.442 -0.189 1.00 0.00 O ATOM 1983 CG2 THR A 131 -3.009 24.345 0.448 1.00 0.00 C ATOM 0 H THR A 131 -2.820 20.386 0.702 1.00 0.00 H new ATOM 0 HA THR A 131 -1.806 22.378 -1.067 1.00 0.00 H new ATOM 0 HB THR A 131 -3.236 22.539 1.596 1.00 0.00 H new ATOM 0 HG1 THR A 131 -4.725 21.698 0.265 1.00 0.00 H new ATOM 0 HG21 THR A 131 -3.905 24.815 0.853 1.00 0.00 H new ATOM 0 HG22 THR A 131 -2.139 24.674 1.016 1.00 0.00 H new ATOM 0 HG23 THR A 131 -2.890 24.631 -0.597 1.00 0.00 H new ATOM 1991 N GLU A 132 -0.356 22.016 1.885 1.00 0.00 N ATOM 1992 CA GLU A 132 0.837 22.371 2.637 1.00 0.00 C ATOM 1993 C GLU A 132 2.079 21.747 2.012 1.00 0.00 C ATOM 1994 O GLU A 132 3.173 22.292 2.145 1.00 0.00 O ATOM 1995 CB GLU A 132 0.699 21.894 4.084 1.00 0.00 C ATOM 1996 CG GLU A 132 -0.396 22.680 4.804 1.00 0.00 C ATOM 1997 CD GLU A 132 -0.476 22.286 6.278 1.00 0.00 C ATOM 1998 OE1 GLU A 132 -0.810 21.110 6.550 1.00 0.00 O ATOM 1999 OE2 GLU A 132 -0.204 23.165 7.127 1.00 0.00 O ATOM 0 H GLU A 132 -0.930 21.293 2.319 1.00 0.00 H new ATOM 0 HA GLU A 132 0.944 23.455 2.616 1.00 0.00 H new ATOM 0 HB2 GLU A 132 0.463 20.830 4.102 1.00 0.00 H new ATOM 0 HB3 GLU A 132 1.648 22.018 4.606 1.00 0.00 H new ATOM 0 HG2 GLU A 132 -0.196 23.748 4.720 1.00 0.00 H new ATOM 0 HG3 GLU A 132 -1.356 22.496 4.322 1.00 0.00 H new ATOM 2006 N ALA A 133 1.928 20.611 1.327 1.00 0.00 N ATOM 2007 CA ALA A 133 3.062 19.953 0.704 1.00 0.00 C ATOM 2008 C ALA A 133 3.584 20.788 -0.462 1.00 0.00 C ATOM 2009 O ALA A 133 4.782 21.049 -0.545 1.00 0.00 O ATOM 2010 CB ALA A 133 2.634 18.568 0.220 1.00 0.00 C ATOM 0 H ALA A 133 1.035 20.136 1.194 1.00 0.00 H new ATOM 0 HA ALA A 133 3.866 19.848 1.432 1.00 0.00 H new ATOM 0 HB1 ALA A 133 3.482 18.068 -0.249 1.00 0.00 H new ATOM 0 HB2 ALA A 133 2.288 17.977 1.068 1.00 0.00 H new ATOM 0 HB3 ALA A 133 1.826 18.669 -0.505 1.00 0.00 H new ATOM 2016 N LEU A 134 2.692 21.215 -1.363 1.00 0.00 N ATOM 2017 CA LEU A 134 3.086 22.011 -2.515 1.00 0.00 C ATOM 2018 C LEU A 134 3.493 23.422 -2.096 1.00 0.00 C ATOM 2019 O LEU A 134 4.225 24.088 -2.827 1.00 0.00 O ATOM 2020 CB LEU A 134 1.963 21.995 -3.563 1.00 0.00 C ATOM 2021 CG LEU A 134 0.649 22.645 -3.104 1.00 0.00 C ATOM 2022 CD1 LEU A 134 0.651 24.159 -3.318 1.00 0.00 C ATOM 2023 CD2 LEU A 134 -0.501 22.078 -3.935 1.00 0.00 C ATOM 0 H LEU A 134 1.692 21.019 -1.310 1.00 0.00 H new ATOM 0 HA LEU A 134 3.970 21.571 -2.977 1.00 0.00 H new ATOM 0 HB2 LEU A 134 2.313 22.508 -4.459 1.00 0.00 H new ATOM 0 HB3 LEU A 134 1.762 20.961 -3.845 1.00 0.00 H new ATOM 0 HG LEU A 134 0.536 22.433 -2.041 1.00 0.00 H new ATOM 0 HD11 LEU A 134 -0.298 24.576 -2.979 1.00 0.00 H new ATOM 0 HD12 LEU A 134 1.467 24.606 -2.750 1.00 0.00 H new ATOM 0 HD13 LEU A 134 0.785 24.377 -4.378 1.00 0.00 H new ATOM 0 HD21 LEU A 134 -1.439 22.533 -3.617 1.00 0.00 H new ATOM 0 HD22 LEU A 134 -0.331 22.297 -4.989 1.00 0.00 H new ATOM 0 HD23 LEU A 134 -0.555 20.999 -3.793 1.00 0.00 H new ATOM 2035 N ALA A 135 3.028 23.884 -0.929 1.00 0.00 N ATOM 2036 CA ALA A 135 3.407 25.192 -0.418 1.00 0.00 C ATOM 2037 C ALA A 135 4.845 25.174 0.102 1.00 0.00 C ATOM 2038 O ALA A 135 5.571 26.150 -0.067 1.00 0.00 O ATOM 2039 CB ALA A 135 2.451 25.593 0.703 1.00 0.00 C ATOM 0 H ALA A 135 2.389 23.366 -0.326 1.00 0.00 H new ATOM 0 HA ALA A 135 3.347 25.919 -1.228 1.00 0.00 H new ATOM 0 HB1 ALA A 135 2.733 26.573 1.088 1.00 0.00 H new ATOM 0 HB2 ALA A 135 1.433 25.634 0.316 1.00 0.00 H new ATOM 0 HB3 ALA A 135 2.504 24.858 1.507 1.00 0.00 H new ATOM 2045 N GLU A 136 5.263 24.070 0.729 1.00 0.00 N ATOM 2046 CA GLU A 136 6.635 23.936 1.202 1.00 0.00 C ATOM 2047 C GLU A 136 7.583 23.687 0.032 1.00 0.00 C ATOM 2048 O GLU A 136 8.787 23.899 0.165 1.00 0.00 O ATOM 2049 CB GLU A 136 6.732 22.787 2.207 1.00 0.00 C ATOM 2050 CG GLU A 136 6.069 23.155 3.534 1.00 0.00 C ATOM 2051 CD GLU A 136 6.775 24.334 4.201 1.00 0.00 C ATOM 2052 OE1 GLU A 136 7.964 24.173 4.558 1.00 0.00 O ATOM 2053 OE2 GLU A 136 6.121 25.391 4.348 1.00 0.00 O ATOM 0 H GLU A 136 4.670 23.262 0.918 1.00 0.00 H new ATOM 0 HA GLU A 136 6.925 24.865 1.692 1.00 0.00 H new ATOM 0 HB2 GLU A 136 6.256 21.898 1.794 1.00 0.00 H new ATOM 0 HB3 GLU A 136 7.779 22.537 2.378 1.00 0.00 H new ATOM 0 HG2 GLU A 136 5.022 23.405 3.362 1.00 0.00 H new ATOM 0 HG3 GLU A 136 6.085 22.294 4.202 1.00 0.00 H new ATOM 2060 N ILE A 137 7.055 23.241 -1.110 1.00 0.00 N ATOM 2061 CA ILE A 137 7.861 23.054 -2.305 1.00 0.00 C ATOM 2062 C ILE A 137 8.176 24.408 -2.930 1.00 0.00 C ATOM 2063 O ILE A 137 9.346 24.736 -3.116 1.00 0.00 O ATOM 2064 CB ILE A 137 7.106 22.153 -3.292 1.00 0.00 C ATOM 2065 CG1 ILE A 137 7.094 20.700 -2.804 1.00 0.00 C ATOM 2066 CG2 ILE A 137 7.727 22.223 -4.691 1.00 0.00 C ATOM 2067 CD1 ILE A 137 8.476 20.050 -2.795 1.00 0.00 C ATOM 0 H ILE A 137 6.070 23.004 -1.226 1.00 0.00 H new ATOM 0 HA ILE A 137 8.803 22.571 -2.046 1.00 0.00 H new ATOM 0 HB ILE A 137 6.080 22.517 -3.348 1.00 0.00 H new ATOM 0 HG12 ILE A 137 6.679 20.667 -1.797 1.00 0.00 H new ATOM 0 HG13 ILE A 137 6.430 20.116 -3.442 1.00 0.00 H new ATOM 0 HG21 ILE A 137 7.171 21.575 -5.369 1.00 0.00 H new ATOM 0 HG22 ILE A 137 7.687 23.249 -5.056 1.00 0.00 H new ATOM 0 HG23 ILE A 137 8.765 21.895 -4.645 1.00 0.00 H new ATOM 0 HD11 ILE A 137 8.393 19.023 -2.439 1.00 0.00 H new ATOM 0 HD12 ILE A 137 8.885 20.052 -3.805 1.00 0.00 H new ATOM 0 HD13 ILE A 137 9.137 20.611 -2.135 1.00 0.00 H new ATOM 2079 N GLU A 138 7.153 25.203 -3.255 1.00 0.00 N ATOM 2080 CA GLU A 138 7.367 26.479 -3.932 1.00 0.00 C ATOM 2081 C GLU A 138 8.077 27.495 -3.036 1.00 0.00 C ATOM 2082 O GLU A 138 8.604 28.491 -3.531 1.00 0.00 O ATOM 2083 CB GLU A 138 6.028 27.032 -4.428 1.00 0.00 C ATOM 2084 CG GLU A 138 5.093 27.380 -3.269 1.00 0.00 C ATOM 2085 CD GLU A 138 3.734 27.842 -3.789 1.00 0.00 C ATOM 2086 OE1 GLU A 138 2.974 26.968 -4.261 1.00 0.00 O ATOM 2087 OE2 GLU A 138 3.467 29.062 -3.713 1.00 0.00 O ATOM 0 H GLU A 138 6.176 24.985 -3.061 1.00 0.00 H new ATOM 0 HA GLU A 138 8.022 26.301 -4.785 1.00 0.00 H new ATOM 0 HB2 GLU A 138 6.204 27.922 -5.033 1.00 0.00 H new ATOM 0 HB3 GLU A 138 5.548 26.297 -5.074 1.00 0.00 H new ATOM 0 HG2 GLU A 138 4.964 26.510 -2.626 1.00 0.00 H new ATOM 0 HG3 GLU A 138 5.540 28.165 -2.658 1.00 0.00 H new ATOM 2094 N LYS A 139 8.095 27.246 -1.723 1.00 0.00 N ATOM 2095 CA LYS A 139 8.746 28.125 -0.765 1.00 0.00 C ATOM 2096 C LYS A 139 10.270 28.074 -0.879 1.00 0.00 C ATOM 2097 O LYS A 139 10.937 29.018 -0.458 1.00 0.00 O ATOM 2098 CB LYS A 139 8.291 27.709 0.635 1.00 0.00 C ATOM 2099 CG LYS A 139 8.896 28.591 1.726 1.00 0.00 C ATOM 2100 CD LYS A 139 8.379 28.160 3.102 1.00 0.00 C ATOM 2101 CE LYS A 139 6.863 28.325 3.230 1.00 0.00 C ATOM 2102 NZ LYS A 139 6.451 29.735 3.090 1.00 0.00 N ATOM 0 H LYS A 139 7.657 26.427 -1.301 1.00 0.00 H new ATOM 0 HA LYS A 139 8.461 29.157 -0.971 1.00 0.00 H new ATOM 0 HB2 LYS A 139 7.204 27.759 0.691 1.00 0.00 H new ATOM 0 HB3 LYS A 139 8.572 26.671 0.813 1.00 0.00 H new ATOM 0 HG2 LYS A 139 9.983 28.520 1.700 1.00 0.00 H new ATOM 0 HG3 LYS A 139 8.640 29.635 1.544 1.00 0.00 H new ATOM 0 HD2 LYS A 139 8.645 27.118 3.278 1.00 0.00 H new ATOM 0 HD3 LYS A 139 8.873 28.749 3.874 1.00 0.00 H new ATOM 0 HE2 LYS A 139 6.366 27.724 2.468 1.00 0.00 H new ATOM 0 HE3 LYS A 139 6.537 27.945 4.198 1.00 0.00 H new ATOM 0 HZ1 LYS A 139 5.448 29.831 3.349 1.00 0.00 H new ATOM 0 HZ2 LYS A 139 7.029 30.330 3.718 1.00 0.00 H new ATOM 0 HZ3 LYS A 139 6.585 30.040 2.105 1.00 0.00 H new ATOM 2116 N GLN A 140 10.841 26.999 -1.435 1.00 0.00 N ATOM 2117 CA GLN A 140 12.287 26.843 -1.432 1.00 0.00 C ATOM 2118 C GLN A 140 12.822 25.911 -2.519 1.00 0.00 C ATOM 2119 O GLN A 140 13.877 26.206 -3.076 1.00 0.00 O ATOM 2120 CB GLN A 140 12.685 26.297 -0.056 1.00 0.00 C ATOM 2121 CG GLN A 140 12.009 24.950 0.225 1.00 0.00 C ATOM 2122 CD GLN A 140 11.991 24.628 1.712 1.00 0.00 C ATOM 2123 OE1 GLN A 140 12.956 24.880 2.429 1.00 0.00 O ATOM 2124 NE2 GLN A 140 10.882 24.065 2.181 1.00 0.00 N ATOM 0 H GLN A 140 10.328 26.240 -1.884 1.00 0.00 H new ATOM 0 HA GLN A 140 12.724 27.819 -1.642 1.00 0.00 H new ATOM 0 HB2 GLN A 140 13.768 26.180 -0.008 1.00 0.00 H new ATOM 0 HB3 GLN A 140 12.407 27.014 0.717 1.00 0.00 H new ATOM 0 HG2 GLN A 140 10.988 24.969 -0.155 1.00 0.00 H new ATOM 0 HG3 GLN A 140 12.534 24.160 -0.312 1.00 0.00 H new ATOM 0 HE21 GLN A 140 10.103 23.872 1.552 1.00 0.00 H new ATOM 0 HE22 GLN A 140 10.810 23.826 3.170 1.00 0.00 H new ATOM 2133 N THR A 141 12.123 24.808 -2.823 1.00 0.00 N ATOM 2134 CA THR A 141 12.617 23.718 -3.677 1.00 0.00 C ATOM 2135 C THR A 141 14.056 23.318 -3.334 1.00 0.00 C ATOM 2136 O THR A 141 14.734 22.694 -4.150 1.00 0.00 O ATOM 2137 CB THR A 141 12.496 24.072 -5.168 1.00 0.00 C ATOM 2138 OG1 THR A 141 13.416 25.080 -5.523 1.00 0.00 O ATOM 2139 CG2 THR A 141 11.096 24.555 -5.532 1.00 0.00 C ATOM 0 H THR A 141 11.178 24.645 -2.475 1.00 0.00 H new ATOM 0 HA THR A 141 11.981 22.856 -3.477 1.00 0.00 H new ATOM 0 HB THR A 141 12.710 23.155 -5.717 1.00 0.00 H new ATOM 0 HG1 THR A 141 13.797 25.475 -4.711 1.00 0.00 H new ATOM 0 HG21 THR A 141 11.058 24.793 -6.595 1.00 0.00 H new ATOM 0 HG22 THR A 141 10.372 23.771 -5.310 1.00 0.00 H new ATOM 0 HG23 THR A 141 10.856 25.446 -4.952 1.00 0.00 H new ATOM 2824 N ASP B 27 5.616 21.010 -12.772 1.00 0.00 N ATOM 2825 CA ASP B 27 6.497 19.938 -13.214 1.00 0.00 C ATOM 2826 C ASP B 27 6.982 19.060 -12.056 1.00 0.00 C ATOM 2827 O ASP B 27 7.540 17.990 -12.295 1.00 0.00 O ATOM 2828 CB ASP B 27 7.685 20.563 -13.945 1.00 0.00 C ATOM 2829 CG ASP B 27 8.593 19.506 -14.575 1.00 0.00 C ATOM 2830 OD1 ASP B 27 8.112 18.806 -15.493 1.00 0.00 O ATOM 2831 OD2 ASP B 27 9.761 19.410 -14.132 1.00 0.00 O ATOM 0 HA ASP B 27 5.937 19.282 -13.880 1.00 0.00 H new ATOM 0 HB2 ASP B 27 7.320 21.236 -14.721 1.00 0.00 H new ATOM 0 HB3 ASP B 27 8.263 21.167 -13.246 1.00 0.00 H new ATOM 2836 N MET B 28 6.777 19.489 -10.806 1.00 0.00 N ATOM 2837 CA MET B 28 7.235 18.728 -9.651 1.00 0.00 C ATOM 2838 C MET B 28 6.587 17.345 -9.599 1.00 0.00 C ATOM 2839 O MET B 28 7.172 16.412 -9.048 1.00 0.00 O ATOM 2840 CB MET B 28 6.941 19.518 -8.372 1.00 0.00 C ATOM 2841 CG MET B 28 7.558 18.823 -7.158 1.00 0.00 C ATOM 2842 SD MET B 28 9.355 18.620 -7.255 1.00 0.00 S ATOM 2843 CE MET B 28 9.599 17.566 -5.804 1.00 0.00 C ATOM 0 H MET B 28 6.297 20.359 -10.574 1.00 0.00 H new ATOM 0 HA MET B 28 8.310 18.574 -9.739 1.00 0.00 H new ATOM 0 HB2 MET B 28 7.341 20.528 -8.462 1.00 0.00 H new ATOM 0 HB3 MET B 28 5.864 19.612 -8.236 1.00 0.00 H new ATOM 0 HG2 MET B 28 7.316 19.396 -6.263 1.00 0.00 H new ATOM 0 HG3 MET B 28 7.098 17.842 -7.042 1.00 0.00 H new ATOM 0 HE1 MET B 28 10.357 18.008 -5.157 1.00 0.00 H new ATOM 0 HE2 MET B 28 8.661 17.478 -5.257 1.00 0.00 H new ATOM 0 HE3 MET B 28 9.927 16.577 -6.124 1.00 0.00 H new ATOM 2853 N GLY B 29 5.389 17.192 -10.167 1.00 0.00 N ATOM 2854 CA GLY B 29 4.708 15.907 -10.179 1.00 0.00 C ATOM 2855 C GLY B 29 5.386 14.948 -11.150 1.00 0.00 C ATOM 2856 O GLY B 29 5.427 13.744 -10.907 1.00 0.00 O ATOM 0 H GLY B 29 4.875 17.946 -10.623 1.00 0.00 H new ATOM 0 HA2 GLY B 29 4.710 15.479 -9.176 1.00 0.00 H new ATOM 0 HA3 GLY B 29 3.665 16.045 -10.465 1.00 0.00 H new ATOM 2860 N ALA B 30 5.925 15.476 -12.252 1.00 0.00 N ATOM 2861 CA ALA B 30 6.615 14.667 -13.240 1.00 0.00 C ATOM 2862 C ALA B 30 8.054 14.387 -12.805 1.00 0.00 C ATOM 2863 O ALA B 30 8.659 13.412 -13.253 1.00 0.00 O ATOM 2864 CB ALA B 30 6.604 15.398 -14.581 1.00 0.00 C ATOM 0 H ALA B 30 5.892 16.470 -12.477 1.00 0.00 H new ATOM 0 HA ALA B 30 6.101 13.711 -13.338 1.00 0.00 H new ATOM 0 HB1 ALA B 30 7.121 14.796 -15.328 1.00 0.00 H new ATOM 0 HB2 ALA B 30 5.574 15.563 -14.897 1.00 0.00 H new ATOM 0 HB3 ALA B 30 7.109 16.358 -14.476 1.00 0.00 H new ATOM 2870 N ALA B 31 8.607 15.238 -11.932 1.00 0.00 N ATOM 2871 CA ALA B 31 9.957 15.050 -11.422 1.00 0.00 C ATOM 2872 C ALA B 31 9.989 13.844 -10.488 1.00 0.00 C ATOM 2873 O ALA B 31 10.909 13.027 -10.544 1.00 0.00 O ATOM 2874 CB ALA B 31 10.382 16.314 -10.677 1.00 0.00 C ATOM 0 H ALA B 31 8.133 16.064 -11.567 1.00 0.00 H new ATOM 0 HA ALA B 31 10.647 14.867 -12.245 1.00 0.00 H new ATOM 0 HB1 ALA B 31 11.393 16.186 -10.290 1.00 0.00 H new ATOM 0 HB2 ALA B 31 10.360 17.163 -11.360 1.00 0.00 H new ATOM 0 HB3 ALA B 31 9.697 16.496 -9.849 1.00 0.00 H new ATOM 2880 N LEU B 32 8.971 13.739 -9.627 1.00 0.00 N ATOM 2881 CA LEU B 32 8.830 12.622 -8.709 1.00 0.00 C ATOM 2882 C LEU B 32 8.473 11.354 -9.477 1.00 0.00 C ATOM 2883 O LEU B 32 8.967 10.275 -9.158 1.00 0.00 O ATOM 2884 CB LEU B 32 7.706 12.946 -7.722 1.00 0.00 C ATOM 2885 CG LEU B 32 8.033 14.116 -6.791 1.00 0.00 C ATOM 2886 CD1 LEU B 32 6.757 14.525 -6.061 1.00 0.00 C ATOM 2887 CD2 LEU B 32 9.082 13.714 -5.759 1.00 0.00 C ATOM 0 H LEU B 32 8.225 14.431 -9.553 1.00 0.00 H new ATOM 0 HA LEU B 32 9.769 12.461 -8.180 1.00 0.00 H new ATOM 0 HB2 LEU B 32 6.799 13.178 -8.280 1.00 0.00 H new ATOM 0 HB3 LEU B 32 7.494 12.062 -7.121 1.00 0.00 H new ATOM 0 HG LEU B 32 8.426 14.941 -7.385 1.00 0.00 H new ATOM 0 HD11 LEU B 32 6.972 15.359 -5.392 1.00 0.00 H new ATOM 0 HD12 LEU B 32 6.003 14.828 -6.788 1.00 0.00 H new ATOM 0 HD13 LEU B 32 6.383 13.681 -5.481 1.00 0.00 H new ATOM 0 HD21 LEU B 32 9.297 14.562 -5.109 1.00 0.00 H new ATOM 0 HD22 LEU B 32 8.704 12.885 -5.160 1.00 0.00 H new ATOM 0 HD23 LEU B 32 9.995 13.407 -6.269 1.00 0.00 H new ATOM 2899 N ARG B 33 7.613 11.477 -10.494 1.00 0.00 N ATOM 2900 CA ARG B 33 7.175 10.316 -11.251 1.00 0.00 C ATOM 2901 C ARG B 33 8.322 9.727 -12.062 1.00 0.00 C ATOM 2902 O ARG B 33 8.390 8.512 -12.211 1.00 0.00 O ATOM 2903 CB ARG B 33 6.011 10.702 -12.169 1.00 0.00 C ATOM 2904 CG ARG B 33 5.456 9.494 -12.933 1.00 0.00 C ATOM 2905 CD ARG B 33 4.894 8.430 -11.987 1.00 0.00 C ATOM 2906 NE ARG B 33 4.547 7.206 -12.716 1.00 0.00 N ATOM 2907 CZ ARG B 33 3.359 6.595 -12.683 1.00 0.00 C ATOM 2908 NH1 ARG B 33 2.338 7.087 -11.985 1.00 0.00 N ATOM 2909 NH2 ARG B 33 3.190 5.467 -13.364 1.00 0.00 N ATOM 0 H ARG B 33 7.214 12.363 -10.804 1.00 0.00 H new ATOM 0 HA ARG B 33 6.837 9.553 -10.549 1.00 0.00 H new ATOM 0 HB2 ARG B 33 5.215 11.152 -11.575 1.00 0.00 H new ATOM 0 HB3 ARG B 33 6.345 11.458 -12.880 1.00 0.00 H new ATOM 0 HG2 ARG B 33 4.672 9.824 -13.615 1.00 0.00 H new ATOM 0 HG3 ARG B 33 6.246 9.056 -13.544 1.00 0.00 H new ATOM 0 HD2 ARG B 33 5.628 8.201 -11.215 1.00 0.00 H new ATOM 0 HD3 ARG B 33 4.010 8.819 -11.481 1.00 0.00 H new ATOM 0 HE ARG B 33 5.273 6.786 -13.297 1.00 0.00 H new ATOM 0 HH11 ARG B 33 2.451 7.952 -11.457 1.00 0.00 H new ATOM 0 HH12 ARG B 33 1.442 6.599 -11.978 1.00 0.00 H new ATOM 0 HH21 ARG B 33 3.962 5.077 -13.904 1.00 0.00 H new ATOM 0 HH22 ARG B 33 2.288 4.991 -13.347 1.00 0.00 H new ATOM 2923 N SER B 34 9.225 10.559 -12.584 1.00 0.00 N ATOM 2924 CA SER B 34 10.347 10.052 -13.361 1.00 0.00 C ATOM 2925 C SER B 34 11.277 9.227 -12.470 1.00 0.00 C ATOM 2926 O SER B 34 11.741 8.158 -12.865 1.00 0.00 O ATOM 2927 CB SER B 34 11.100 11.231 -13.977 1.00 0.00 C ATOM 2928 OG SER B 34 12.178 10.754 -14.753 1.00 0.00 O ATOM 0 H SER B 34 9.199 11.574 -12.482 1.00 0.00 H new ATOM 0 HA SER B 34 9.979 9.405 -14.157 1.00 0.00 H new ATOM 0 HB2 SER B 34 10.426 11.821 -14.598 1.00 0.00 H new ATOM 0 HB3 SER B 34 11.469 11.890 -13.191 1.00 0.00 H new ATOM 0 HG SER B 34 12.658 11.512 -15.148 1.00 0.00 H new ATOM 2934 N ALA B 35 11.544 9.728 -11.257 1.00 0.00 N ATOM 2935 CA ALA B 35 12.427 9.066 -10.315 1.00 0.00 C ATOM 2936 C ALA B 35 11.848 7.736 -9.832 1.00 0.00 C ATOM 2937 O ALA B 35 12.594 6.854 -9.406 1.00 0.00 O ATOM 2938 CB ALA B 35 12.660 9.998 -9.128 1.00 0.00 C ATOM 0 H ALA B 35 11.150 10.603 -10.911 1.00 0.00 H new ATOM 0 HA ALA B 35 13.369 8.844 -10.816 1.00 0.00 H new ATOM 0 HB1 ALA B 35 13.322 9.514 -8.410 1.00 0.00 H new ATOM 0 HB2 ALA B 35 13.117 10.924 -9.477 1.00 0.00 H new ATOM 0 HB3 ALA B 35 11.707 10.222 -8.649 1.00 0.00 H new ATOM 2944 N TYR B 36 10.523 7.575 -9.892 1.00 0.00 N ATOM 2945 CA TYR B 36 9.878 6.388 -9.357 1.00 0.00 C ATOM 2946 C TYR B 36 9.300 5.498 -10.456 1.00 0.00 C ATOM 2947 O TYR B 36 8.973 4.343 -10.199 1.00 0.00 O ATOM 2948 CB TYR B 36 8.817 6.815 -8.341 1.00 0.00 C ATOM 2949 CG TYR B 36 9.323 7.675 -7.197 1.00 0.00 C ATOM 2950 CD1 TYR B 36 10.659 7.586 -6.767 1.00 0.00 C ATOM 2951 CD2 TYR B 36 8.447 8.572 -6.566 1.00 0.00 C ATOM 2952 CE1 TYR B 36 11.122 8.401 -5.724 1.00 0.00 C ATOM 2953 CE2 TYR B 36 8.903 9.386 -5.518 1.00 0.00 C ATOM 2954 CZ TYR B 36 10.245 9.306 -5.095 1.00 0.00 C ATOM 2955 OH TYR B 36 10.692 10.101 -4.085 1.00 0.00 O ATOM 0 H TYR B 36 9.884 8.254 -10.306 1.00 0.00 H new ATOM 0 HA TYR B 36 10.626 5.776 -8.853 1.00 0.00 H new ATOM 0 HB2 TYR B 36 8.034 7.362 -8.866 1.00 0.00 H new ATOM 0 HB3 TYR B 36 8.356 5.920 -7.924 1.00 0.00 H new ATOM 0 HD1 TYR B 36 11.331 6.887 -7.242 1.00 0.00 H new ATOM 0 HD2 TYR B 36 7.418 8.636 -6.888 1.00 0.00 H new ATOM 0 HE1 TYR B 36 12.151 8.335 -5.403 1.00 0.00 H new ATOM 0 HE2 TYR B 36 8.225 10.074 -5.035 1.00 0.00 H new ATOM 0 HH TYR B 36 9.958 10.666 -3.764 1.00 0.00 H new ATOM 2965 N GLN B 37 9.166 6.008 -11.684 1.00 0.00 N ATOM 2966 CA GLN B 37 8.747 5.187 -12.809 1.00 0.00 C ATOM 2967 C GLN B 37 9.860 4.192 -13.126 1.00 0.00 C ATOM 2968 O GLN B 37 9.584 3.041 -13.457 1.00 0.00 O ATOM 2969 CB GLN B 37 8.456 6.079 -14.018 1.00 0.00 C ATOM 2970 CG GLN B 37 8.035 5.256 -15.241 1.00 0.00 C ATOM 2971 CD GLN B 37 6.751 4.471 -14.992 1.00 0.00 C ATOM 2972 OE1 GLN B 37 5.859 4.923 -14.278 1.00 0.00 O ATOM 2973 NE2 GLN B 37 6.644 3.285 -15.580 1.00 0.00 N ATOM 0 H GLN B 37 9.343 6.985 -11.918 1.00 0.00 H new ATOM 0 HA GLN B 37 7.836 4.642 -12.562 1.00 0.00 H new ATOM 0 HB2 GLN B 37 7.666 6.787 -13.766 1.00 0.00 H new ATOM 0 HB3 GLN B 37 9.343 6.664 -14.261 1.00 0.00 H new ATOM 0 HG2 GLN B 37 7.893 5.921 -16.093 1.00 0.00 H new ATOM 0 HG3 GLN B 37 8.836 4.565 -15.505 1.00 0.00 H new ATOM 0 HE21 GLN B 37 7.402 2.937 -16.167 1.00 0.00 H new ATOM 0 HE22 GLN B 37 5.804 2.722 -15.444 1.00 0.00 H new ATOM 2982 N LYS B 38 11.122 4.631 -13.020 1.00 0.00 N ATOM 2983 CA LYS B 38 12.264 3.751 -13.234 1.00 0.00 C ATOM 2984 C LYS B 38 12.320 2.649 -12.174 1.00 0.00 C ATOM 2985 O LYS B 38 12.886 1.588 -12.419 1.00 0.00 O ATOM 2986 CB LYS B 38 13.558 4.572 -13.239 1.00 0.00 C ATOM 2987 CG LYS B 38 13.801 5.205 -11.868 1.00 0.00 C ATOM 2988 CD LYS B 38 15.062 6.068 -11.848 1.00 0.00 C ATOM 2989 CE LYS B 38 14.907 7.273 -12.773 1.00 0.00 C ATOM 2990 NZ LYS B 38 16.025 8.217 -12.605 1.00 0.00 N ATOM 0 H LYS B 38 11.371 5.592 -12.787 1.00 0.00 H new ATOM 0 HA LYS B 38 12.151 3.265 -14.203 1.00 0.00 H new ATOM 0 HB2 LYS B 38 14.400 3.932 -13.504 1.00 0.00 H new ATOM 0 HB3 LYS B 38 13.498 5.351 -13.999 1.00 0.00 H new ATOM 0 HG2 LYS B 38 12.940 5.815 -11.593 1.00 0.00 H new ATOM 0 HG3 LYS B 38 13.888 4.420 -11.117 1.00 0.00 H new ATOM 0 HD2 LYS B 38 15.260 6.407 -10.831 1.00 0.00 H new ATOM 0 HD3 LYS B 38 15.921 5.473 -12.159 1.00 0.00 H new ATOM 0 HE2 LYS B 38 14.863 6.937 -13.809 1.00 0.00 H new ATOM 0 HE3 LYS B 38 13.965 7.779 -12.562 1.00 0.00 H new ATOM 0 HZ1 LYS B 38 15.853 9.065 -13.181 1.00 0.00 H new ATOM 0 HZ2 LYS B 38 16.103 8.489 -11.604 1.00 0.00 H new ATOM 0 HZ3 LYS B 38 16.910 7.765 -12.911 1.00 0.00 H new ATOM 3004 N THR B 39 11.733 2.900 -10.995 1.00 0.00 N ATOM 3005 CA THR B 39 11.687 1.919 -9.914 1.00 0.00 C ATOM 3006 C THR B 39 10.718 0.770 -10.217 1.00 0.00 C ATOM 3007 O THR B 39 10.741 -0.242 -9.519 1.00 0.00 O ATOM 3008 CB THR B 39 11.315 2.618 -8.602 1.00 0.00 C ATOM 3009 OG1 THR B 39 12.207 3.685 -8.376 1.00 0.00 O ATOM 3010 CG2 THR B 39 11.411 1.674 -7.405 1.00 0.00 C ATOM 0 H THR B 39 11.280 3.786 -10.770 1.00 0.00 H new ATOM 0 HA THR B 39 12.678 1.474 -9.818 1.00 0.00 H new ATOM 0 HB THR B 39 10.286 2.965 -8.698 1.00 0.00 H new ATOM 0 HG1 THR B 39 11.972 4.136 -7.538 1.00 0.00 H new ATOM 0 HG21 THR B 39 11.139 2.210 -6.496 1.00 0.00 H new ATOM 0 HG22 THR B 39 10.731 0.834 -7.548 1.00 0.00 H new ATOM 0 HG23 THR B 39 12.432 1.303 -7.315 1.00 0.00 H new ATOM 3018 N ILE B 40 9.869 0.907 -11.242 1.00 0.00 N ATOM 3019 CA ILE B 40 8.885 -0.120 -11.579 1.00 0.00 C ATOM 3020 C ILE B 40 8.939 -0.498 -13.058 1.00 0.00 C ATOM 3021 O ILE B 40 8.078 -1.230 -13.540 1.00 0.00 O ATOM 3022 CB ILE B 40 7.473 0.341 -11.187 1.00 0.00 C ATOM 3023 CG1 ILE B 40 7.064 1.582 -11.990 1.00 0.00 C ATOM 3024 CG2 ILE B 40 7.404 0.619 -9.679 1.00 0.00 C ATOM 3025 CD1 ILE B 40 5.591 1.933 -11.781 1.00 0.00 C ATOM 0 H ILE B 40 9.846 1.724 -11.853 1.00 0.00 H new ATOM 0 HA ILE B 40 9.134 -1.014 -11.008 1.00 0.00 H new ATOM 0 HB ILE B 40 6.770 -0.458 -11.423 1.00 0.00 H new ATOM 0 HG12 ILE B 40 7.685 2.428 -11.694 1.00 0.00 H new ATOM 0 HG13 ILE B 40 7.249 1.407 -13.050 1.00 0.00 H new ATOM 0 HG21 ILE B 40 6.398 0.945 -9.415 1.00 0.00 H new ATOM 0 HG22 ILE B 40 7.647 -0.291 -9.130 1.00 0.00 H new ATOM 0 HG23 ILE B 40 8.118 1.401 -9.420 1.00 0.00 H new ATOM 0 HD11 ILE B 40 5.341 2.818 -12.367 1.00 0.00 H new ATOM 0 HD12 ILE B 40 4.969 1.098 -12.102 1.00 0.00 H new ATOM 0 HD13 ILE B 40 5.411 2.134 -10.725 1.00 0.00 H new ATOM 3037 N GLU B 41 9.943 -0.003 -13.786 1.00 0.00 N ATOM 3038 CA GLU B 41 10.098 -0.259 -15.213 1.00 0.00 C ATOM 3039 C GLU B 41 10.759 -1.621 -15.473 1.00 0.00 C ATOM 3040 O GLU B 41 11.376 -1.826 -16.519 1.00 0.00 O ATOM 3041 CB GLU B 41 10.907 0.895 -15.825 1.00 0.00 C ATOM 3042 CG GLU B 41 10.676 1.042 -17.332 1.00 0.00 C ATOM 3043 CD GLU B 41 9.206 1.277 -17.656 1.00 0.00 C ATOM 3044 OE1 GLU B 41 8.701 2.367 -17.311 1.00 0.00 O ATOM 3045 OE2 GLU B 41 8.592 0.360 -18.249 1.00 0.00 O ATOM 0 H GLU B 41 10.675 0.591 -13.395 1.00 0.00 H new ATOM 0 HA GLU B 41 9.118 -0.305 -15.687 1.00 0.00 H new ATOM 0 HB2 GLU B 41 10.638 1.827 -15.327 1.00 0.00 H new ATOM 0 HB3 GLU B 41 11.968 0.729 -15.638 1.00 0.00 H new ATOM 0 HG2 GLU B 41 11.270 1.873 -17.712 1.00 0.00 H new ATOM 0 HG3 GLU B 41 11.022 0.143 -17.843 1.00 0.00 H new ATOM 3052 N GLU B 42 10.640 -2.559 -14.529 1.00 0.00 N ATOM 3053 CA GLU B 42 11.283 -3.863 -14.622 1.00 0.00 C ATOM 3054 C GLU B 42 10.413 -4.966 -14.012 1.00 0.00 C ATOM 3055 O GLU B 42 9.300 -4.707 -13.551 1.00 0.00 O ATOM 3056 CB GLU B 42 12.653 -3.799 -13.938 1.00 0.00 C ATOM 3057 CG GLU B 42 12.531 -3.442 -12.454 1.00 0.00 C ATOM 3058 CD GLU B 42 13.906 -3.405 -11.795 1.00 0.00 C ATOM 3059 OE1 GLU B 42 14.359 -4.479 -11.335 1.00 0.00 O ATOM 3060 OE2 GLU B 42 14.500 -2.304 -11.752 1.00 0.00 O ATOM 0 H GLU B 42 10.092 -2.430 -13.678 1.00 0.00 H new ATOM 0 HA GLU B 42 11.417 -4.114 -15.674 1.00 0.00 H new ATOM 0 HB2 GLU B 42 13.156 -4.761 -14.040 1.00 0.00 H new ATOM 0 HB3 GLU B 42 13.276 -3.059 -14.440 1.00 0.00 H new ATOM 0 HG2 GLU B 42 12.044 -2.473 -12.347 1.00 0.00 H new ATOM 0 HG3 GLU B 42 11.900 -4.173 -11.949 1.00 0.00 H new ATOM 3067 N GLN B 43 10.932 -6.199 -14.017 1.00 0.00 N ATOM 3068 CA GLN B 43 10.251 -7.386 -13.512 1.00 0.00 C ATOM 3069 C GLN B 43 9.945 -7.273 -12.015 1.00 0.00 C ATOM 3070 O GLN B 43 10.329 -6.304 -11.362 1.00 0.00 O ATOM 3071 CB GLN B 43 11.115 -8.622 -13.790 1.00 0.00 C ATOM 3072 CG GLN B 43 11.228 -8.930 -15.287 1.00 0.00 C ATOM 3073 CD GLN B 43 12.057 -7.908 -16.059 1.00 0.00 C ATOM 3074 OE1 GLN B 43 13.032 -7.362 -15.547 1.00 0.00 O ATOM 3075 NE2 GLN B 43 11.677 -7.635 -17.303 1.00 0.00 N ATOM 0 H GLN B 43 11.863 -6.399 -14.383 1.00 0.00 H new ATOM 0 HA GLN B 43 9.296 -7.480 -14.029 1.00 0.00 H new ATOM 0 HB2 GLN B 43 12.112 -8.466 -13.378 1.00 0.00 H new ATOM 0 HB3 GLN B 43 10.689 -9.483 -13.276 1.00 0.00 H new ATOM 0 HG2 GLN B 43 11.673 -9.917 -15.414 1.00 0.00 H new ATOM 0 HG3 GLN B 43 10.227 -8.974 -15.717 1.00 0.00 H new ATOM 0 HE21 GLN B 43 10.864 -8.103 -17.702 1.00 0.00 H new ATOM 0 HE22 GLN B 43 12.199 -6.957 -17.858 1.00 0.00 H new ATOM 3084 N VAL B 44 9.246 -8.275 -11.469 1.00 0.00 N ATOM 3085 CA VAL B 44 8.783 -8.257 -10.087 1.00 0.00 C ATOM 3086 C VAL B 44 9.040 -9.600 -9.404 1.00 0.00 C ATOM 3087 O VAL B 44 9.144 -10.624 -10.081 1.00 0.00 O ATOM 3088 CB VAL B 44 7.284 -7.924 -10.052 1.00 0.00 C ATOM 3089 CG1 VAL B 44 7.020 -6.579 -10.713 1.00 0.00 C ATOM 3090 CG2 VAL B 44 6.446 -8.986 -10.764 1.00 0.00 C ATOM 0 H VAL B 44 8.988 -9.120 -11.979 1.00 0.00 H new ATOM 0 HA VAL B 44 9.339 -7.492 -9.544 1.00 0.00 H new ATOM 0 HB VAL B 44 6.995 -7.893 -9.002 1.00 0.00 H new ATOM 0 HG11 VAL B 44 5.953 -6.360 -10.679 1.00 0.00 H new ATOM 0 HG12 VAL B 44 7.568 -5.800 -10.183 1.00 0.00 H new ATOM 0 HG13 VAL B 44 7.350 -6.613 -11.751 1.00 0.00 H new ATOM 0 HG21 VAL B 44 5.392 -8.711 -10.715 1.00 0.00 H new ATOM 0 HG22 VAL B 44 6.755 -9.055 -11.807 1.00 0.00 H new ATOM 0 HG23 VAL B 44 6.592 -9.951 -10.278 1.00 0.00 H new ATOM 3100 N PRO B 45 9.143 -9.617 -8.065 1.00 0.00 N ATOM 3101 CA PRO B 45 9.307 -10.830 -7.281 1.00 0.00 C ATOM 3102 C PRO B 45 8.110 -11.772 -7.405 1.00 0.00 C ATOM 3103 O PRO B 45 7.112 -11.451 -8.047 1.00 0.00 O ATOM 3104 CB PRO B 45 9.454 -10.369 -5.827 1.00 0.00 C ATOM 3105 CG PRO B 45 9.839 -8.898 -5.929 1.00 0.00 C ATOM 3106 CD PRO B 45 9.119 -8.452 -7.197 1.00 0.00 C ATOM 0 HA PRO B 45 10.172 -11.391 -7.636 1.00 0.00 H new ATOM 0 HB2 PRO B 45 8.524 -10.498 -5.274 1.00 0.00 H new ATOM 0 HB3 PRO B 45 10.218 -10.944 -5.304 1.00 0.00 H new ATOM 0 HG2 PRO B 45 9.512 -8.332 -5.057 1.00 0.00 H new ATOM 0 HG3 PRO B 45 10.918 -8.766 -6.008 1.00 0.00 H new ATOM 0 HD2 PRO B 45 8.097 -8.139 -6.983 1.00 0.00 H new ATOM 0 HD3 PRO B 45 9.622 -7.603 -7.660 1.00 0.00 H new ATOM 3114 N ASP B 46 8.220 -12.944 -6.775 1.00 0.00 N ATOM 3115 CA ASP B 46 7.125 -13.900 -6.681 1.00 0.00 C ATOM 3116 C ASP B 46 7.194 -14.702 -5.378 1.00 0.00 C ATOM 3117 O ASP B 46 6.318 -15.525 -5.112 1.00 0.00 O ATOM 3118 CB ASP B 46 7.161 -14.838 -7.887 1.00 0.00 C ATOM 3119 CG ASP B 46 8.437 -15.680 -7.917 1.00 0.00 C ATOM 3120 OD1 ASP B 46 9.459 -15.169 -8.427 1.00 0.00 O ATOM 3121 OD2 ASP B 46 8.383 -16.830 -7.428 1.00 0.00 O ATOM 0 H ASP B 46 9.076 -13.254 -6.315 1.00 0.00 H new ATOM 0 HA ASP B 46 6.185 -13.349 -6.678 1.00 0.00 H new ATOM 0 HB2 ASP B 46 6.292 -15.496 -7.861 1.00 0.00 H new ATOM 0 HB3 ASP B 46 7.090 -14.253 -8.804 1.00 0.00 H new ATOM 3126 N GLU B 47 8.226 -14.471 -4.558 1.00 0.00 N ATOM 3127 CA GLU B 47 8.413 -15.192 -3.308 1.00 0.00 C ATOM 3128 C GLU B 47 7.298 -14.885 -2.314 1.00 0.00 C ATOM 3129 O GLU B 47 7.013 -15.689 -1.430 1.00 0.00 O ATOM 3130 CB GLU B 47 9.778 -14.822 -2.717 1.00 0.00 C ATOM 3131 CG GLU B 47 9.860 -13.344 -2.325 1.00 0.00 C ATOM 3132 CD GLU B 47 11.290 -12.967 -1.951 1.00 0.00 C ATOM 3133 OE1 GLU B 47 11.734 -13.395 -0.864 1.00 0.00 O ATOM 3134 OE2 GLU B 47 11.932 -12.255 -2.755 1.00 0.00 O ATOM 0 H GLU B 47 8.950 -13.779 -4.748 1.00 0.00 H new ATOM 0 HA GLU B 47 8.378 -16.262 -3.511 1.00 0.00 H new ATOM 0 HB2 GLU B 47 9.971 -15.440 -1.840 1.00 0.00 H new ATOM 0 HB3 GLU B 47 10.559 -15.047 -3.443 1.00 0.00 H new ATOM 0 HG2 GLU B 47 9.519 -12.723 -3.153 1.00 0.00 H new ATOM 0 HG3 GLU B 47 9.195 -13.148 -1.484 1.00 0.00 H new ATOM 3141 N MET B 48 6.657 -13.720 -2.453 1.00 0.00 N ATOM 3142 CA MET B 48 5.590 -13.307 -1.558 1.00 0.00 C ATOM 3143 C MET B 48 4.297 -14.050 -1.872 1.00 0.00 C ATOM 3144 O MET B 48 3.543 -14.394 -0.965 1.00 0.00 O ATOM 3145 CB MET B 48 5.411 -11.799 -1.691 1.00 0.00 C ATOM 3146 CG MET B 48 6.525 -11.112 -0.904 1.00 0.00 C ATOM 3147 SD MET B 48 6.653 -9.337 -1.203 1.00 0.00 S ATOM 3148 CE MET B 48 7.583 -9.404 -2.755 1.00 0.00 C ATOM 0 H MET B 48 6.868 -13.045 -3.188 1.00 0.00 H new ATOM 0 HA MET B 48 5.852 -13.553 -0.529 1.00 0.00 H new ATOM 0 HB2 MET B 48 5.449 -11.503 -2.739 1.00 0.00 H new ATOM 0 HB3 MET B 48 4.435 -11.497 -1.310 1.00 0.00 H new ATOM 0 HG2 MET B 48 6.359 -11.279 0.160 1.00 0.00 H new ATOM 0 HG3 MET B 48 7.476 -11.581 -1.156 1.00 0.00 H new ATOM 0 HE1 MET B 48 7.691 -8.397 -3.158 1.00 0.00 H new ATOM 0 HE2 MET B 48 8.570 -9.828 -2.570 1.00 0.00 H new ATOM 0 HE3 MET B 48 7.049 -10.027 -3.473 1.00 0.00 H new ATOM 3158 N LEU B 49 4.018 -14.312 -3.152 1.00 0.00 N ATOM 3159 CA LEU B 49 2.851 -15.104 -3.502 1.00 0.00 C ATOM 3160 C LEU B 49 3.140 -16.583 -3.259 1.00 0.00 C ATOM 3161 O LEU B 49 2.217 -17.394 -3.209 1.00 0.00 O ATOM 3162 CB LEU B 49 2.446 -14.835 -4.954 1.00 0.00 C ATOM 3163 CG LEU B 49 1.789 -13.455 -5.099 1.00 0.00 C ATOM 3164 CD1 LEU B 49 1.508 -13.189 -6.578 1.00 0.00 C ATOM 3165 CD2 LEU B 49 0.465 -13.375 -4.338 1.00 0.00 C ATOM 0 H LEU B 49 4.576 -13.992 -3.944 1.00 0.00 H new ATOM 0 HA LEU B 49 2.011 -14.818 -2.869 1.00 0.00 H new ATOM 0 HB2 LEU B 49 3.325 -14.892 -5.596 1.00 0.00 H new ATOM 0 HB3 LEU B 49 1.755 -15.607 -5.291 1.00 0.00 H new ATOM 0 HG LEU B 49 2.474 -12.714 -4.686 1.00 0.00 H new ATOM 0 HD11 LEU B 49 1.041 -12.210 -6.689 1.00 0.00 H new ATOM 0 HD12 LEU B 49 2.444 -13.210 -7.136 1.00 0.00 H new ATOM 0 HD13 LEU B 49 0.838 -13.957 -6.965 1.00 0.00 H new ATOM 0 HD21 LEU B 49 0.031 -12.383 -4.465 1.00 0.00 H new ATOM 0 HD22 LEU B 49 -0.224 -14.125 -4.727 1.00 0.00 H new ATOM 0 HD23 LEU B 49 0.643 -13.560 -3.279 1.00 0.00 H new ATOM 3177 N ASP B 50 4.416 -16.955 -3.100 1.00 0.00 N ATOM 3178 CA ASP B 50 4.755 -18.313 -2.718 1.00 0.00 C ATOM 3179 C ASP B 50 4.363 -18.551 -1.262 1.00 0.00 C ATOM 3180 O ASP B 50 4.188 -19.691 -0.840 1.00 0.00 O ATOM 3181 CB ASP B 50 6.245 -18.574 -2.944 1.00 0.00 C ATOM 3182 CG ASP B 50 6.563 -20.059 -2.790 1.00 0.00 C ATOM 3183 OD1 ASP B 50 5.894 -20.864 -3.476 1.00 0.00 O ATOM 3184 OD2 ASP B 50 7.478 -20.374 -1.996 1.00 0.00 O ATOM 0 H ASP B 50 5.216 -16.336 -3.230 1.00 0.00 H new ATOM 0 HA ASP B 50 4.199 -19.013 -3.342 1.00 0.00 H new ATOM 0 HB2 ASP B 50 6.531 -18.237 -3.940 1.00 0.00 H new ATOM 0 HB3 ASP B 50 6.833 -17.995 -2.231 1.00 0.00 H new ATOM 3189 N LEU B 51 4.222 -17.470 -0.488 1.00 0.00 N ATOM 3190 CA LEU B 51 3.711 -17.556 0.874 1.00 0.00 C ATOM 3191 C LEU B 51 2.219 -17.868 0.862 1.00 0.00 C ATOM 3192 O LEU B 51 1.667 -18.242 1.891 1.00 0.00 O ATOM 3193 CB LEU B 51 3.936 -16.236 1.615 1.00 0.00 C ATOM 3194 CG LEU B 51 5.381 -15.750 1.532 1.00 0.00 C ATOM 3195 CD1 LEU B 51 5.486 -14.403 2.233 1.00 0.00 C ATOM 3196 CD2 LEU B 51 6.337 -16.744 2.181 1.00 0.00 C ATOM 0 H LEU B 51 4.457 -16.524 -0.788 1.00 0.00 H new ATOM 0 HA LEU B 51 4.248 -18.355 1.385 1.00 0.00 H new ATOM 0 HB2 LEU B 51 3.277 -15.474 1.199 1.00 0.00 H new ATOM 0 HB3 LEU B 51 3.659 -16.360 2.662 1.00 0.00 H new ATOM 0 HG LEU B 51 5.660 -15.655 0.483 1.00 0.00 H new ATOM 0 HD11 LEU B 51 6.514 -14.045 2.181 1.00 0.00 H new ATOM 0 HD12 LEU B 51 4.827 -13.686 1.744 1.00 0.00 H new ATOM 0 HD13 LEU B 51 5.193 -14.512 3.277 1.00 0.00 H new ATOM 0 HD21 LEU B 51 7.358 -16.369 2.106 1.00 0.00 H new ATOM 0 HD22 LEU B 51 6.073 -16.870 3.231 1.00 0.00 H new ATOM 0 HD23 LEU B 51 6.264 -17.705 1.671 1.00 0.00 H new ATOM 3208 N LEU B 52 1.560 -17.718 -0.294 1.00 0.00 N ATOM 3209 CA LEU B 52 0.162 -18.098 -0.428 1.00 0.00 C ATOM 3210 C LEU B 52 0.018 -19.551 -0.866 1.00 0.00 C ATOM 3211 O LEU B 52 -1.060 -20.126 -0.732 1.00 0.00 O ATOM 3212 CB LEU B 52 -0.553 -17.187 -1.425 1.00 0.00 C ATOM 3213 CG LEU B 52 -0.557 -15.718 -1.004 1.00 0.00 C ATOM 3214 CD1 LEU B 52 -1.530 -14.987 -1.923 1.00 0.00 C ATOM 3215 CD2 LEU B 52 -1.033 -15.539 0.438 1.00 0.00 C ATOM 0 H LEU B 52 1.977 -17.337 -1.143 1.00 0.00 H new ATOM 0 HA LEU B 52 -0.299 -17.987 0.553 1.00 0.00 H new ATOM 0 HB2 LEU B 52 -0.072 -17.278 -2.399 1.00 0.00 H new ATOM 0 HB3 LEU B 52 -1.582 -17.527 -1.544 1.00 0.00 H new ATOM 0 HG LEU B 52 0.458 -15.327 -1.074 1.00 0.00 H new ATOM 0 HD11 LEU B 52 -1.561 -13.931 -1.654 1.00 0.00 H new ATOM 0 HD12 LEU B 52 -1.200 -15.088 -2.957 1.00 0.00 H new ATOM 0 HD13 LEU B 52 -2.525 -15.418 -1.816 1.00 0.00 H new ATOM 0 HD21 LEU B 52 -1.020 -14.480 0.697 1.00 0.00 H new ATOM 0 HD22 LEU B 52 -2.048 -15.925 0.537 1.00 0.00 H new ATOM 0 HD23 LEU B 52 -0.371 -16.084 1.110 1.00 0.00 H new ATOM 3227 N ASN B 53 1.093 -20.155 -1.382 1.00 0.00 N ATOM 3228 CA ASN B 53 1.081 -21.549 -1.800 1.00 0.00 C ATOM 3229 C ASN B 53 1.017 -22.510 -0.603 1.00 0.00 C ATOM 3230 O ASN B 53 1.336 -23.690 -0.742 1.00 0.00 O ATOM 3231 CB ASN B 53 2.290 -21.836 -2.696 1.00 0.00 C ATOM 3232 CG ASN B 53 2.155 -21.162 -4.052 1.00 0.00 C ATOM 3233 OD1 ASN B 53 1.053 -20.979 -4.563 1.00 0.00 O ATOM 3234 ND2 ASN B 53 3.275 -20.781 -4.659 1.00 0.00 N ATOM 0 H ASN B 53 1.990 -19.688 -1.519 1.00 0.00 H new ATOM 0 HA ASN B 53 0.173 -21.723 -2.378 1.00 0.00 H new ATOM 0 HB2 ASN B 53 3.198 -21.487 -2.205 1.00 0.00 H new ATOM 0 HB3 ASN B 53 2.395 -22.912 -2.833 1.00 0.00 H new ATOM 0 HD21 ASN B 53 3.231 -20.325 -5.570 1.00 0.00 H new ATOM 0 HD22 ASN B 53 4.178 -20.945 -4.213 1.00 0.00 H new ATOM 3241 N LYS B 54 0.609 -22.011 0.570 1.00 0.00 N ATOM 3242 CA LYS B 54 0.465 -22.818 1.778 1.00 0.00 C ATOM 3243 C LYS B 54 -0.856 -22.540 2.496 1.00 0.00 C ATOM 3244 O LYS B 54 -1.100 -23.108 3.555 1.00 0.00 O ATOM 3245 CB LYS B 54 1.670 -22.593 2.704 1.00 0.00 C ATOM 3246 CG LYS B 54 1.797 -21.119 3.096 1.00 0.00 C ATOM 3247 CD LYS B 54 2.962 -20.890 4.061 1.00 0.00 C ATOM 3248 CE LYS B 54 3.054 -19.399 4.402 1.00 0.00 C ATOM 3249 NZ LYS B 54 4.165 -19.124 5.334 1.00 0.00 N ATOM 0 H LYS B 54 0.369 -21.029 0.704 1.00 0.00 H new ATOM 0 HA LYS B 54 0.442 -23.868 1.486 1.00 0.00 H new ATOM 0 HB2 LYS B 54 1.562 -23.203 3.601 1.00 0.00 H new ATOM 0 HB3 LYS B 54 2.582 -22.919 2.205 1.00 0.00 H new ATOM 0 HG2 LYS B 54 1.942 -20.515 2.200 1.00 0.00 H new ATOM 0 HG3 LYS B 54 0.869 -20.784 3.559 1.00 0.00 H new ATOM 0 HD2 LYS B 54 2.816 -21.474 4.970 1.00 0.00 H new ATOM 0 HD3 LYS B 54 3.894 -21.230 3.610 1.00 0.00 H new ATOM 0 HE2 LYS B 54 3.195 -18.824 3.487 1.00 0.00 H new ATOM 0 HE3 LYS B 54 2.115 -19.068 4.846 1.00 0.00 H new ATOM 0 HZ1 LYS B 54 4.198 -18.106 5.544 1.00 0.00 H new ATOM 0 HZ2 LYS B 54 4.017 -19.654 6.216 1.00 0.00 H new ATOM 0 HZ3 LYS B 54 5.063 -19.418 4.900 1.00 0.00 H new ATOM 3263 N LEU B 55 -1.715 -21.676 1.937 1.00 0.00 N ATOM 3264 CA LEU B 55 -3.030 -21.413 2.513 1.00 0.00 C ATOM 3265 C LEU B 55 -4.067 -20.965 1.480 1.00 0.00 C ATOM 3266 O LEU B 55 -5.230 -20.778 1.840 1.00 0.00 O ATOM 3267 CB LEU B 55 -2.942 -20.370 3.638 1.00 0.00 C ATOM 3268 CG LEU B 55 -2.665 -18.943 3.146 1.00 0.00 C ATOM 3269 CD1 LEU B 55 -3.124 -17.951 4.213 1.00 0.00 C ATOM 3270 CD2 LEU B 55 -1.177 -18.725 2.900 1.00 0.00 C ATOM 0 H LEU B 55 -1.517 -21.150 1.086 1.00 0.00 H new ATOM 0 HA LEU B 55 -3.368 -22.366 2.919 1.00 0.00 H new ATOM 0 HB2 LEU B 55 -3.877 -20.375 4.198 1.00 0.00 H new ATOM 0 HB3 LEU B 55 -2.154 -20.664 4.331 1.00 0.00 H new ATOM 0 HG LEU B 55 -3.205 -18.793 2.211 1.00 0.00 H new ATOM 0 HD11 LEU B 55 -2.931 -16.934 3.872 1.00 0.00 H new ATOM 0 HD12 LEU B 55 -4.192 -18.077 4.392 1.00 0.00 H new ATOM 0 HD13 LEU B 55 -2.577 -18.133 5.138 1.00 0.00 H new ATOM 0 HD21 LEU B 55 -1.011 -17.705 2.552 1.00 0.00 H new ATOM 0 HD22 LEU B 55 -0.627 -18.886 3.827 1.00 0.00 H new ATOM 0 HD23 LEU B 55 -0.826 -19.428 2.144 1.00 0.00 H new ATOM 3282 N ALA B 56 -3.679 -20.794 0.211 1.00 0.00 N ATOM 3283 CA ALA B 56 -4.602 -20.337 -0.818 1.00 0.00 C ATOM 3284 C ALA B 56 -4.513 -21.185 -2.089 1.00 0.00 C ATOM 3285 O ALA B 56 -5.231 -20.919 -3.056 1.00 0.00 O ATOM 3286 CB ALA B 56 -4.312 -18.867 -1.121 1.00 0.00 C ATOM 0 H ALA B 56 -2.730 -20.967 -0.122 1.00 0.00 H new ATOM 0 HA ALA B 56 -5.621 -20.445 -0.446 1.00 0.00 H new ATOM 0 HB1 ALA B 56 -4.997 -18.512 -1.891 1.00 0.00 H new ATOM 0 HB2 ALA B 56 -4.446 -18.276 -0.215 1.00 0.00 H new ATOM 0 HB3 ALA B 56 -3.286 -18.764 -1.473 1.00 0.00 H new