USER MOD reduce.3.24.130724 H: found=0, std=0, add=922, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 922 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 9 HIS : no HD1:sc= -0.0139 X(o=-0.014,f=-0.35) USER MOD Single : A 11 THR OG1 : rot 180:sc= 0 USER MOD Single : A 18 SER OG : rot 180:sc=-0.00633 USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 30 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 31 MET CE :methyl -136:sc= -6.19! (180deg=-12.4!) USER MOD Single : A 34 TYR OH : rot 95:sc= 0.00664 USER MOD Single : A 36 GLN : amide:sc= -2.42 K(o=-2.4,f=-8.6!) USER MOD Single : A 38 THR OG1 : rot 180:sc= -0.0212 USER MOD Single : A 39 CYS SG : rot -32:sc= -4.69! USER MOD Single : A 41 THR OG1 : rot 180:sc= 0 USER MOD Single : A 42 GLN : amide:sc= -0.0219 X(o=-0.022,f=-0.059) USER MOD Single : A 44 GLN : amide:sc= -0.363 X(o=-0.36,f=-0.082) USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 SER OG : rot 138:sc= 1.42 USER MOD Single : A 47 ASN : amide:sc= -1.8 X(o=-1.8,f=-1.8) USER MOD Single : A 52 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 54 THR OG1 : rot 180:sc= 0.0087 USER MOD Single : A 55 THR OG1 : rot 180:sc= 0 USER MOD Single : A 59 ASN : amide:sc= -2.7! C(o=-2.7!,f=-2.4!) USER MOD Single : A 61 THR OG1 : rot 180:sc= -0.648 USER MOD Single : A 65 THR OG1 : rot 180:sc= 0 USER MOD Single : A 67 SER OG : rot -140:sc= 0.775 USER MOD Single : A 70 THR OG1 : rot -160:sc= -1.28 USER MOD Single : A 71 THR OG1 : rot 180:sc= 0 USER MOD Single : A 74 LYS NZ :NH3+ -168:sc= 0.00537 (180deg=0.000482) USER MOD Single : A 76 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.0297) USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 THR OG1 : rot 180:sc= -0.0856 USER MOD Single : A 93 THR OG1 : rot 180:sc= 0 USER MOD Single : A 104 SER OG : rot 44:sc= 0.0162 USER MOD Single : A 108 THR OG1 : rot 180:sc= 0 USER MOD Single : A 110 TYR OH : rot 180:sc= 0 USER MOD Single : A 111 ASN : amide:sc= -0.293! C(o=-0.29!,f=-6.5!) USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 TYR OH : rot 180:sc= 0 USER MOD Single : A 119 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 127 SER OG : rot 180:sc= 0 USER MOD Single : A 129 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 131 SER OG : rot 54:sc= 0.0207 USER MOD ----------------------------------------------------------------- ATOM 59 N GLY A 7 -9.922 19.691 -1.881 1.00 0.00 N ATOM 60 CA GLY A 7 -8.685 19.059 -1.454 1.00 0.00 C ATOM 61 C GLY A 7 -7.532 19.422 -2.392 1.00 0.00 C ATOM 62 O GLY A 7 -7.642 20.357 -3.184 1.00 0.00 O ATOM 0 HA2 GLY A 7 -8.444 19.372 -0.438 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -8.814 17.977 -1.432 1.00 0.00 H new ATOM 66 N PRO A 8 -6.424 18.643 -2.269 1.00 0.00 N ATOM 67 CA PRO A 8 -5.252 18.873 -3.096 1.00 0.00 C ATOM 68 C PRO A 8 -5.484 18.377 -4.525 1.00 0.00 C ATOM 69 O PRO A 8 -6.620 18.121 -4.921 1.00 0.00 O ATOM 70 CB PRO A 8 -4.122 18.141 -2.390 1.00 0.00 C ATOM 71 CG PRO A 8 -4.790 17.149 -1.453 1.00 0.00 C ATOM 72 CD PRO A 8 -6.258 17.527 -1.342 1.00 0.00 C ATOM 0 HA PRO A 8 -5.016 19.931 -3.206 1.00 0.00 H new ATOM 0 HB2 PRO A 8 -3.480 17.630 -3.107 1.00 0.00 H new ATOM 0 HB3 PRO A 8 -3.491 18.837 -1.837 1.00 0.00 H new ATOM 0 HG2 PRO A 8 -4.685 16.133 -1.835 1.00 0.00 H new ATOM 0 HG3 PRO A 8 -4.315 17.171 -0.472 1.00 0.00 H new ATOM 0 HD2 PRO A 8 -6.904 16.691 -1.609 1.00 0.00 H new ATOM 0 HD3 PRO A 8 -6.517 17.816 -0.323 1.00 0.00 H new ATOM 80 N HIS A 9 -4.388 18.258 -5.261 1.00 0.00 N ATOM 81 CA HIS A 9 -4.458 17.797 -6.637 1.00 0.00 C ATOM 82 C HIS A 9 -3.049 17.481 -7.145 1.00 0.00 C ATOM 83 O HIS A 9 -2.098 18.197 -6.833 1.00 0.00 O ATOM 84 CB HIS A 9 -5.189 18.816 -7.514 1.00 0.00 C ATOM 85 CG HIS A 9 -4.840 20.253 -7.208 1.00 0.00 C ATOM 86 ND1 HIS A 9 -5.592 21.042 -6.355 1.00 0.00 N ATOM 87 CD2 HIS A 9 -3.812 21.034 -7.649 1.00 0.00 C ATOM 88 CE1 HIS A 9 -5.033 22.241 -6.294 1.00 0.00 C ATOM 89 NE2 HIS A 9 -3.931 22.235 -7.097 1.00 0.00 N ATOM 0 H HIS A 9 -3.447 18.473 -4.930 1.00 0.00 H new ATOM 0 HA HIS A 9 -5.040 16.877 -6.687 1.00 0.00 H new ATOM 0 HB2 HIS A 9 -4.958 18.612 -8.560 1.00 0.00 H new ATOM 0 HB3 HIS A 9 -6.264 18.680 -7.392 1.00 0.00 H new ATOM 0 HD2 HIS A 9 -3.033 20.727 -8.332 1.00 0.00 H new ATOM 0 HE1 HIS A 9 -5.388 23.077 -5.710 1.00 0.00 H new ATOM 0 HE2 HIS A 9 -3.302 23.023 -7.248 1.00 0.00 H new ATOM 97 N GLY A 10 -2.960 16.409 -7.918 1.00 0.00 N ATOM 98 CA GLY A 10 -1.684 15.989 -8.471 1.00 0.00 C ATOM 99 C GLY A 10 -1.624 14.467 -8.618 1.00 0.00 C ATOM 100 O GLY A 10 -2.652 13.794 -8.569 1.00 0.00 O ATOM 0 H GLY A 10 -3.751 15.818 -8.175 1.00 0.00 H new ATOM 0 HA2 GLY A 10 -1.533 16.458 -9.443 1.00 0.00 H new ATOM 0 HA3 GLY A 10 -0.874 16.328 -7.825 1.00 0.00 H new ATOM 104 N THR A 11 -0.409 13.970 -8.795 1.00 0.00 N ATOM 105 CA THR A 11 -0.201 12.540 -8.950 1.00 0.00 C ATOM 106 C THR A 11 0.326 11.934 -7.647 1.00 0.00 C ATOM 107 O THR A 11 0.925 12.632 -6.831 1.00 0.00 O ATOM 108 CB THR A 11 0.733 12.324 -10.142 1.00 0.00 C ATOM 109 OG1 THR A 11 -0.147 12.026 -11.223 1.00 0.00 O ATOM 110 CG2 THR A 11 1.585 11.062 -9.997 1.00 0.00 C ATOM 0 H THR A 11 0.442 14.532 -8.835 1.00 0.00 H new ATOM 0 HA THR A 11 -1.139 12.024 -9.156 1.00 0.00 H new ATOM 0 HB THR A 11 1.384 13.191 -10.254 1.00 0.00 H new ATOM 0 HG1 THR A 11 0.376 11.873 -12.038 1.00 0.00 H new ATOM 0 HG21 THR A 11 2.230 10.956 -10.870 1.00 0.00 H new ATOM 0 HG22 THR A 11 2.199 11.139 -9.100 1.00 0.00 H new ATOM 0 HG23 THR A 11 0.935 10.191 -9.918 1.00 0.00 H new ATOM 118 N LEU A 12 0.083 10.640 -7.493 1.00 0.00 N ATOM 119 CA LEU A 12 0.525 9.932 -6.304 1.00 0.00 C ATOM 120 C LEU A 12 1.585 8.900 -6.695 1.00 0.00 C ATOM 121 O LEU A 12 1.462 8.239 -7.725 1.00 0.00 O ATOM 122 CB LEU A 12 -0.670 9.334 -5.560 1.00 0.00 C ATOM 123 CG LEU A 12 -0.341 8.299 -4.483 1.00 0.00 C ATOM 124 CD1 LEU A 12 0.252 7.032 -5.103 1.00 0.00 C ATOM 125 CD2 LEU A 12 0.574 8.895 -3.411 1.00 0.00 C ATOM 0 H LEU A 12 -0.414 10.064 -8.172 1.00 0.00 H new ATOM 0 HA LEU A 12 0.994 10.622 -5.603 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -1.227 10.147 -5.096 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -1.332 8.870 -6.291 1.00 0.00 H new ATOM 0 HG LEU A 12 -1.270 8.012 -3.990 1.00 0.00 H new ATOM 0 HD11 LEU A 12 0.477 6.313 -4.316 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -0.466 6.597 -5.798 1.00 0.00 H new ATOM 0 HD13 LEU A 12 1.168 7.283 -5.638 1.00 0.00 H new ATOM 0 HD21 LEU A 12 0.792 8.138 -2.657 1.00 0.00 H new ATOM 0 HD22 LEU A 12 1.504 9.228 -3.871 1.00 0.00 H new ATOM 0 HD23 LEU A 12 0.078 9.744 -2.940 1.00 0.00 H new ATOM 137 N GLU A 13 2.602 8.795 -5.852 1.00 0.00 N ATOM 138 CA GLU A 13 3.683 7.855 -6.097 1.00 0.00 C ATOM 139 C GLU A 13 3.885 6.951 -4.879 1.00 0.00 C ATOM 140 O GLU A 13 4.359 7.402 -3.838 1.00 0.00 O ATOM 141 CB GLU A 13 4.976 8.588 -6.456 1.00 0.00 C ATOM 142 CG GLU A 13 6.030 7.613 -6.986 1.00 0.00 C ATOM 143 CD GLU A 13 7.360 7.791 -6.253 1.00 0.00 C ATOM 144 OE1 GLU A 13 7.421 7.371 -5.077 1.00 0.00 O ATOM 145 OE2 GLU A 13 8.287 8.344 -6.884 1.00 0.00 O ATOM 0 H GLU A 13 2.700 9.345 -4.999 1.00 0.00 H new ATOM 0 HA GLU A 13 3.410 7.231 -6.948 1.00 0.00 H new ATOM 0 HB2 GLU A 13 4.770 9.350 -7.208 1.00 0.00 H new ATOM 0 HB3 GLU A 13 5.362 9.104 -5.577 1.00 0.00 H new ATOM 0 HG2 GLU A 13 5.677 6.589 -6.863 1.00 0.00 H new ATOM 0 HG3 GLU A 13 6.175 7.774 -8.054 1.00 0.00 H new ATOM 152 N VAL A 14 3.515 5.690 -5.050 1.00 0.00 N ATOM 153 CA VAL A 14 3.650 4.718 -3.979 1.00 0.00 C ATOM 154 C VAL A 14 4.931 3.909 -4.188 1.00 0.00 C ATOM 155 O VAL A 14 5.277 3.568 -5.319 1.00 0.00 O ATOM 156 CB VAL A 14 2.396 3.844 -3.903 1.00 0.00 C ATOM 157 CG1 VAL A 14 2.649 2.595 -3.057 1.00 0.00 C ATOM 158 CG2 VAL A 14 1.205 4.640 -3.366 1.00 0.00 C ATOM 0 H VAL A 14 3.122 5.319 -5.915 1.00 0.00 H new ATOM 0 HA VAL A 14 3.737 5.221 -3.016 1.00 0.00 H new ATOM 0 HB VAL A 14 2.152 3.519 -4.914 1.00 0.00 H new ATOM 0 HG11 VAL A 14 1.742 1.991 -3.019 1.00 0.00 H new ATOM 0 HG12 VAL A 14 3.455 2.011 -3.502 1.00 0.00 H new ATOM 0 HG13 VAL A 14 2.930 2.891 -2.046 1.00 0.00 H new ATOM 0 HG21 VAL A 14 0.327 3.996 -3.322 1.00 0.00 H new ATOM 0 HG22 VAL A 14 1.435 5.009 -2.366 1.00 0.00 H new ATOM 0 HG23 VAL A 14 1.003 5.483 -4.026 1.00 0.00 H new ATOM 168 N VAL A 15 5.602 3.624 -3.081 1.00 0.00 N ATOM 169 CA VAL A 15 6.837 2.861 -3.129 1.00 0.00 C ATOM 170 C VAL A 15 6.754 1.700 -2.136 1.00 0.00 C ATOM 171 O VAL A 15 7.091 1.857 -0.964 1.00 0.00 O ATOM 172 CB VAL A 15 8.031 3.783 -2.873 1.00 0.00 C ATOM 173 CG1 VAL A 15 9.331 2.981 -2.778 1.00 0.00 C ATOM 174 CG2 VAL A 15 8.131 4.863 -3.951 1.00 0.00 C ATOM 0 H VAL A 15 5.313 3.908 -2.145 1.00 0.00 H new ATOM 0 HA VAL A 15 6.982 2.430 -4.120 1.00 0.00 H new ATOM 0 HB VAL A 15 7.872 4.280 -1.916 1.00 0.00 H new ATOM 0 HG11 VAL A 15 10.165 3.659 -2.596 1.00 0.00 H new ATOM 0 HG12 VAL A 15 9.259 2.267 -1.958 1.00 0.00 H new ATOM 0 HG13 VAL A 15 9.497 2.445 -3.713 1.00 0.00 H new ATOM 0 HG21 VAL A 15 8.988 5.504 -3.745 1.00 0.00 H new ATOM 0 HG22 VAL A 15 8.256 4.393 -4.926 1.00 0.00 H new ATOM 0 HG23 VAL A 15 7.221 5.463 -3.951 1.00 0.00 H new ATOM 184 N LEU A 16 6.302 0.562 -2.642 1.00 0.00 N ATOM 185 CA LEU A 16 6.170 -0.625 -1.814 1.00 0.00 C ATOM 186 C LEU A 16 7.561 -1.108 -1.398 1.00 0.00 C ATOM 187 O LEU A 16 8.211 -1.849 -2.134 1.00 0.00 O ATOM 188 CB LEU A 16 5.339 -1.689 -2.532 1.00 0.00 C ATOM 189 CG LEU A 16 5.062 -2.970 -1.742 1.00 0.00 C ATOM 190 CD1 LEU A 16 4.291 -2.665 -0.457 1.00 0.00 C ATOM 191 CD2 LEU A 16 4.344 -4.005 -2.610 1.00 0.00 C ATOM 0 H LEU A 16 6.023 0.437 -3.615 1.00 0.00 H new ATOM 0 HA LEU A 16 5.626 -0.393 -0.899 1.00 0.00 H new ATOM 0 HB2 LEU A 16 4.384 -1.246 -2.814 1.00 0.00 H new ATOM 0 HB3 LEU A 16 5.851 -1.959 -3.456 1.00 0.00 H new ATOM 0 HG LEU A 16 6.018 -3.404 -1.448 1.00 0.00 H new ATOM 0 HD11 LEU A 16 4.107 -3.592 0.086 1.00 0.00 H new ATOM 0 HD12 LEU A 16 4.876 -1.989 0.167 1.00 0.00 H new ATOM 0 HD13 LEU A 16 3.339 -2.196 -0.706 1.00 0.00 H new ATOM 0 HD21 LEU A 16 4.159 -4.906 -2.024 1.00 0.00 H new ATOM 0 HD22 LEU A 16 3.395 -3.595 -2.955 1.00 0.00 H new ATOM 0 HD23 LEU A 16 4.966 -4.253 -3.470 1.00 0.00 H new ATOM 203 N VAL A 17 7.977 -0.669 -0.219 1.00 0.00 N ATOM 204 CA VAL A 17 9.278 -1.048 0.304 1.00 0.00 C ATOM 205 C VAL A 17 9.229 -2.501 0.780 1.00 0.00 C ATOM 206 O VAL A 17 9.558 -3.416 0.026 1.00 0.00 O ATOM 207 CB VAL A 17 9.704 -0.073 1.404 1.00 0.00 C ATOM 208 CG1 VAL A 17 11.023 -0.511 2.045 1.00 0.00 C ATOM 209 CG2 VAL A 17 9.805 1.354 0.863 1.00 0.00 C ATOM 0 H VAL A 17 7.436 -0.054 0.389 1.00 0.00 H new ATOM 0 HA VAL A 17 10.036 -0.988 -0.477 1.00 0.00 H new ATOM 0 HB VAL A 17 8.936 -0.085 2.177 1.00 0.00 H new ATOM 0 HG11 VAL A 17 11.303 0.199 2.823 1.00 0.00 H new ATOM 0 HG12 VAL A 17 10.903 -1.502 2.484 1.00 0.00 H new ATOM 0 HG13 VAL A 17 11.804 -0.543 1.285 1.00 0.00 H new ATOM 0 HG21 VAL A 17 10.109 2.026 1.665 1.00 0.00 H new ATOM 0 HG22 VAL A 17 10.543 1.388 0.061 1.00 0.00 H new ATOM 0 HG23 VAL A 17 8.835 1.666 0.476 1.00 0.00 H new ATOM 219 N SER A 18 8.815 -2.668 2.027 1.00 0.00 N ATOM 220 CA SER A 18 8.719 -3.995 2.612 1.00 0.00 C ATOM 221 C SER A 18 7.516 -4.065 3.556 1.00 0.00 C ATOM 222 O SER A 18 6.776 -3.092 3.697 1.00 0.00 O ATOM 223 CB SER A 18 10.002 -4.362 3.360 1.00 0.00 C ATOM 224 OG SER A 18 9.936 -4.007 4.739 1.00 0.00 O ATOM 0 H SER A 18 8.542 -1.907 2.649 1.00 0.00 H new ATOM 0 HA SER A 18 8.583 -4.715 1.805 1.00 0.00 H new ATOM 0 HB2 SER A 18 10.181 -5.433 3.270 1.00 0.00 H new ATOM 0 HB3 SER A 18 10.849 -3.857 2.896 1.00 0.00 H new ATOM 0 HG SER A 18 10.773 -4.259 5.182 1.00 0.00 H new ATOM 230 N ALA A 19 7.358 -5.224 4.177 1.00 0.00 N ATOM 231 CA ALA A 19 6.258 -5.433 5.103 1.00 0.00 C ATOM 232 C ALA A 19 6.680 -6.447 6.168 1.00 0.00 C ATOM 233 O ALA A 19 6.985 -7.596 5.852 1.00 0.00 O ATOM 234 CB ALA A 19 5.018 -5.884 4.328 1.00 0.00 C ATOM 0 H ALA A 19 7.973 -6.029 4.057 1.00 0.00 H new ATOM 0 HA ALA A 19 6.004 -4.504 5.614 1.00 0.00 H new ATOM 0 HB1 ALA A 19 4.192 -6.041 5.022 1.00 0.00 H new ATOM 0 HB2 ALA A 19 4.743 -5.117 3.604 1.00 0.00 H new ATOM 0 HB3 ALA A 19 5.235 -6.816 3.805 1.00 0.00 H new ATOM 240 N LYS A 20 6.684 -5.984 7.410 1.00 0.00 N ATOM 241 CA LYS A 20 7.063 -6.836 8.525 1.00 0.00 C ATOM 242 C LYS A 20 5.802 -7.391 9.190 1.00 0.00 C ATOM 243 O LYS A 20 4.787 -6.701 9.275 1.00 0.00 O ATOM 244 CB LYS A 20 7.984 -6.082 9.486 1.00 0.00 C ATOM 245 CG LYS A 20 9.451 -6.244 9.080 1.00 0.00 C ATOM 246 CD LYS A 20 10.176 -4.897 9.096 1.00 0.00 C ATOM 247 CE LYS A 20 11.445 -4.948 8.244 1.00 0.00 C ATOM 248 NZ LYS A 20 12.629 -4.581 9.053 1.00 0.00 N ATOM 0 H LYS A 20 6.431 -5.030 7.669 1.00 0.00 H new ATOM 0 HA LYS A 20 7.640 -7.691 8.172 1.00 0.00 H new ATOM 0 HB2 LYS A 20 7.720 -5.025 9.494 1.00 0.00 H new ATOM 0 HB3 LYS A 20 7.840 -6.454 10.500 1.00 0.00 H new ATOM 0 HG2 LYS A 20 9.946 -6.936 9.761 1.00 0.00 H new ATOM 0 HG3 LYS A 20 9.510 -6.681 8.083 1.00 0.00 H new ATOM 0 HD2 LYS A 20 9.512 -4.118 8.720 1.00 0.00 H new ATOM 0 HD3 LYS A 20 10.432 -4.630 10.121 1.00 0.00 H new ATOM 0 HE2 LYS A 20 11.574 -5.949 7.833 1.00 0.00 H new ATOM 0 HE3 LYS A 20 11.350 -4.267 7.398 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 13.481 -4.621 8.459 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 12.511 -3.617 9.424 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 12.728 -5.247 9.845 1.00 0.00 H new ATOM 262 N GLY A 21 5.907 -8.631 9.643 1.00 0.00 N ATOM 263 CA GLY A 21 4.787 -9.286 10.298 1.00 0.00 C ATOM 264 C GLY A 21 4.976 -9.307 11.816 1.00 0.00 C ATOM 265 O GLY A 21 5.657 -8.448 12.373 1.00 0.00 O ATOM 0 H GLY A 21 6.750 -9.200 9.570 1.00 0.00 H new ATOM 0 HA2 GLY A 21 3.862 -8.766 10.050 1.00 0.00 H new ATOM 0 HA3 GLY A 21 4.689 -10.306 9.926 1.00 0.00 H new ATOM 269 N LEU A 22 4.360 -10.299 12.443 1.00 0.00 N ATOM 270 CA LEU A 22 4.452 -10.444 13.886 1.00 0.00 C ATOM 271 C LEU A 22 5.091 -11.793 14.219 1.00 0.00 C ATOM 272 O LEU A 22 5.538 -12.510 13.325 1.00 0.00 O ATOM 273 CB LEU A 22 3.081 -10.236 14.533 1.00 0.00 C ATOM 274 CG LEU A 22 2.473 -8.840 14.384 1.00 0.00 C ATOM 275 CD1 LEU A 22 1.041 -8.806 14.919 1.00 0.00 C ATOM 276 CD2 LEU A 22 3.359 -7.783 15.049 1.00 0.00 C ATOM 0 H LEU A 22 3.795 -11.010 11.978 1.00 0.00 H new ATOM 0 HA LEU A 22 5.098 -9.673 14.306 1.00 0.00 H new ATOM 0 HB2 LEU A 22 2.387 -10.960 14.107 1.00 0.00 H new ATOM 0 HB3 LEU A 22 3.165 -10.462 15.596 1.00 0.00 H new ATOM 0 HG LEU A 22 2.425 -8.599 13.322 1.00 0.00 H new ATOM 0 HD11 LEU A 22 0.632 -7.802 14.801 1.00 0.00 H new ATOM 0 HD12 LEU A 22 0.428 -9.515 14.363 1.00 0.00 H new ATOM 0 HD13 LEU A 22 1.041 -9.076 15.975 1.00 0.00 H new ATOM 0 HD21 LEU A 22 2.905 -6.800 14.929 1.00 0.00 H new ATOM 0 HD22 LEU A 22 3.460 -8.009 16.111 1.00 0.00 H new ATOM 0 HD23 LEU A 22 4.344 -7.787 14.582 1.00 0.00 H new ATOM 288 N GLU A 23 5.116 -12.098 15.508 1.00 0.00 N ATOM 289 CA GLU A 23 5.693 -13.349 15.971 1.00 0.00 C ATOM 290 C GLU A 23 4.589 -14.313 16.410 1.00 0.00 C ATOM 291 O GLU A 23 4.822 -15.514 16.531 1.00 0.00 O ATOM 292 CB GLU A 23 6.692 -13.105 17.104 1.00 0.00 C ATOM 293 CG GLU A 23 6.049 -12.304 18.238 1.00 0.00 C ATOM 294 CD GLU A 23 6.234 -13.011 19.582 1.00 0.00 C ATOM 295 OE1 GLU A 23 6.034 -14.245 19.607 1.00 0.00 O ATOM 296 OE2 GLU A 23 6.571 -12.303 20.555 1.00 0.00 O ATOM 0 H GLU A 23 4.746 -11.500 16.247 1.00 0.00 H new ATOM 0 HA GLU A 23 6.237 -13.805 15.143 1.00 0.00 H new ATOM 0 HB2 GLU A 23 7.053 -14.059 17.487 1.00 0.00 H new ATOM 0 HB3 GLU A 23 7.559 -12.567 16.720 1.00 0.00 H new ATOM 0 HG2 GLU A 23 6.492 -11.309 18.282 1.00 0.00 H new ATOM 0 HG3 GLU A 23 4.986 -12.171 18.037 1.00 0.00 H new ATOM 303 N ASP A 24 3.411 -13.750 16.637 1.00 0.00 N ATOM 304 CA ASP A 24 2.271 -14.544 17.060 1.00 0.00 C ATOM 305 C ASP A 24 1.107 -14.314 16.093 1.00 0.00 C ATOM 306 O ASP A 24 -0.009 -14.023 16.519 1.00 0.00 O ATOM 307 CB ASP A 24 1.808 -14.141 18.461 1.00 0.00 C ATOM 308 CG ASP A 24 0.495 -14.780 18.917 1.00 0.00 C ATOM 309 OD1 ASP A 24 0.378 -16.014 18.757 1.00 0.00 O ATOM 310 OD2 ASP A 24 -0.362 -14.020 19.416 1.00 0.00 O ATOM 0 H ASP A 24 3.222 -12.753 16.536 1.00 0.00 H new ATOM 0 HA ASP A 24 2.574 -15.591 17.068 1.00 0.00 H new ATOM 0 HB2 ASP A 24 2.589 -14.403 19.175 1.00 0.00 H new ATOM 0 HB3 ASP A 24 1.697 -13.057 18.493 1.00 0.00 H new ATOM 315 N ALA A 25 1.409 -14.453 14.811 1.00 0.00 N ATOM 316 CA ALA A 25 0.402 -14.264 13.780 1.00 0.00 C ATOM 317 C ALA A 25 0.927 -14.814 12.453 1.00 0.00 C ATOM 318 O ALA A 25 1.703 -14.152 11.766 1.00 0.00 O ATOM 319 CB ALA A 25 0.035 -12.781 13.692 1.00 0.00 C ATOM 0 H ALA A 25 2.337 -14.694 14.462 1.00 0.00 H new ATOM 0 HA ALA A 25 -0.508 -14.812 14.027 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -0.720 -12.638 12.919 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -0.360 -12.446 14.651 1.00 0.00 H new ATOM 0 HB3 ALA A 25 0.923 -12.201 13.443 1.00 0.00 H new ATOM 325 N ASP A 26 0.482 -16.021 12.132 1.00 0.00 N ATOM 326 CA ASP A 26 0.897 -16.668 10.899 1.00 0.00 C ATOM 327 C ASP A 26 0.609 -15.739 9.719 1.00 0.00 C ATOM 328 O ASP A 26 -0.475 -15.783 9.139 1.00 0.00 O ATOM 329 CB ASP A 26 0.127 -17.970 10.675 1.00 0.00 C ATOM 330 CG ASP A 26 0.592 -19.152 11.528 1.00 0.00 C ATOM 331 OD1 ASP A 26 1.320 -18.891 12.511 1.00 0.00 O ATOM 332 OD2 ASP A 26 0.209 -20.290 11.179 1.00 0.00 O ATOM 0 H ASP A 26 -0.162 -16.567 12.705 1.00 0.00 H new ATOM 0 HA ASP A 26 1.962 -16.887 10.975 1.00 0.00 H new ATOM 0 HB2 ASP A 26 -0.929 -17.789 10.877 1.00 0.00 H new ATOM 0 HB3 ASP A 26 0.208 -18.246 9.624 1.00 0.00 H new ATOM 337 N PHE A 27 1.599 -14.919 9.397 1.00 0.00 N ATOM 338 CA PHE A 27 1.466 -13.980 8.296 1.00 0.00 C ATOM 339 C PHE A 27 2.791 -13.822 7.547 1.00 0.00 C ATOM 340 O PHE A 27 3.800 -13.440 8.138 1.00 0.00 O ATOM 341 CB PHE A 27 1.072 -12.632 8.902 1.00 0.00 C ATOM 342 CG PHE A 27 0.905 -11.512 7.873 1.00 0.00 C ATOM 343 CD1 PHE A 27 0.169 -11.724 6.750 1.00 0.00 C ATOM 344 CD2 PHE A 27 1.493 -10.304 8.082 1.00 0.00 C ATOM 345 CE1 PHE A 27 0.014 -10.685 5.795 1.00 0.00 C ATOM 346 CE2 PHE A 27 1.339 -9.264 7.127 1.00 0.00 C ATOM 347 CZ PHE A 27 0.602 -9.477 6.004 1.00 0.00 C ATOM 0 H PHE A 27 2.497 -14.886 9.880 1.00 0.00 H new ATOM 0 HA PHE A 27 0.720 -14.341 7.588 1.00 0.00 H new ATOM 0 HB2 PHE A 27 0.137 -12.751 9.449 1.00 0.00 H new ATOM 0 HB3 PHE A 27 1.830 -12.335 9.627 1.00 0.00 H new ATOM 0 HD1 PHE A 27 -0.298 -12.683 6.584 1.00 0.00 H new ATOM 0 HD2 PHE A 27 2.077 -10.135 8.974 1.00 0.00 H new ATOM 0 HE1 PHE A 27 -0.571 -10.854 4.903 1.00 0.00 H new ATOM 0 HE2 PHE A 27 1.807 -8.305 7.292 1.00 0.00 H new ATOM 0 HZ PHE A 27 0.484 -8.686 5.278 1.00 0.00 H new ATOM 357 N LEU A 28 2.744 -14.122 6.257 1.00 0.00 N ATOM 358 CA LEU A 28 3.929 -14.018 5.422 1.00 0.00 C ATOM 359 C LEU A 28 4.977 -15.023 5.902 1.00 0.00 C ATOM 360 O LEU A 28 6.117 -14.653 6.178 1.00 0.00 O ATOM 361 CB LEU A 28 4.433 -12.574 5.385 1.00 0.00 C ATOM 362 CG LEU A 28 3.360 -11.492 5.242 1.00 0.00 C ATOM 363 CD1 LEU A 28 3.975 -10.094 5.335 1.00 0.00 C ATOM 364 CD2 LEU A 28 2.560 -11.681 3.951 1.00 0.00 C ATOM 0 H LEU A 28 1.905 -14.437 5.770 1.00 0.00 H new ATOM 0 HA LEU A 28 3.691 -14.275 4.390 1.00 0.00 H new ATOM 0 HB2 LEU A 28 4.994 -12.383 6.300 1.00 0.00 H new ATOM 0 HB3 LEU A 28 5.133 -12.476 4.555 1.00 0.00 H new ATOM 0 HG LEU A 28 2.661 -11.592 6.072 1.00 0.00 H new ATOM 0 HD11 LEU A 28 3.191 -9.344 5.230 1.00 0.00 H new ATOM 0 HD12 LEU A 28 4.464 -9.975 6.302 1.00 0.00 H new ATOM 0 HD13 LEU A 28 4.709 -9.966 4.539 1.00 0.00 H new ATOM 0 HD21 LEU A 28 1.804 -10.899 3.874 1.00 0.00 H new ATOM 0 HD22 LEU A 28 3.232 -11.622 3.095 1.00 0.00 H new ATOM 0 HD23 LEU A 28 2.073 -12.656 3.964 1.00 0.00 H new ATOM 376 N ASN A 29 4.553 -16.276 5.987 1.00 0.00 N ATOM 377 CA ASN A 29 5.441 -17.337 6.429 1.00 0.00 C ATOM 378 C ASN A 29 5.472 -18.444 5.373 1.00 0.00 C ATOM 379 O ASN A 29 4.442 -19.040 5.064 1.00 0.00 O ATOM 380 CB ASN A 29 4.954 -17.952 7.743 1.00 0.00 C ATOM 381 CG ASN A 29 5.850 -19.116 8.170 1.00 0.00 C ATOM 382 OD1 ASN A 29 5.547 -20.278 7.954 1.00 0.00 O ATOM 383 ND2 ASN A 29 6.968 -18.741 8.785 1.00 0.00 N ATOM 0 H ASN A 29 3.607 -16.579 5.757 1.00 0.00 H new ATOM 0 HA ASN A 29 6.432 -16.907 6.577 1.00 0.00 H new ATOM 0 HB2 ASN A 29 4.944 -17.191 8.523 1.00 0.00 H new ATOM 0 HB3 ASN A 29 3.928 -18.302 7.627 1.00 0.00 H new ATOM 0 HD21 ASN A 29 7.633 -19.444 9.108 1.00 0.00 H new ATOM 0 HD22 ASN A 29 7.161 -17.750 8.934 1.00 0.00 H new ATOM 390 N ASN A 30 6.665 -18.684 4.849 1.00 0.00 N ATOM 391 CA ASN A 30 6.843 -19.709 3.833 1.00 0.00 C ATOM 392 C ASN A 30 5.714 -19.605 2.807 1.00 0.00 C ATOM 393 O ASN A 30 4.881 -20.505 2.701 1.00 0.00 O ATOM 394 CB ASN A 30 6.796 -21.108 4.449 1.00 0.00 C ATOM 395 CG ASN A 30 8.172 -21.524 4.973 1.00 0.00 C ATOM 396 OD1 ASN A 30 8.934 -22.211 4.314 1.00 0.00 O ATOM 397 ND2 ASN A 30 8.445 -21.070 6.193 1.00 0.00 N ATOM 0 H ASN A 30 7.517 -18.187 5.108 1.00 0.00 H new ATOM 0 HA ASN A 30 7.815 -19.554 3.364 1.00 0.00 H new ATOM 0 HB2 ASN A 30 6.072 -21.126 5.264 1.00 0.00 H new ATOM 0 HB3 ASN A 30 6.455 -21.826 3.703 1.00 0.00 H new ATOM 0 HD21 ASN A 30 9.338 -21.293 6.632 1.00 0.00 H new ATOM 0 HD22 ASN A 30 7.761 -20.499 6.690 1.00 0.00 H new ATOM 404 N MET A 31 5.721 -18.500 2.075 1.00 0.00 N ATOM 405 CA MET A 31 4.708 -18.268 1.061 1.00 0.00 C ATOM 406 C MET A 31 5.155 -17.184 0.077 1.00 0.00 C ATOM 407 O MET A 31 6.286 -16.705 0.148 1.00 0.00 O ATOM 408 CB MET A 31 3.401 -17.840 1.732 1.00 0.00 C ATOM 409 CG MET A 31 3.669 -16.870 2.884 1.00 0.00 C ATOM 410 SD MET A 31 2.130 -16.392 3.651 1.00 0.00 S ATOM 411 CE MET A 31 1.385 -15.481 2.308 1.00 0.00 C ATOM 0 H MET A 31 6.413 -17.756 2.165 1.00 0.00 H new ATOM 0 HA MET A 31 4.556 -19.195 0.508 1.00 0.00 H new ATOM 0 HB2 MET A 31 2.749 -17.367 0.998 1.00 0.00 H new ATOM 0 HB3 MET A 31 2.875 -18.718 2.106 1.00 0.00 H new ATOM 0 HG2 MET A 31 4.322 -17.339 3.621 1.00 0.00 H new ATOM 0 HG3 MET A 31 4.190 -15.987 2.513 1.00 0.00 H new ATOM 0 HE1 MET A 31 0.945 -14.561 2.692 1.00 0.00 H new ATOM 0 HE2 MET A 31 2.146 -15.237 1.567 1.00 0.00 H new ATOM 0 HE3 MET A 31 0.608 -16.088 1.844 1.00 0.00 H new ATOM 421 N ASP A 32 4.244 -16.829 -0.817 1.00 0.00 N ATOM 422 CA ASP A 32 4.531 -15.811 -1.814 1.00 0.00 C ATOM 423 C ASP A 32 3.433 -14.746 -1.778 1.00 0.00 C ATOM 424 O ASP A 32 2.618 -14.658 -2.695 1.00 0.00 O ATOM 425 CB ASP A 32 4.562 -16.411 -3.221 1.00 0.00 C ATOM 426 CG ASP A 32 5.910 -17.000 -3.643 1.00 0.00 C ATOM 427 OD1 ASP A 32 6.584 -17.567 -2.756 1.00 0.00 O ATOM 428 OD2 ASP A 32 6.235 -16.869 -4.843 1.00 0.00 O ATOM 0 H ASP A 32 3.307 -17.228 -0.872 1.00 0.00 H new ATOM 0 HA ASP A 32 5.505 -15.379 -1.585 1.00 0.00 H new ATOM 0 HB2 ASP A 32 3.805 -17.193 -3.283 1.00 0.00 H new ATOM 0 HB3 ASP A 32 4.281 -15.638 -3.936 1.00 0.00 H new ATOM 433 N PRO A 33 3.448 -13.942 -0.681 1.00 0.00 N ATOM 434 CA PRO A 33 2.464 -12.886 -0.514 1.00 0.00 C ATOM 435 C PRO A 33 2.771 -11.700 -1.430 1.00 0.00 C ATOM 436 O PRO A 33 3.927 -11.303 -1.571 1.00 0.00 O ATOM 437 CB PRO A 33 2.519 -12.527 0.962 1.00 0.00 C ATOM 438 CG PRO A 33 3.847 -13.062 1.472 1.00 0.00 C ATOM 439 CD PRO A 33 4.398 -14.017 0.425 1.00 0.00 C ATOM 0 HA PRO A 33 1.459 -13.199 -0.797 1.00 0.00 H new ATOM 0 HB2 PRO A 33 2.452 -11.448 1.104 1.00 0.00 H new ATOM 0 HB3 PRO A 33 1.685 -12.972 1.504 1.00 0.00 H new ATOM 0 HG2 PRO A 33 4.546 -12.244 1.648 1.00 0.00 H new ATOM 0 HG3 PRO A 33 3.711 -13.576 2.424 1.00 0.00 H new ATOM 0 HD2 PRO A 33 5.399 -13.723 0.108 1.00 0.00 H new ATOM 0 HD3 PRO A 33 4.473 -15.032 0.815 1.00 0.00 H new ATOM 447 N TYR A 34 1.716 -11.167 -2.029 1.00 0.00 N ATOM 448 CA TYR A 34 1.859 -10.034 -2.927 1.00 0.00 C ATOM 449 C TYR A 34 0.862 -8.927 -2.578 1.00 0.00 C ATOM 450 O TYR A 34 -0.298 -9.204 -2.278 1.00 0.00 O ATOM 451 CB TYR A 34 1.544 -10.564 -4.328 1.00 0.00 C ATOM 452 CG TYR A 34 0.072 -10.921 -4.541 1.00 0.00 C ATOM 453 CD1 TYR A 34 -0.391 -12.174 -4.195 1.00 0.00 C ATOM 454 CD2 TYR A 34 -0.793 -9.990 -5.080 1.00 0.00 C ATOM 455 CE1 TYR A 34 -1.777 -12.510 -4.396 1.00 0.00 C ATOM 456 CE2 TYR A 34 -2.179 -10.326 -5.281 1.00 0.00 C ATOM 457 CZ TYR A 34 -2.602 -11.570 -4.929 1.00 0.00 C ATOM 458 OH TYR A 34 -3.911 -11.887 -5.118 1.00 0.00 O ATOM 0 H TYR A 34 0.759 -11.499 -1.910 1.00 0.00 H new ATOM 0 HA TYR A 34 2.861 -9.612 -2.855 1.00 0.00 H new ATOM 0 HB2 TYR A 34 1.836 -9.814 -5.063 1.00 0.00 H new ATOM 0 HB3 TYR A 34 2.153 -11.448 -4.516 1.00 0.00 H new ATOM 0 HD1 TYR A 34 0.286 -12.903 -3.774 1.00 0.00 H new ATOM 0 HD2 TYR A 34 -0.430 -9.009 -5.351 1.00 0.00 H new ATOM 0 HE1 TYR A 34 -2.153 -13.487 -4.129 1.00 0.00 H new ATOM 0 HE2 TYR A 34 -2.867 -9.607 -5.701 1.00 0.00 H new ATOM 0 HH TYR A 34 -4.436 -11.579 -4.350 1.00 0.00 H new ATOM 468 N VAL A 35 1.351 -7.697 -2.628 1.00 0.00 N ATOM 469 CA VAL A 35 0.517 -6.547 -2.320 1.00 0.00 C ATOM 470 C VAL A 35 -0.129 -6.032 -3.607 1.00 0.00 C ATOM 471 O VAL A 35 0.432 -6.184 -4.691 1.00 0.00 O ATOM 472 CB VAL A 35 1.342 -5.481 -1.597 1.00 0.00 C ATOM 473 CG1 VAL A 35 0.513 -4.219 -1.351 1.00 0.00 C ATOM 474 CG2 VAL A 35 1.914 -6.025 -0.286 1.00 0.00 C ATOM 0 H VAL A 35 2.314 -7.471 -2.877 1.00 0.00 H new ATOM 0 HA VAL A 35 -0.289 -6.830 -1.643 1.00 0.00 H new ATOM 0 HB VAL A 35 2.179 -5.212 -2.241 1.00 0.00 H new ATOM 0 HG11 VAL A 35 1.123 -3.477 -0.836 1.00 0.00 H new ATOM 0 HG12 VAL A 35 0.177 -3.813 -2.305 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -0.353 -4.466 -0.737 1.00 0.00 H new ATOM 0 HG21 VAL A 35 2.496 -5.247 0.208 1.00 0.00 H new ATOM 0 HG22 VAL A 35 1.098 -6.336 0.366 1.00 0.00 H new ATOM 0 HG23 VAL A 35 2.556 -6.880 -0.496 1.00 0.00 H new ATOM 484 N GLN A 36 -1.300 -5.433 -3.445 1.00 0.00 N ATOM 485 CA GLN A 36 -2.029 -4.895 -4.581 1.00 0.00 C ATOM 486 C GLN A 36 -2.485 -3.464 -4.289 1.00 0.00 C ATOM 487 O GLN A 36 -3.493 -3.256 -3.615 1.00 0.00 O ATOM 488 CB GLN A 36 -3.218 -5.787 -4.943 1.00 0.00 C ATOM 489 CG GLN A 36 -4.175 -5.065 -5.893 1.00 0.00 C ATOM 490 CD GLN A 36 -5.405 -5.926 -6.190 1.00 0.00 C ATOM 491 OE1 GLN A 36 -5.315 -7.115 -6.450 1.00 0.00 O ATOM 492 NE2 GLN A 36 -6.556 -5.261 -6.138 1.00 0.00 N ATOM 0 H GLN A 36 -1.762 -5.308 -2.544 1.00 0.00 H new ATOM 0 HA GLN A 36 -1.359 -4.874 -5.441 1.00 0.00 H new ATOM 0 HB2 GLN A 36 -2.860 -6.705 -5.410 1.00 0.00 H new ATOM 0 HB3 GLN A 36 -3.749 -6.077 -4.036 1.00 0.00 H new ATOM 0 HG2 GLN A 36 -4.487 -4.119 -5.451 1.00 0.00 H new ATOM 0 HG3 GLN A 36 -3.659 -4.828 -6.824 1.00 0.00 H new ATOM 0 HE21 GLN A 36 -6.560 -4.266 -5.914 1.00 0.00 H new ATOM 0 HE22 GLN A 36 -7.434 -5.746 -6.322 1.00 0.00 H new ATOM 501 N LEU A 37 -1.722 -2.515 -4.810 1.00 0.00 N ATOM 502 CA LEU A 37 -2.035 -1.110 -4.614 1.00 0.00 C ATOM 503 C LEU A 37 -3.351 -0.781 -5.322 1.00 0.00 C ATOM 504 O LEU A 37 -3.567 -1.195 -6.460 1.00 0.00 O ATOM 505 CB LEU A 37 -0.863 -0.232 -5.056 1.00 0.00 C ATOM 506 CG LEU A 37 0.332 -0.177 -4.102 1.00 0.00 C ATOM 507 CD1 LEU A 37 0.070 -1.012 -2.847 1.00 0.00 C ATOM 508 CD2 LEU A 37 1.620 -0.597 -4.811 1.00 0.00 C ATOM 0 H LEU A 37 -0.887 -2.692 -5.368 1.00 0.00 H new ATOM 0 HA LEU A 37 -2.180 -0.897 -3.555 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -0.513 -0.589 -6.025 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -1.231 0.783 -5.204 1.00 0.00 H new ATOM 0 HG LEU A 37 0.465 0.856 -3.780 1.00 0.00 H new ATOM 0 HD11 LEU A 37 0.935 -0.956 -2.186 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -0.808 -0.626 -2.330 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -0.103 -2.050 -3.130 1.00 0.00 H new ATOM 0 HD21 LEU A 37 2.453 -0.549 -4.110 1.00 0.00 H new ATOM 0 HD22 LEU A 37 1.516 -1.617 -5.181 1.00 0.00 H new ATOM 0 HD23 LEU A 37 1.810 0.075 -5.648 1.00 0.00 H new ATOM 520 N THR A 38 -4.196 -0.041 -4.619 1.00 0.00 N ATOM 521 CA THR A 38 -5.485 0.347 -5.166 1.00 0.00 C ATOM 522 C THR A 38 -5.680 1.860 -5.048 1.00 0.00 C ATOM 523 O THR A 38 -5.385 2.448 -4.008 1.00 0.00 O ATOM 524 CB THR A 38 -6.566 -0.463 -4.450 1.00 0.00 C ATOM 525 OG1 THR A 38 -6.000 -1.765 -4.326 1.00 0.00 O ATOM 526 CG2 THR A 38 -7.808 -0.679 -5.318 1.00 0.00 C ATOM 0 H THR A 38 -4.013 0.300 -3.675 1.00 0.00 H new ATOM 0 HA THR A 38 -5.546 0.125 -6.231 1.00 0.00 H new ATOM 0 HB THR A 38 -6.850 0.047 -3.529 1.00 0.00 H new ATOM 0 HG1 THR A 38 -6.635 -2.356 -3.870 1.00 0.00 H new ATOM 0 HG21 THR A 38 -8.544 -1.260 -4.762 1.00 0.00 H new ATOM 0 HG22 THR A 38 -8.236 0.287 -5.588 1.00 0.00 H new ATOM 0 HG23 THR A 38 -7.530 -1.218 -6.224 1.00 0.00 H new ATOM 534 N CYS A 39 -6.176 2.447 -6.127 1.00 0.00 N ATOM 535 CA CYS A 39 -6.415 3.880 -6.157 1.00 0.00 C ATOM 536 C CYS A 39 -7.722 4.134 -6.911 1.00 0.00 C ATOM 537 O CYS A 39 -7.736 4.171 -8.141 1.00 0.00 O ATOM 538 CB CYS A 39 -5.240 4.636 -6.781 1.00 0.00 C ATOM 539 SG CYS A 39 -5.510 6.440 -6.638 1.00 0.00 S ATOM 0 H CYS A 39 -6.419 1.956 -6.987 1.00 0.00 H new ATOM 0 HA CYS A 39 -6.505 4.257 -5.138 1.00 0.00 H new ATOM 0 HB2 CYS A 39 -4.312 4.358 -6.282 1.00 0.00 H new ATOM 0 HB3 CYS A 39 -5.134 4.358 -7.830 1.00 0.00 H new ATOM 0 HG CYS A 39 -6.783 6.694 -6.699 1.00 0.00 H new ATOM 545 N ARG A 40 -8.788 4.302 -6.143 1.00 0.00 N ATOM 546 CA ARG A 40 -10.096 4.551 -6.723 1.00 0.00 C ATOM 547 C ARG A 40 -10.533 3.361 -7.580 1.00 0.00 C ATOM 548 O ARG A 40 -11.341 2.542 -7.145 1.00 0.00 O ATOM 549 CB ARG A 40 -10.085 5.814 -7.586 1.00 0.00 C ATOM 550 CG ARG A 40 -11.110 6.832 -7.082 1.00 0.00 C ATOM 551 CD ARG A 40 -10.613 8.263 -7.297 1.00 0.00 C ATOM 552 NE ARG A 40 -11.616 9.038 -8.062 1.00 0.00 N ATOM 553 CZ ARG A 40 -11.329 10.126 -8.789 1.00 0.00 C ATOM 554 NH1 ARG A 40 -10.069 10.575 -8.854 1.00 0.00 N ATOM 555 NH2 ARG A 40 -12.304 10.765 -9.451 1.00 0.00 N ATOM 0 H ARG A 40 -8.772 4.271 -5.124 1.00 0.00 H new ATOM 0 HA ARG A 40 -10.800 4.691 -5.903 1.00 0.00 H new ATOM 0 HB2 ARG A 40 -9.090 6.258 -7.574 1.00 0.00 H new ATOM 0 HB3 ARG A 40 -10.305 5.553 -8.621 1.00 0.00 H new ATOM 0 HG2 ARG A 40 -12.056 6.690 -7.604 1.00 0.00 H new ATOM 0 HG3 ARG A 40 -11.302 6.665 -6.022 1.00 0.00 H new ATOM 0 HD2 ARG A 40 -10.429 8.741 -6.335 1.00 0.00 H new ATOM 0 HD3 ARG A 40 -9.664 8.250 -7.834 1.00 0.00 H new ATOM 0 HE ARG A 40 -12.586 8.724 -8.034 1.00 0.00 H new ATOM 0 HH11 ARG A 40 -9.328 10.089 -8.350 1.00 0.00 H new ATOM 0 HH12 ARG A 40 -9.851 11.403 -9.408 1.00 0.00 H new ATOM 0 HH21 ARG A 40 -13.264 10.423 -9.401 1.00 0.00 H new ATOM 0 HH22 ARG A 40 -12.086 11.593 -10.005 1.00 0.00 H new ATOM 569 N THR A 41 -9.978 3.303 -8.782 1.00 0.00 N ATOM 570 CA THR A 41 -10.300 2.227 -9.703 1.00 0.00 C ATOM 571 C THR A 41 -9.026 1.678 -10.348 1.00 0.00 C ATOM 572 O THR A 41 -9.092 0.880 -11.282 1.00 0.00 O ATOM 573 CB THR A 41 -11.313 2.760 -10.718 1.00 0.00 C ATOM 574 OG1 THR A 41 -10.796 4.035 -11.089 1.00 0.00 O ATOM 575 CG2 THR A 41 -12.668 3.079 -10.081 1.00 0.00 C ATOM 0 H THR A 41 -9.308 3.984 -9.139 1.00 0.00 H new ATOM 0 HA THR A 41 -10.753 1.383 -9.182 1.00 0.00 H new ATOM 0 HB THR A 41 -11.449 2.027 -11.513 1.00 0.00 H new ATOM 0 HG1 THR A 41 -11.392 4.451 -11.747 1.00 0.00 H new ATOM 0 HG21 THR A 41 -13.350 3.454 -10.844 1.00 0.00 H new ATOM 0 HG22 THR A 41 -13.083 2.174 -9.636 1.00 0.00 H new ATOM 0 HG23 THR A 41 -12.537 3.836 -9.308 1.00 0.00 H new ATOM 583 N GLN A 42 -7.895 2.127 -9.824 1.00 0.00 N ATOM 584 CA GLN A 42 -6.607 1.691 -10.337 1.00 0.00 C ATOM 585 C GLN A 42 -6.015 0.608 -9.433 1.00 0.00 C ATOM 586 O GLN A 42 -5.685 0.870 -8.278 1.00 0.00 O ATOM 587 CB GLN A 42 -5.645 2.872 -10.479 1.00 0.00 C ATOM 588 CG GLN A 42 -6.169 3.886 -11.498 1.00 0.00 C ATOM 589 CD GLN A 42 -5.613 5.284 -11.216 1.00 0.00 C ATOM 590 OE1 GLN A 42 -5.750 5.827 -10.133 1.00 0.00 O ATOM 591 NE2 GLN A 42 -4.981 5.833 -12.250 1.00 0.00 N ATOM 0 H GLN A 42 -7.844 2.788 -9.049 1.00 0.00 H new ATOM 0 HA GLN A 42 -6.758 1.266 -11.329 1.00 0.00 H new ATOM 0 HB2 GLN A 42 -5.514 3.357 -9.512 1.00 0.00 H new ATOM 0 HB3 GLN A 42 -4.664 2.512 -10.790 1.00 0.00 H new ATOM 0 HG2 GLN A 42 -5.887 3.575 -12.504 1.00 0.00 H new ATOM 0 HG3 GLN A 42 -7.258 3.910 -11.465 1.00 0.00 H new ATOM 0 HE21 GLN A 42 -4.903 5.322 -13.129 1.00 0.00 H new ATOM 0 HE22 GLN A 42 -4.575 6.765 -12.163 1.00 0.00 H new ATOM 600 N ASP A 43 -5.899 -0.587 -9.994 1.00 0.00 N ATOM 601 CA ASP A 43 -5.353 -1.711 -9.253 1.00 0.00 C ATOM 602 C ASP A 43 -4.032 -2.145 -9.893 1.00 0.00 C ATOM 603 O ASP A 43 -3.950 -2.302 -11.110 1.00 0.00 O ATOM 604 CB ASP A 43 -6.307 -2.907 -9.282 1.00 0.00 C ATOM 605 CG ASP A 43 -7.081 -3.084 -10.590 1.00 0.00 C ATOM 606 OD1 ASP A 43 -7.878 -2.175 -10.906 1.00 0.00 O ATOM 607 OD2 ASP A 43 -6.858 -4.125 -11.245 1.00 0.00 O ATOM 0 H ASP A 43 -6.174 -0.801 -10.953 1.00 0.00 H new ATOM 0 HA ASP A 43 -5.204 -1.393 -8.221 1.00 0.00 H new ATOM 0 HB2 ASP A 43 -5.734 -3.814 -9.090 1.00 0.00 H new ATOM 0 HB3 ASP A 43 -7.022 -2.803 -8.466 1.00 0.00 H new ATOM 612 N GLN A 44 -3.032 -2.327 -9.044 1.00 0.00 N ATOM 613 CA GLN A 44 -1.719 -2.739 -9.511 1.00 0.00 C ATOM 614 C GLN A 44 -1.034 -3.617 -8.462 1.00 0.00 C ATOM 615 O GLN A 44 -0.858 -3.202 -7.318 1.00 0.00 O ATOM 616 CB GLN A 44 -0.855 -1.526 -9.859 1.00 0.00 C ATOM 617 CG GLN A 44 -1.529 -0.660 -10.926 1.00 0.00 C ATOM 618 CD GLN A 44 -0.676 0.568 -11.254 1.00 0.00 C ATOM 619 OE1 GLN A 44 0.510 0.478 -11.526 1.00 0.00 O ATOM 620 NE2 GLN A 44 -1.345 1.717 -11.215 1.00 0.00 N ATOM 0 H GLN A 44 -3.104 -2.197 -8.035 1.00 0.00 H new ATOM 0 HA GLN A 44 -1.846 -3.326 -10.421 1.00 0.00 H new ATOM 0 HB2 GLN A 44 -0.678 -0.932 -8.962 1.00 0.00 H new ATOM 0 HB3 GLN A 44 0.119 -1.860 -10.218 1.00 0.00 H new ATOM 0 HG2 GLN A 44 -1.689 -1.248 -11.830 1.00 0.00 H new ATOM 0 HG3 GLN A 44 -2.511 -0.342 -10.575 1.00 0.00 H new ATOM 0 HE21 GLN A 44 -2.338 1.722 -10.980 1.00 0.00 H new ATOM 0 HE22 GLN A 44 -0.865 2.594 -11.420 1.00 0.00 H new ATOM 629 N LYS A 45 -0.666 -4.816 -8.890 1.00 0.00 N ATOM 630 CA LYS A 45 -0.004 -5.757 -8.002 1.00 0.00 C ATOM 631 C LYS A 45 1.511 -5.636 -8.176 1.00 0.00 C ATOM 632 O LYS A 45 1.983 -5.077 -9.165 1.00 0.00 O ATOM 633 CB LYS A 45 -0.538 -7.173 -8.227 1.00 0.00 C ATOM 634 CG LYS A 45 -1.870 -7.378 -7.503 1.00 0.00 C ATOM 635 CD LYS A 45 -2.820 -8.241 -8.336 1.00 0.00 C ATOM 636 CE LYS A 45 -2.172 -9.578 -8.697 1.00 0.00 C ATOM 637 NZ LYS A 45 -2.701 -10.081 -9.984 1.00 0.00 N ATOM 0 H LYS A 45 -0.814 -5.157 -9.840 1.00 0.00 H new ATOM 0 HA LYS A 45 -0.226 -5.520 -6.962 1.00 0.00 H new ATOM 0 HB2 LYS A 45 -0.669 -7.351 -9.294 1.00 0.00 H new ATOM 0 HB3 LYS A 45 0.190 -7.901 -7.870 1.00 0.00 H new ATOM 0 HG2 LYS A 45 -1.694 -7.853 -6.538 1.00 0.00 H new ATOM 0 HG3 LYS A 45 -2.332 -6.411 -7.303 1.00 0.00 H new ATOM 0 HD2 LYS A 45 -3.740 -8.418 -7.778 1.00 0.00 H new ATOM 0 HD3 LYS A 45 -3.096 -7.709 -9.246 1.00 0.00 H new ATOM 0 HE2 LYS A 45 -1.091 -9.458 -8.764 1.00 0.00 H new ATOM 0 HE3 LYS A 45 -2.364 -10.306 -7.909 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 -2.250 -10.990 -10.213 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 -3.730 -10.214 -9.908 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 -2.496 -9.393 -10.736 1.00 0.00 H new ATOM 651 N SER A 46 2.231 -6.171 -7.201 1.00 0.00 N ATOM 652 CA SER A 46 3.683 -6.130 -7.234 1.00 0.00 C ATOM 653 C SER A 46 4.242 -7.542 -7.419 1.00 0.00 C ATOM 654 O SER A 46 3.511 -8.524 -7.300 1.00 0.00 O ATOM 655 CB SER A 46 4.246 -5.499 -5.958 1.00 0.00 C ATOM 656 OG SER A 46 4.020 -6.317 -4.814 1.00 0.00 O ATOM 0 H SER A 46 1.836 -6.635 -6.383 1.00 0.00 H new ATOM 0 HA SER A 46 3.988 -5.511 -8.078 1.00 0.00 H new ATOM 0 HB2 SER A 46 5.316 -5.331 -6.078 1.00 0.00 H new ATOM 0 HB3 SER A 46 3.786 -4.523 -5.803 1.00 0.00 H new ATOM 0 HG SER A 46 4.823 -6.323 -4.252 1.00 0.00 H new ATOM 662 N ASN A 47 5.534 -7.600 -7.707 1.00 0.00 N ATOM 663 CA ASN A 47 6.200 -8.875 -7.910 1.00 0.00 C ATOM 664 C ASN A 47 5.832 -9.825 -6.768 1.00 0.00 C ATOM 665 O ASN A 47 5.540 -9.382 -5.658 1.00 0.00 O ATOM 666 CB ASN A 47 7.721 -8.709 -7.914 1.00 0.00 C ATOM 667 CG ASN A 47 8.185 -7.876 -6.717 1.00 0.00 C ATOM 668 OD1 ASN A 47 8.514 -8.391 -5.661 1.00 0.00 O ATOM 669 ND2 ASN A 47 8.192 -6.565 -6.940 1.00 0.00 N ATOM 0 H ASN A 47 6.138 -6.784 -7.805 1.00 0.00 H new ATOM 0 HA ASN A 47 5.878 -9.273 -8.872 1.00 0.00 H new ATOM 0 HB2 ASN A 47 8.197 -9.689 -7.886 1.00 0.00 H new ATOM 0 HB3 ASN A 47 8.035 -8.228 -8.840 1.00 0.00 H new ATOM 0 HD21 ASN A 47 8.485 -5.924 -6.203 1.00 0.00 H new ATOM 0 HD22 ASN A 47 7.904 -6.201 -7.848 1.00 0.00 H new ATOM 676 N VAL A 48 5.857 -11.112 -7.079 1.00 0.00 N ATOM 677 CA VAL A 48 5.530 -12.128 -6.093 1.00 0.00 C ATOM 678 C VAL A 48 6.756 -12.395 -5.217 1.00 0.00 C ATOM 679 O VAL A 48 7.777 -12.878 -5.704 1.00 0.00 O ATOM 680 CB VAL A 48 5.007 -13.385 -6.790 1.00 0.00 C ATOM 681 CG1 VAL A 48 5.159 -14.614 -5.891 1.00 0.00 C ATOM 682 CG2 VAL A 48 3.553 -13.204 -7.230 1.00 0.00 C ATOM 0 H VAL A 48 6.099 -11.475 -8.001 1.00 0.00 H new ATOM 0 HA VAL A 48 4.731 -11.781 -5.437 1.00 0.00 H new ATOM 0 HB VAL A 48 5.609 -13.547 -7.684 1.00 0.00 H new ATOM 0 HG11 VAL A 48 4.780 -15.494 -6.410 1.00 0.00 H new ATOM 0 HG12 VAL A 48 6.212 -14.761 -5.650 1.00 0.00 H new ATOM 0 HG13 VAL A 48 4.594 -14.464 -4.971 1.00 0.00 H new ATOM 0 HG21 VAL A 48 3.206 -14.112 -7.723 1.00 0.00 H new ATOM 0 HG22 VAL A 48 2.931 -13.004 -6.357 1.00 0.00 H new ATOM 0 HG23 VAL A 48 3.484 -12.366 -7.924 1.00 0.00 H new ATOM 692 N ALA A 49 6.613 -12.071 -3.941 1.00 0.00 N ATOM 693 CA ALA A 49 7.696 -12.270 -2.993 1.00 0.00 C ATOM 694 C ALA A 49 7.963 -13.769 -2.838 1.00 0.00 C ATOM 695 O ALA A 49 7.445 -14.404 -1.920 1.00 0.00 O ATOM 696 CB ALA A 49 7.341 -11.601 -1.663 1.00 0.00 C ATOM 0 H ALA A 49 5.764 -11.672 -3.541 1.00 0.00 H new ATOM 0 HA ALA A 49 8.613 -11.807 -3.356 1.00 0.00 H new ATOM 0 HB1 ALA A 49 8.154 -11.751 -0.952 1.00 0.00 H new ATOM 0 HB2 ALA A 49 7.190 -10.533 -1.822 1.00 0.00 H new ATOM 0 HB3 ALA A 49 6.426 -12.042 -1.267 1.00 0.00 H new ATOM 702 N GLU A 50 8.771 -14.291 -3.749 1.00 0.00 N ATOM 703 CA GLU A 50 9.113 -15.703 -3.725 1.00 0.00 C ATOM 704 C GLU A 50 10.086 -15.994 -2.581 1.00 0.00 C ATOM 705 O GLU A 50 11.164 -15.406 -2.513 1.00 0.00 O ATOM 706 CB GLU A 50 9.697 -16.148 -5.068 1.00 0.00 C ATOM 707 CG GLU A 50 8.628 -16.134 -6.162 1.00 0.00 C ATOM 708 CD GLU A 50 9.264 -16.015 -7.548 1.00 0.00 C ATOM 709 OE1 GLU A 50 10.288 -16.699 -7.763 1.00 0.00 O ATOM 710 OE2 GLU A 50 8.711 -15.243 -8.362 1.00 0.00 O ATOM 0 H GLU A 50 9.199 -13.761 -4.509 1.00 0.00 H new ATOM 0 HA GLU A 50 8.201 -16.275 -3.555 1.00 0.00 H new ATOM 0 HB2 GLU A 50 10.518 -15.488 -5.348 1.00 0.00 H new ATOM 0 HB3 GLU A 50 10.113 -17.151 -4.973 1.00 0.00 H new ATOM 0 HG2 GLU A 50 8.035 -17.047 -6.107 1.00 0.00 H new ATOM 0 HG3 GLU A 50 7.946 -15.300 -5.998 1.00 0.00 H new ATOM 717 N GLY A 51 9.669 -16.901 -1.709 1.00 0.00 N ATOM 718 CA GLY A 51 10.490 -17.278 -0.571 1.00 0.00 C ATOM 719 C GLY A 51 11.236 -16.066 -0.008 1.00 0.00 C ATOM 720 O GLY A 51 12.439 -15.920 -0.218 1.00 0.00 O ATOM 0 H GLY A 51 8.773 -17.386 -1.768 1.00 0.00 H new ATOM 0 HA2 GLY A 51 9.863 -17.716 0.205 1.00 0.00 H new ATOM 0 HA3 GLY A 51 11.206 -18.043 -0.872 1.00 0.00 H new ATOM 724 N MET A 52 10.490 -15.228 0.697 1.00 0.00 N ATOM 725 CA MET A 52 11.065 -14.034 1.292 1.00 0.00 C ATOM 726 C MET A 52 11.009 -14.101 2.819 1.00 0.00 C ATOM 727 O MET A 52 11.885 -13.569 3.500 1.00 0.00 O ATOM 728 CB MET A 52 10.299 -12.801 0.806 1.00 0.00 C ATOM 729 CG MET A 52 10.636 -12.486 -0.653 1.00 0.00 C ATOM 730 SD MET A 52 12.361 -12.048 -0.799 1.00 0.00 S ATOM 731 CE MET A 52 12.301 -11.043 -2.273 1.00 0.00 C ATOM 0 H MET A 52 9.492 -15.353 0.869 1.00 0.00 H new ATOM 0 HA MET A 52 12.110 -13.967 0.988 1.00 0.00 H new ATOM 0 HB2 MET A 52 9.227 -12.971 0.907 1.00 0.00 H new ATOM 0 HB3 MET A 52 10.546 -11.944 1.433 1.00 0.00 H new ATOM 0 HG2 MET A 52 10.417 -13.350 -1.280 1.00 0.00 H new ATOM 0 HG3 MET A 52 10.012 -11.666 -1.010 1.00 0.00 H new ATOM 0 HE1 MET A 52 13.303 -10.684 -2.510 1.00 0.00 H new ATOM 0 HE2 MET A 52 11.923 -11.638 -3.104 1.00 0.00 H new ATOM 0 HE3 MET A 52 11.640 -10.192 -2.107 1.00 0.00 H new ATOM 741 N GLY A 53 9.970 -14.759 3.313 1.00 0.00 N ATOM 742 CA GLY A 53 9.789 -14.902 4.748 1.00 0.00 C ATOM 743 C GLY A 53 8.680 -13.978 5.255 1.00 0.00 C ATOM 744 O GLY A 53 7.678 -13.771 4.572 1.00 0.00 O ATOM 0 H GLY A 53 9.245 -15.199 2.746 1.00 0.00 H new ATOM 0 HA2 GLY A 53 9.542 -15.937 4.986 1.00 0.00 H new ATOM 0 HA3 GLY A 53 10.723 -14.671 5.261 1.00 0.00 H new ATOM 748 N THR A 54 8.897 -13.446 6.449 1.00 0.00 N ATOM 749 CA THR A 54 7.929 -12.548 7.056 1.00 0.00 C ATOM 750 C THR A 54 8.351 -11.092 6.852 1.00 0.00 C ATOM 751 O THR A 54 7.872 -10.199 7.550 1.00 0.00 O ATOM 752 CB THR A 54 7.781 -12.938 8.528 1.00 0.00 C ATOM 753 OG1 THR A 54 9.096 -12.795 9.059 1.00 0.00 O ATOM 754 CG2 THR A 54 7.464 -14.423 8.711 1.00 0.00 C ATOM 0 H THR A 54 9.729 -13.620 7.013 1.00 0.00 H new ATOM 0 HA THR A 54 6.952 -12.639 6.581 1.00 0.00 H new ATOM 0 HB THR A 54 6.992 -12.340 8.984 1.00 0.00 H new ATOM 0 HG1 THR A 54 9.091 -13.027 10.011 1.00 0.00 H new ATOM 0 HG21 THR A 54 7.369 -14.647 9.774 1.00 0.00 H new ATOM 0 HG22 THR A 54 6.528 -14.660 8.205 1.00 0.00 H new ATOM 0 HG23 THR A 54 8.269 -15.022 8.285 1.00 0.00 H new ATOM 762 N THR A 55 9.243 -10.897 5.892 1.00 0.00 N ATOM 763 CA THR A 55 9.735 -9.564 5.587 1.00 0.00 C ATOM 764 C THR A 55 10.109 -9.458 4.108 1.00 0.00 C ATOM 765 O THR A 55 11.278 -9.274 3.770 1.00 0.00 O ATOM 766 CB THR A 55 10.901 -9.263 6.532 1.00 0.00 C ATOM 767 OG1 THR A 55 11.602 -10.500 6.623 1.00 0.00 O ATOM 768 CG2 THR A 55 10.439 -8.990 7.964 1.00 0.00 C ATOM 0 H THR A 55 9.638 -11.640 5.315 1.00 0.00 H new ATOM 0 HA THR A 55 8.963 -8.811 5.749 1.00 0.00 H new ATOM 0 HB THR A 55 11.456 -8.402 6.160 1.00 0.00 H new ATOM 0 HG1 THR A 55 12.375 -10.395 7.216 1.00 0.00 H new ATOM 0 HG21 THR A 55 11.305 -8.782 8.592 1.00 0.00 H new ATOM 0 HG22 THR A 55 9.770 -8.130 7.973 1.00 0.00 H new ATOM 0 HG23 THR A 55 9.912 -9.863 8.349 1.00 0.00 H new ATOM 776 N PRO A 56 9.068 -9.583 3.241 1.00 0.00 N ATOM 777 CA PRO A 56 9.276 -9.504 1.806 1.00 0.00 C ATOM 778 C PRO A 56 9.514 -8.058 1.365 1.00 0.00 C ATOM 779 O PRO A 56 8.929 -7.131 1.923 1.00 0.00 O ATOM 780 CB PRO A 56 8.025 -10.113 1.193 1.00 0.00 C ATOM 781 CG PRO A 56 6.969 -10.085 2.287 1.00 0.00 C ATOM 782 CD PRO A 56 7.671 -9.802 3.605 1.00 0.00 C ATOM 0 HA PRO A 56 10.166 -10.042 1.480 1.00 0.00 H new ATOM 0 HB2 PRO A 56 7.700 -9.544 0.322 1.00 0.00 H new ATOM 0 HB3 PRO A 56 8.212 -11.133 0.856 1.00 0.00 H new ATOM 0 HG2 PRO A 56 6.224 -9.317 2.079 1.00 0.00 H new ATOM 0 HG3 PRO A 56 6.441 -11.038 2.332 1.00 0.00 H new ATOM 0 HD2 PRO A 56 7.249 -8.927 4.099 1.00 0.00 H new ATOM 0 HD3 PRO A 56 7.568 -10.639 4.296 1.00 0.00 H new ATOM 790 N GLU A 57 10.373 -7.912 0.367 1.00 0.00 N ATOM 791 CA GLU A 57 10.696 -6.595 -0.155 1.00 0.00 C ATOM 792 C GLU A 57 10.321 -6.504 -1.635 1.00 0.00 C ATOM 793 O GLU A 57 10.512 -7.458 -2.387 1.00 0.00 O ATOM 794 CB GLU A 57 12.176 -6.268 0.057 1.00 0.00 C ATOM 795 CG GLU A 57 12.472 -6.001 1.534 1.00 0.00 C ATOM 796 CD GLU A 57 12.595 -7.312 2.314 1.00 0.00 C ATOM 797 OE1 GLU A 57 12.752 -8.357 1.647 1.00 0.00 O ATOM 798 OE2 GLU A 57 12.529 -7.239 3.560 1.00 0.00 O ATOM 0 H GLU A 57 10.855 -8.684 -0.094 1.00 0.00 H new ATOM 0 HA GLU A 57 10.113 -5.856 0.394 1.00 0.00 H new ATOM 0 HB2 GLU A 57 12.790 -7.097 -0.297 1.00 0.00 H new ATOM 0 HB3 GLU A 57 12.448 -5.395 -0.536 1.00 0.00 H new ATOM 0 HG2 GLU A 57 13.396 -5.431 1.626 1.00 0.00 H new ATOM 0 HG3 GLU A 57 11.677 -5.391 1.964 1.00 0.00 H new ATOM 805 N TRP A 58 9.794 -5.347 -2.010 1.00 0.00 N ATOM 806 CA TRP A 58 9.390 -5.120 -3.387 1.00 0.00 C ATOM 807 C TRP A 58 10.177 -3.920 -3.918 1.00 0.00 C ATOM 808 O TRP A 58 10.676 -3.949 -5.042 1.00 0.00 O ATOM 809 CB TRP A 58 7.875 -4.934 -3.491 1.00 0.00 C ATOM 810 CG TRP A 58 7.066 -6.134 -2.994 1.00 0.00 C ATOM 811 CD1 TRP A 58 6.642 -7.192 -3.698 1.00 0.00 C ATOM 812 CD2 TRP A 58 6.597 -6.356 -1.647 1.00 0.00 C ATOM 813 NE1 TRP A 58 5.937 -8.076 -2.908 1.00 0.00 N ATOM 814 CE2 TRP A 58 5.909 -7.552 -1.621 1.00 0.00 C ATOM 815 CE3 TRP A 58 6.749 -5.573 -0.490 1.00 0.00 C ATOM 816 CZ2 TRP A 58 5.319 -8.071 -0.462 1.00 0.00 C ATOM 817 CZ3 TRP A 58 6.154 -6.106 0.660 1.00 0.00 C ATOM 818 CH2 TRP A 58 5.458 -7.308 0.703 1.00 0.00 C ATOM 0 H TRP A 58 9.638 -4.557 -1.384 1.00 0.00 H new ATOM 0 HA TRP A 58 9.619 -5.989 -4.004 1.00 0.00 H new ATOM 0 HB2 TRP A 58 7.587 -4.052 -2.918 1.00 0.00 H new ATOM 0 HB3 TRP A 58 7.614 -4.738 -4.531 1.00 0.00 H new ATOM 0 HD1 TRP A 58 6.829 -7.335 -4.752 1.00 0.00 H new ATOM 0 HE1 TRP A 58 5.514 -8.953 -3.212 1.00 0.00 H new ATOM 0 HE3 TRP A 58 7.283 -4.634 -0.488 1.00 0.00 H new ATOM 0 HZ2 TRP A 58 4.785 -9.010 -0.467 1.00 0.00 H new ATOM 0 HZ3 TRP A 58 6.242 -5.544 1.578 1.00 0.00 H new ATOM 0 HH2 TRP A 58 5.026 -7.652 1.631 1.00 0.00 H new ATOM 829 N ASN A 59 10.264 -2.894 -3.084 1.00 0.00 N ATOM 830 CA ASN A 59 10.982 -1.686 -3.456 1.00 0.00 C ATOM 831 C ASN A 59 10.482 -1.200 -4.818 1.00 0.00 C ATOM 832 O ASN A 59 11.218 -0.547 -5.556 1.00 0.00 O ATOM 833 CB ASN A 59 12.484 -1.952 -3.571 1.00 0.00 C ATOM 834 CG ASN A 59 12.858 -3.281 -2.911 1.00 0.00 C ATOM 835 OD1 ASN A 59 12.715 -4.350 -3.482 1.00 0.00 O ATOM 836 ND2 ASN A 59 13.345 -3.155 -1.680 1.00 0.00 N ATOM 0 H ASN A 59 9.849 -2.874 -2.152 1.00 0.00 H new ATOM 0 HA ASN A 59 10.806 -0.937 -2.683 1.00 0.00 H new ATOM 0 HB2 ASN A 59 12.774 -1.969 -4.621 1.00 0.00 H new ATOM 0 HB3 ASN A 59 13.038 -1.140 -3.100 1.00 0.00 H new ATOM 0 HD21 ASN A 59 13.625 -3.983 -1.155 1.00 0.00 H new ATOM 0 HD22 ASN A 59 13.439 -2.230 -1.261 1.00 0.00 H new ATOM 843 N GLU A 60 9.234 -1.536 -5.109 1.00 0.00 N ATOM 844 CA GLU A 60 8.628 -1.142 -6.369 1.00 0.00 C ATOM 845 C GLU A 60 8.040 0.266 -6.257 1.00 0.00 C ATOM 846 O GLU A 60 8.028 0.854 -5.176 1.00 0.00 O ATOM 847 CB GLU A 60 7.560 -2.148 -6.802 1.00 0.00 C ATOM 848 CG GLU A 60 8.149 -3.202 -7.742 1.00 0.00 C ATOM 849 CD GLU A 60 8.783 -2.548 -8.971 1.00 0.00 C ATOM 850 OE1 GLU A 60 8.024 -1.902 -9.725 1.00 0.00 O ATOM 851 OE2 GLU A 60 10.012 -2.708 -9.129 1.00 0.00 O ATOM 0 H GLU A 60 8.626 -2.077 -4.494 1.00 0.00 H new ATOM 0 HA GLU A 60 9.403 -1.132 -7.135 1.00 0.00 H new ATOM 0 HB2 GLU A 60 7.136 -2.635 -5.924 1.00 0.00 H new ATOM 0 HB3 GLU A 60 6.744 -1.625 -7.301 1.00 0.00 H new ATOM 0 HG2 GLU A 60 8.898 -3.790 -7.211 1.00 0.00 H new ATOM 0 HG3 GLU A 60 7.366 -3.892 -8.056 1.00 0.00 H new ATOM 858 N THR A 61 7.567 0.768 -7.389 1.00 0.00 N ATOM 859 CA THR A 61 6.980 2.096 -7.432 1.00 0.00 C ATOM 860 C THR A 61 5.716 2.093 -8.294 1.00 0.00 C ATOM 861 O THR A 61 5.709 1.532 -9.389 1.00 0.00 O ATOM 862 CB THR A 61 8.051 3.071 -7.926 1.00 0.00 C ATOM 863 OG1 THR A 61 8.911 3.239 -6.803 1.00 0.00 O ATOM 864 CG2 THR A 61 7.493 4.472 -8.182 1.00 0.00 C ATOM 0 H THR A 61 7.579 0.278 -8.284 1.00 0.00 H new ATOM 0 HA THR A 61 6.659 2.419 -6.442 1.00 0.00 H new ATOM 0 HB THR A 61 8.498 2.686 -8.842 1.00 0.00 H new ATOM 0 HG1 THR A 61 9.636 3.856 -7.036 1.00 0.00 H new ATOM 0 HG21 THR A 61 8.294 5.124 -8.531 1.00 0.00 H new ATOM 0 HG22 THR A 61 6.712 4.419 -8.940 1.00 0.00 H new ATOM 0 HG23 THR A 61 7.076 4.872 -7.258 1.00 0.00 H new ATOM 872 N PHE A 62 4.678 2.725 -7.768 1.00 0.00 N ATOM 873 CA PHE A 62 3.411 2.802 -8.476 1.00 0.00 C ATOM 874 C PHE A 62 2.855 4.227 -8.451 1.00 0.00 C ATOM 875 O PHE A 62 2.785 4.851 -7.394 1.00 0.00 O ATOM 876 CB PHE A 62 2.436 1.874 -7.751 1.00 0.00 C ATOM 877 CG PHE A 62 2.934 0.433 -7.612 1.00 0.00 C ATOM 878 CD1 PHE A 62 2.653 -0.479 -8.581 1.00 0.00 C ATOM 879 CD2 PHE A 62 3.657 0.066 -6.521 1.00 0.00 C ATOM 880 CE1 PHE A 62 3.115 -1.816 -8.452 1.00 0.00 C ATOM 881 CE2 PHE A 62 4.119 -1.271 -6.392 1.00 0.00 C ATOM 882 CZ PHE A 62 3.838 -2.183 -7.361 1.00 0.00 C ATOM 0 H PHE A 62 4.688 3.189 -6.860 1.00 0.00 H new ATOM 0 HA PHE A 62 3.549 2.513 -9.518 1.00 0.00 H new ATOM 0 HB2 PHE A 62 2.238 2.276 -6.758 1.00 0.00 H new ATOM 0 HB3 PHE A 62 1.487 1.869 -8.288 1.00 0.00 H new ATOM 0 HD1 PHE A 62 2.079 -0.187 -9.448 1.00 0.00 H new ATOM 0 HD2 PHE A 62 3.880 0.791 -5.752 1.00 0.00 H new ATOM 0 HE1 PHE A 62 2.892 -2.541 -9.221 1.00 0.00 H new ATOM 0 HE2 PHE A 62 4.693 -1.563 -5.525 1.00 0.00 H new ATOM 0 HZ PHE A 62 4.190 -3.200 -7.264 1.00 0.00 H new ATOM 892 N ILE A 63 2.474 4.700 -9.629 1.00 0.00 N ATOM 893 CA ILE A 63 1.926 6.040 -9.755 1.00 0.00 C ATOM 894 C ILE A 63 0.402 5.955 -9.871 1.00 0.00 C ATOM 895 O ILE A 63 -0.128 5.002 -10.441 1.00 0.00 O ATOM 896 CB ILE A 63 2.590 6.784 -10.915 1.00 0.00 C ATOM 897 CG1 ILE A 63 4.081 6.451 -10.998 1.00 0.00 C ATOM 898 CG2 ILE A 63 2.344 8.290 -10.814 1.00 0.00 C ATOM 899 CD1 ILE A 63 4.871 7.201 -9.924 1.00 0.00 C ATOM 0 H ILE A 63 2.534 4.179 -10.504 1.00 0.00 H new ATOM 0 HA ILE A 63 2.146 6.626 -8.863 1.00 0.00 H new ATOM 0 HB ILE A 63 2.132 6.445 -11.844 1.00 0.00 H new ATOM 0 HG12 ILE A 63 4.225 5.377 -10.877 1.00 0.00 H new ATOM 0 HG13 ILE A 63 4.462 6.714 -11.985 1.00 0.00 H new ATOM 0 HG21 ILE A 63 2.827 8.794 -11.651 1.00 0.00 H new ATOM 0 HG22 ILE A 63 1.272 8.486 -10.842 1.00 0.00 H new ATOM 0 HG23 ILE A 63 2.757 8.664 -9.877 1.00 0.00 H new ATOM 0 HD11 ILE A 63 5.928 6.946 -10.005 1.00 0.00 H new ATOM 0 HD12 ILE A 63 4.745 8.275 -10.063 1.00 0.00 H new ATOM 0 HD13 ILE A 63 4.504 6.917 -8.938 1.00 0.00 H new ATOM 911 N PHE A 64 -0.259 6.963 -9.321 1.00 0.00 N ATOM 912 CA PHE A 64 -1.710 7.014 -9.356 1.00 0.00 C ATOM 913 C PHE A 64 -2.207 8.460 -9.411 1.00 0.00 C ATOM 914 O PHE A 64 -1.896 9.261 -8.531 1.00 0.00 O ATOM 915 CB PHE A 64 -2.212 6.363 -8.065 1.00 0.00 C ATOM 916 CG PHE A 64 -2.069 4.840 -8.039 1.00 0.00 C ATOM 917 CD1 PHE A 64 -2.962 4.063 -8.709 1.00 0.00 C ATOM 918 CD2 PHE A 64 -1.050 4.264 -7.347 1.00 0.00 C ATOM 919 CE1 PHE A 64 -2.830 2.649 -8.685 1.00 0.00 C ATOM 920 CE2 PHE A 64 -0.918 2.850 -7.323 1.00 0.00 C ATOM 921 CZ PHE A 64 -1.811 2.073 -7.993 1.00 0.00 C ATOM 0 H PHE A 64 0.184 7.751 -8.849 1.00 0.00 H new ATOM 0 HA PHE A 64 -2.079 6.498 -10.242 1.00 0.00 H new ATOM 0 HB2 PHE A 64 -1.664 6.783 -7.222 1.00 0.00 H new ATOM 0 HB3 PHE A 64 -3.262 6.621 -7.924 1.00 0.00 H new ATOM 0 HD1 PHE A 64 -3.771 4.521 -9.259 1.00 0.00 H new ATOM 0 HD2 PHE A 64 -0.341 4.882 -6.816 1.00 0.00 H new ATOM 0 HE1 PHE A 64 -3.539 2.031 -9.216 1.00 0.00 H new ATOM 0 HE2 PHE A 64 -0.109 2.392 -6.773 1.00 0.00 H new ATOM 0 HZ PHE A 64 -1.711 0.998 -7.975 1.00 0.00 H new ATOM 931 N THR A 65 -2.971 8.750 -10.454 1.00 0.00 N ATOM 932 CA THR A 65 -3.514 10.085 -10.636 1.00 0.00 C ATOM 933 C THR A 65 -4.465 10.434 -9.489 1.00 0.00 C ATOM 934 O THR A 65 -5.267 9.602 -9.067 1.00 0.00 O ATOM 935 CB THR A 65 -4.177 10.143 -12.013 1.00 0.00 C ATOM 936 OG1 THR A 65 -3.082 10.214 -12.923 1.00 0.00 O ATOM 937 CG2 THR A 65 -4.937 11.450 -12.243 1.00 0.00 C ATOM 0 H THR A 65 -3.227 8.083 -11.182 1.00 0.00 H new ATOM 0 HA THR A 65 -2.727 10.839 -10.607 1.00 0.00 H new ATOM 0 HB THR A 65 -4.861 9.302 -12.121 1.00 0.00 H new ATOM 0 HG1 THR A 65 -3.422 10.253 -13.841 1.00 0.00 H new ATOM 0 HG21 THR A 65 -5.388 11.439 -13.235 1.00 0.00 H new ATOM 0 HG22 THR A 65 -5.718 11.554 -11.490 1.00 0.00 H new ATOM 0 HG23 THR A 65 -4.247 12.290 -12.168 1.00 0.00 H new ATOM 945 N VAL A 66 -4.344 11.667 -9.017 1.00 0.00 N ATOM 946 CA VAL A 66 -5.183 12.137 -7.928 1.00 0.00 C ATOM 947 C VAL A 66 -5.962 13.371 -8.386 1.00 0.00 C ATOM 948 O VAL A 66 -5.567 14.041 -9.339 1.00 0.00 O ATOM 949 CB VAL A 66 -4.330 12.395 -6.685 1.00 0.00 C ATOM 950 CG1 VAL A 66 -5.200 12.469 -5.428 1.00 0.00 C ATOM 951 CG2 VAL A 66 -3.241 11.330 -6.536 1.00 0.00 C ATOM 0 H VAL A 66 -3.678 12.354 -9.369 1.00 0.00 H new ATOM 0 HA VAL A 66 -5.913 11.376 -7.652 1.00 0.00 H new ATOM 0 HB VAL A 66 -3.840 13.360 -6.810 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -4.569 12.653 -4.559 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -5.921 13.280 -5.531 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -5.731 11.526 -5.297 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -2.649 11.537 -5.644 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -3.703 10.347 -6.444 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -2.594 11.346 -7.413 1.00 0.00 H new ATOM 961 N SER A 67 -7.055 13.635 -7.685 1.00 0.00 N ATOM 962 CA SER A 67 -7.893 14.777 -8.008 1.00 0.00 C ATOM 963 C SER A 67 -8.784 15.127 -6.814 1.00 0.00 C ATOM 964 O SER A 67 -8.769 16.259 -6.334 1.00 0.00 O ATOM 965 CB SER A 67 -8.749 14.501 -9.245 1.00 0.00 C ATOM 966 OG SER A 67 -9.088 13.121 -9.363 1.00 0.00 O ATOM 0 H SER A 67 -7.379 13.078 -6.895 1.00 0.00 H new ATOM 0 HA SER A 67 -7.244 15.624 -8.230 1.00 0.00 H new ATOM 0 HB2 SER A 67 -9.661 15.095 -9.195 1.00 0.00 H new ATOM 0 HB3 SER A 67 -8.210 14.819 -10.137 1.00 0.00 H new ATOM 0 HG SER A 67 -9.035 12.850 -10.303 1.00 0.00 H new ATOM 972 N GLU A 68 -9.539 14.133 -6.369 1.00 0.00 N ATOM 973 CA GLU A 68 -10.435 14.321 -5.240 1.00 0.00 C ATOM 974 C GLU A 68 -10.987 12.974 -4.771 1.00 0.00 C ATOM 975 O GLU A 68 -11.016 12.010 -5.535 1.00 0.00 O ATOM 976 CB GLU A 68 -11.568 15.285 -5.594 1.00 0.00 C ATOM 977 CG GLU A 68 -12.609 14.604 -6.486 1.00 0.00 C ATOM 978 CD GLU A 68 -13.856 15.478 -6.638 1.00 0.00 C ATOM 979 OE1 GLU A 68 -13.833 16.349 -7.534 1.00 0.00 O ATOM 980 OE2 GLU A 68 -14.804 15.253 -5.855 1.00 0.00 O ATOM 0 H GLU A 68 -9.549 13.195 -6.770 1.00 0.00 H new ATOM 0 HA GLU A 68 -9.868 14.764 -4.421 1.00 0.00 H new ATOM 0 HB2 GLU A 68 -12.044 15.643 -4.681 1.00 0.00 H new ATOM 0 HB3 GLU A 68 -11.161 16.158 -6.105 1.00 0.00 H new ATOM 0 HG2 GLU A 68 -12.178 14.405 -7.467 1.00 0.00 H new ATOM 0 HG3 GLU A 68 -12.886 13.641 -6.058 1.00 0.00 H new ATOM 987 N GLY A 69 -11.412 12.949 -3.516 1.00 0.00 N ATOM 988 CA GLY A 69 -11.963 11.736 -2.936 1.00 0.00 C ATOM 989 C GLY A 69 -10.848 10.784 -2.495 1.00 0.00 C ATOM 990 O GLY A 69 -10.821 10.344 -1.347 1.00 0.00 O ATOM 0 H GLY A 69 -11.386 13.750 -2.885 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -12.589 11.989 -2.081 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -12.604 11.239 -3.664 1.00 0.00 H new ATOM 994 N THR A 70 -9.956 10.495 -3.431 1.00 0.00 N ATOM 995 CA THR A 70 -8.843 9.604 -3.154 1.00 0.00 C ATOM 996 C THR A 70 -7.757 10.337 -2.364 1.00 0.00 C ATOM 997 O THR A 70 -7.089 11.223 -2.895 1.00 0.00 O ATOM 998 CB THR A 70 -8.347 9.037 -4.486 1.00 0.00 C ATOM 999 OG1 THR A 70 -9.193 7.916 -4.723 1.00 0.00 O ATOM 1000 CG2 THR A 70 -6.946 8.432 -4.380 1.00 0.00 C ATOM 0 H THR A 70 -9.982 10.862 -4.382 1.00 0.00 H new ATOM 0 HA THR A 70 -9.152 8.770 -2.524 1.00 0.00 H new ATOM 0 HB THR A 70 -8.345 9.826 -5.238 1.00 0.00 H new ATOM 0 HG1 THR A 70 -8.765 7.314 -5.367 1.00 0.00 H new ATOM 0 HG21 THR A 70 -6.642 8.044 -5.353 1.00 0.00 H new ATOM 0 HG22 THR A 70 -6.242 9.199 -4.059 1.00 0.00 H new ATOM 0 HG23 THR A 70 -6.954 7.620 -3.653 1.00 0.00 H new ATOM 1008 N THR A 71 -7.615 9.941 -1.108 1.00 0.00 N ATOM 1009 CA THR A 71 -6.621 10.550 -0.239 1.00 0.00 C ATOM 1010 C THR A 71 -5.909 9.478 0.589 1.00 0.00 C ATOM 1011 O THR A 71 -5.169 9.797 1.518 1.00 0.00 O ATOM 1012 CB THR A 71 -7.323 11.609 0.613 1.00 0.00 C ATOM 1013 OG1 THR A 71 -8.208 10.858 1.440 1.00 0.00 O ATOM 1014 CG2 THR A 71 -8.252 12.502 -0.212 1.00 0.00 C ATOM 0 H THR A 71 -8.171 9.206 -0.671 1.00 0.00 H new ATOM 0 HA THR A 71 -5.839 11.043 -0.817 1.00 0.00 H new ATOM 0 HB THR A 71 -6.577 12.226 1.114 1.00 0.00 H new ATOM 0 HG1 THR A 71 -8.703 11.467 2.027 1.00 0.00 H new ATOM 0 HG21 THR A 71 -8.725 13.236 0.440 1.00 0.00 H new ATOM 0 HG22 THR A 71 -7.674 13.017 -0.979 1.00 0.00 H new ATOM 0 HG23 THR A 71 -9.019 11.890 -0.686 1.00 0.00 H new ATOM 1022 N GLU A 72 -6.157 8.230 0.221 1.00 0.00 N ATOM 1023 CA GLU A 72 -5.548 7.109 0.919 1.00 0.00 C ATOM 1024 C GLU A 72 -5.452 5.896 -0.009 1.00 0.00 C ATOM 1025 O GLU A 72 -6.393 5.593 -0.740 1.00 0.00 O ATOM 1026 CB GLU A 72 -6.327 6.767 2.190 1.00 0.00 C ATOM 1027 CG GLU A 72 -7.525 5.869 1.874 1.00 0.00 C ATOM 1028 CD GLU A 72 -8.592 5.974 2.966 1.00 0.00 C ATOM 1029 OE1 GLU A 72 -8.824 7.114 3.425 1.00 0.00 O ATOM 1030 OE2 GLU A 72 -9.151 4.913 3.318 1.00 0.00 O ATOM 0 H GLU A 72 -6.771 7.970 -0.551 1.00 0.00 H new ATOM 0 HA GLU A 72 -4.539 7.395 1.217 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -5.669 6.266 2.900 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -6.671 7.684 2.668 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -7.954 6.153 0.913 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -7.194 4.834 1.782 1.00 0.00 H new ATOM 1037 N LEU A 73 -4.305 5.235 0.052 1.00 0.00 N ATOM 1038 CA LEU A 73 -4.073 4.062 -0.774 1.00 0.00 C ATOM 1039 C LEU A 73 -4.410 2.804 0.029 1.00 0.00 C ATOM 1040 O LEU A 73 -4.155 2.744 1.231 1.00 0.00 O ATOM 1041 CB LEU A 73 -2.648 4.072 -1.331 1.00 0.00 C ATOM 1042 CG LEU A 73 -2.218 2.819 -2.095 1.00 0.00 C ATOM 1043 CD1 LEU A 73 -2.611 2.914 -3.571 1.00 0.00 C ATOM 1044 CD2 LEU A 73 -0.722 2.554 -1.917 1.00 0.00 C ATOM 0 H LEU A 73 -3.527 5.489 0.660 1.00 0.00 H new ATOM 0 HA LEU A 73 -4.730 4.072 -1.643 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -2.544 4.931 -1.994 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -1.956 4.223 -0.502 1.00 0.00 H new ATOM 0 HG LEU A 73 -2.749 1.965 -1.675 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -2.293 2.010 -4.091 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -3.693 3.019 -3.653 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -2.127 3.781 -4.021 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -0.443 1.657 -2.471 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -0.154 3.405 -2.294 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -0.501 2.411 -0.859 1.00 0.00 H new ATOM 1056 N LYS A 74 -4.979 1.831 -0.667 1.00 0.00 N ATOM 1057 CA LYS A 74 -5.354 0.578 -0.034 1.00 0.00 C ATOM 1058 C LYS A 74 -4.346 -0.506 -0.422 1.00 0.00 C ATOM 1059 O LYS A 74 -4.194 -0.824 -1.600 1.00 0.00 O ATOM 1060 CB LYS A 74 -6.803 0.220 -0.371 1.00 0.00 C ATOM 1061 CG LYS A 74 -7.756 0.702 0.725 1.00 0.00 C ATOM 1062 CD LYS A 74 -7.689 2.222 0.880 1.00 0.00 C ATOM 1063 CE LYS A 74 -9.073 2.852 0.705 1.00 0.00 C ATOM 1064 NZ LYS A 74 -9.144 3.601 -0.570 1.00 0.00 N ATOM 0 H LYS A 74 -5.190 1.885 -1.664 1.00 0.00 H new ATOM 0 HA LYS A 74 -5.318 0.673 1.051 1.00 0.00 H new ATOM 0 HB2 LYS A 74 -7.081 0.671 -1.324 1.00 0.00 H new ATOM 0 HB3 LYS A 74 -6.896 -0.859 -0.490 1.00 0.00 H new ATOM 0 HG2 LYS A 74 -8.776 0.402 0.483 1.00 0.00 H new ATOM 0 HG3 LYS A 74 -7.499 0.225 1.671 1.00 0.00 H new ATOM 0 HD2 LYS A 74 -7.292 2.474 1.864 1.00 0.00 H new ATOM 0 HD3 LYS A 74 -7.001 2.636 0.143 1.00 0.00 H new ATOM 0 HE2 LYS A 74 -9.837 2.075 0.720 1.00 0.00 H new ATOM 0 HE3 LYS A 74 -9.282 3.522 1.539 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 -10.004 4.185 -0.582 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 -8.308 4.214 -0.660 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 -9.169 2.931 -1.365 1.00 0.00 H new ATOM 1078 N ALA A 75 -3.684 -1.043 0.592 1.00 0.00 N ATOM 1079 CA ALA A 75 -2.695 -2.084 0.372 1.00 0.00 C ATOM 1080 C ALA A 75 -3.216 -3.405 0.942 1.00 0.00 C ATOM 1081 O ALA A 75 -3.148 -3.634 2.149 1.00 0.00 O ATOM 1082 CB ALA A 75 -1.363 -1.665 0.998 1.00 0.00 C ATOM 0 H ALA A 75 -3.813 -0.777 1.568 1.00 0.00 H new ATOM 0 HA ALA A 75 -2.523 -2.229 -0.694 1.00 0.00 H new ATOM 0 HB1 ALA A 75 -0.621 -2.447 0.833 1.00 0.00 H new ATOM 0 HB2 ALA A 75 -1.021 -0.737 0.539 1.00 0.00 H new ATOM 0 HB3 ALA A 75 -1.496 -1.512 2.069 1.00 0.00 H new ATOM 1088 N LYS A 76 -3.724 -4.239 0.047 1.00 0.00 N ATOM 1089 CA LYS A 76 -4.257 -5.531 0.446 1.00 0.00 C ATOM 1090 C LYS A 76 -3.213 -6.615 0.171 1.00 0.00 C ATOM 1091 O LYS A 76 -2.794 -6.803 -0.970 1.00 0.00 O ATOM 1092 CB LYS A 76 -5.604 -5.788 -0.233 1.00 0.00 C ATOM 1093 CG LYS A 76 -6.758 -5.262 0.623 1.00 0.00 C ATOM 1094 CD LYS A 76 -8.035 -6.068 0.377 1.00 0.00 C ATOM 1095 CE LYS A 76 -8.908 -6.109 1.633 1.00 0.00 C ATOM 1096 NZ LYS A 76 -9.394 -4.753 1.971 1.00 0.00 N ATOM 0 H LYS A 76 -3.778 -4.046 -0.953 1.00 0.00 H new ATOM 0 HA LYS A 76 -4.458 -5.546 1.517 1.00 0.00 H new ATOM 0 HB2 LYS A 76 -5.621 -5.305 -1.210 1.00 0.00 H new ATOM 0 HB3 LYS A 76 -5.731 -6.857 -0.404 1.00 0.00 H new ATOM 0 HG2 LYS A 76 -6.487 -5.316 1.677 1.00 0.00 H new ATOM 0 HG3 LYS A 76 -6.937 -4.212 0.393 1.00 0.00 H new ATOM 0 HD2 LYS A 76 -8.596 -5.625 -0.446 1.00 0.00 H new ATOM 0 HD3 LYS A 76 -7.776 -7.083 0.076 1.00 0.00 H new ATOM 0 HE2 LYS A 76 -9.755 -6.776 1.473 1.00 0.00 H new ATOM 0 HE3 LYS A 76 -8.336 -6.515 2.467 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 -10.078 -4.814 2.752 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 -8.591 -4.158 2.260 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 -9.855 -4.332 1.139 1.00 0.00 H new ATOM 1110 N ILE A 77 -2.823 -7.300 1.236 1.00 0.00 N ATOM 1111 CA ILE A 77 -1.836 -8.361 1.123 1.00 0.00 C ATOM 1112 C ILE A 77 -2.545 -9.680 0.811 1.00 0.00 C ATOM 1113 O ILE A 77 -3.550 -10.013 1.438 1.00 0.00 O ATOM 1114 CB ILE A 77 -0.962 -8.414 2.377 1.00 0.00 C ATOM 1115 CG1 ILE A 77 -0.309 -7.057 2.648 1.00 0.00 C ATOM 1116 CG2 ILE A 77 0.072 -9.538 2.277 1.00 0.00 C ATOM 1117 CD1 ILE A 77 -1.173 -6.211 3.585 1.00 0.00 C ATOM 0 H ILE A 77 -3.172 -7.141 2.181 1.00 0.00 H new ATOM 0 HA ILE A 77 -1.155 -8.162 0.296 1.00 0.00 H new ATOM 0 HB ILE A 77 -1.602 -8.639 3.230 1.00 0.00 H new ATOM 0 HG12 ILE A 77 0.676 -7.205 3.090 1.00 0.00 H new ATOM 0 HG13 ILE A 77 -0.160 -6.527 1.707 1.00 0.00 H new ATOM 0 HG21 ILE A 77 0.681 -9.554 3.181 1.00 0.00 H new ATOM 0 HG22 ILE A 77 -0.440 -10.494 2.167 1.00 0.00 H new ATOM 0 HG23 ILE A 77 0.712 -9.367 1.412 1.00 0.00 H new ATOM 0 HD11 ILE A 77 -0.686 -5.252 3.762 1.00 0.00 H new ATOM 0 HD12 ILE A 77 -2.149 -6.044 3.129 1.00 0.00 H new ATOM 0 HD13 ILE A 77 -1.300 -6.733 4.533 1.00 0.00 H new ATOM 1129 N PHE A 78 -1.994 -10.397 -0.158 1.00 0.00 N ATOM 1130 CA PHE A 78 -2.561 -11.673 -0.560 1.00 0.00 C ATOM 1131 C PHE A 78 -1.472 -12.739 -0.693 1.00 0.00 C ATOM 1132 O PHE A 78 -0.431 -12.653 -0.044 1.00 0.00 O ATOM 1133 CB PHE A 78 -3.218 -11.459 -1.925 1.00 0.00 C ATOM 1134 CG PHE A 78 -4.364 -10.445 -1.912 1.00 0.00 C ATOM 1135 CD1 PHE A 78 -5.600 -10.821 -1.488 1.00 0.00 C ATOM 1136 CD2 PHE A 78 -4.146 -9.168 -2.324 1.00 0.00 C ATOM 1137 CE1 PHE A 78 -6.663 -9.880 -1.477 1.00 0.00 C ATOM 1138 CE2 PHE A 78 -5.209 -8.226 -2.312 1.00 0.00 C ATOM 1139 CZ PHE A 78 -6.445 -8.602 -1.889 1.00 0.00 C ATOM 0 H PHE A 78 -1.161 -10.118 -0.676 1.00 0.00 H new ATOM 0 HA PHE A 78 -3.277 -12.015 0.188 1.00 0.00 H new ATOM 0 HB2 PHE A 78 -2.460 -11.126 -2.634 1.00 0.00 H new ATOM 0 HB3 PHE A 78 -3.596 -12.414 -2.289 1.00 0.00 H new ATOM 0 HD1 PHE A 78 -5.773 -11.835 -1.160 1.00 0.00 H new ATOM 0 HD2 PHE A 78 -3.164 -8.870 -2.661 1.00 0.00 H new ATOM 0 HE1 PHE A 78 -7.645 -10.179 -1.141 1.00 0.00 H new ATOM 0 HE2 PHE A 78 -5.035 -7.211 -2.639 1.00 0.00 H new ATOM 0 HZ PHE A 78 -7.254 -7.886 -1.880 1.00 0.00 H new ATOM 1149 N ASP A 79 -1.749 -13.720 -1.539 1.00 0.00 N ATOM 1150 CA ASP A 79 -0.806 -14.802 -1.766 1.00 0.00 C ATOM 1151 C ASP A 79 -0.969 -15.325 -3.195 1.00 0.00 C ATOM 1152 O ASP A 79 -2.082 -15.620 -3.628 1.00 0.00 O ATOM 1153 CB ASP A 79 -1.061 -15.965 -0.805 1.00 0.00 C ATOM 1154 CG ASP A 79 -1.414 -15.556 0.626 1.00 0.00 C ATOM 1155 OD1 ASP A 79 -0.738 -14.637 1.136 1.00 0.00 O ATOM 1156 OD2 ASP A 79 -2.351 -16.172 1.178 1.00 0.00 O ATOM 0 H ASP A 79 -2.614 -13.788 -2.076 1.00 0.00 H new ATOM 0 HA ASP A 79 0.199 -14.413 -1.603 1.00 0.00 H new ATOM 0 HB2 ASP A 79 -1.872 -16.574 -1.203 1.00 0.00 H new ATOM 0 HB3 ASP A 79 -0.172 -16.596 -0.778 1.00 0.00 H new ATOM 1161 N LYS A 80 0.156 -15.422 -3.887 1.00 0.00 N ATOM 1162 CA LYS A 80 0.151 -15.904 -5.258 1.00 0.00 C ATOM 1163 C LYS A 80 -0.714 -17.163 -5.349 1.00 0.00 C ATOM 1164 O LYS A 80 -1.220 -17.496 -6.419 1.00 0.00 O ATOM 1165 CB LYS A 80 1.583 -16.104 -5.760 1.00 0.00 C ATOM 1166 CG LYS A 80 2.091 -17.507 -5.425 1.00 0.00 C ATOM 1167 CD LYS A 80 3.436 -17.780 -6.100 1.00 0.00 C ATOM 1168 CE LYS A 80 3.373 -19.045 -6.958 1.00 0.00 C ATOM 1169 NZ LYS A 80 4.733 -19.572 -7.206 1.00 0.00 N ATOM 0 H LYS A 80 1.077 -15.175 -3.525 1.00 0.00 H new ATOM 0 HA LYS A 80 -0.295 -15.162 -5.921 1.00 0.00 H new ATOM 0 HB2 LYS A 80 1.619 -15.948 -6.838 1.00 0.00 H new ATOM 0 HB3 LYS A 80 2.238 -15.359 -5.308 1.00 0.00 H new ATOM 0 HG2 LYS A 80 2.194 -17.612 -4.345 1.00 0.00 H new ATOM 0 HG3 LYS A 80 1.361 -18.249 -5.749 1.00 0.00 H new ATOM 0 HD2 LYS A 80 3.714 -16.929 -6.721 1.00 0.00 H new ATOM 0 HD3 LYS A 80 4.212 -17.889 -5.342 1.00 0.00 H new ATOM 0 HE2 LYS A 80 2.769 -19.802 -6.457 1.00 0.00 H new ATOM 0 HE3 LYS A 80 2.884 -18.824 -7.907 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 4.672 -20.431 -7.790 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 5.298 -18.855 -7.704 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 5.187 -19.802 -6.299 1.00 0.00 H new ATOM 1183 N ASP A 81 -0.856 -17.828 -4.212 1.00 0.00 N ATOM 1184 CA ASP A 81 -1.651 -19.042 -4.150 1.00 0.00 C ATOM 1185 C ASP A 81 -3.135 -18.674 -4.115 1.00 0.00 C ATOM 1186 O ASP A 81 -3.949 -19.293 -4.799 1.00 0.00 O ATOM 1187 CB ASP A 81 -1.333 -19.845 -2.887 1.00 0.00 C ATOM 1188 CG ASP A 81 -0.044 -20.667 -2.950 1.00 0.00 C ATOM 1189 OD1 ASP A 81 0.579 -20.663 -4.034 1.00 0.00 O ATOM 1190 OD2 ASP A 81 0.289 -21.281 -1.914 1.00 0.00 O ATOM 0 H ASP A 81 -0.434 -17.549 -3.326 1.00 0.00 H new ATOM 0 HA ASP A 81 -1.416 -19.643 -5.028 1.00 0.00 H new ATOM 0 HB2 ASP A 81 -1.266 -19.157 -2.044 1.00 0.00 H new ATOM 0 HB3 ASP A 81 -2.166 -20.518 -2.684 1.00 0.00 H new ATOM 1195 N VAL A 82 -3.444 -17.667 -3.311 1.00 0.00 N ATOM 1196 CA VAL A 82 -4.816 -17.209 -3.177 1.00 0.00 C ATOM 1197 C VAL A 82 -5.173 -16.325 -4.374 1.00 0.00 C ATOM 1198 O VAL A 82 -4.745 -16.592 -5.496 1.00 0.00 O ATOM 1199 CB VAL A 82 -5.003 -16.500 -1.834 1.00 0.00 C ATOM 1200 CG1 VAL A 82 -4.393 -17.318 -0.694 1.00 0.00 C ATOM 1201 CG2 VAL A 82 -4.415 -15.088 -1.873 1.00 0.00 C ATOM 0 H VAL A 82 -2.767 -17.155 -2.745 1.00 0.00 H new ATOM 0 HA VAL A 82 -5.503 -18.055 -3.181 1.00 0.00 H new ATOM 0 HB VAL A 82 -6.073 -16.411 -1.647 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -4.539 -16.792 0.250 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -4.878 -18.293 -0.645 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -3.326 -17.452 -0.873 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -4.561 -14.606 -0.906 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -3.349 -15.144 -2.093 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -4.915 -14.507 -2.647 1.00 0.00 H new ATOM 1211 N GLY A 83 -5.952 -15.291 -4.094 1.00 0.00 N ATOM 1212 CA GLY A 83 -6.371 -14.366 -5.134 1.00 0.00 C ATOM 1213 C GLY A 83 -6.938 -13.081 -4.528 1.00 0.00 C ATOM 1214 O GLY A 83 -7.442 -13.089 -3.406 1.00 0.00 O ATOM 0 H GLY A 83 -6.304 -15.073 -3.162 1.00 0.00 H new ATOM 0 HA2 GLY A 83 -5.523 -14.126 -5.776 1.00 0.00 H new ATOM 0 HA3 GLY A 83 -7.124 -14.839 -5.764 1.00 0.00 H new ATOM 1218 N THR A 84 -6.837 -12.007 -5.298 1.00 0.00 N ATOM 1219 CA THR A 84 -7.334 -10.717 -4.852 1.00 0.00 C ATOM 1220 C THR A 84 -8.650 -10.886 -4.091 1.00 0.00 C ATOM 1221 O THR A 84 -8.719 -10.613 -2.894 1.00 0.00 O ATOM 1222 CB THR A 84 -7.452 -9.807 -6.076 1.00 0.00 C ATOM 1223 OG1 THR A 84 -8.309 -10.524 -6.960 1.00 0.00 O ATOM 1224 CG2 THR A 84 -6.136 -9.688 -6.847 1.00 0.00 C ATOM 0 H THR A 84 -6.418 -12.004 -6.228 1.00 0.00 H new ATOM 0 HA THR A 84 -6.646 -10.250 -4.147 1.00 0.00 H new ATOM 0 HB THR A 84 -7.778 -8.816 -5.761 1.00 0.00 H new ATOM 0 HG1 THR A 84 -8.441 -10.005 -7.780 1.00 0.00 H new ATOM 0 HG21 THR A 84 -6.275 -9.031 -7.706 1.00 0.00 H new ATOM 0 HG22 THR A 84 -5.368 -9.274 -6.194 1.00 0.00 H new ATOM 0 HG23 THR A 84 -5.826 -10.674 -7.191 1.00 0.00 H new ATOM 1232 N GLU A 85 -9.663 -11.337 -4.817 1.00 0.00 N ATOM 1233 CA GLU A 85 -10.973 -11.546 -4.226 1.00 0.00 C ATOM 1234 C GLU A 85 -10.921 -12.687 -3.209 1.00 0.00 C ATOM 1235 O GLU A 85 -11.320 -12.517 -2.058 1.00 0.00 O ATOM 1236 CB GLU A 85 -12.024 -11.820 -5.304 1.00 0.00 C ATOM 1237 CG GLU A 85 -11.711 -13.114 -6.057 1.00 0.00 C ATOM 1238 CD GLU A 85 -12.559 -13.228 -7.326 1.00 0.00 C ATOM 1239 OE1 GLU A 85 -13.781 -13.440 -7.175 1.00 0.00 O ATOM 1240 OE2 GLU A 85 -11.965 -13.100 -8.419 1.00 0.00 O ATOM 0 H GLU A 85 -9.602 -11.563 -5.810 1.00 0.00 H new ATOM 0 HA GLU A 85 -11.264 -10.634 -3.705 1.00 0.00 H new ATOM 0 HB2 GLU A 85 -13.010 -11.891 -4.846 1.00 0.00 H new ATOM 0 HB3 GLU A 85 -12.057 -10.986 -6.005 1.00 0.00 H new ATOM 0 HG2 GLU A 85 -10.653 -13.140 -6.318 1.00 0.00 H new ATOM 0 HG3 GLU A 85 -11.901 -13.971 -5.410 1.00 0.00 H new ATOM 1247 N ASP A 86 -10.425 -13.826 -3.670 1.00 0.00 N ATOM 1248 CA ASP A 86 -10.315 -14.995 -2.815 1.00 0.00 C ATOM 1249 C ASP A 86 -10.246 -14.548 -1.353 1.00 0.00 C ATOM 1250 O ASP A 86 -11.243 -14.605 -0.636 1.00 0.00 O ATOM 1251 CB ASP A 86 -9.044 -15.788 -3.127 1.00 0.00 C ATOM 1252 CG ASP A 86 -9.267 -17.087 -3.904 1.00 0.00 C ATOM 1253 OD1 ASP A 86 -10.449 -17.394 -4.170 1.00 0.00 O ATOM 1254 OD2 ASP A 86 -8.249 -17.743 -4.216 1.00 0.00 O ATOM 0 H ASP A 86 -10.095 -13.964 -4.625 1.00 0.00 H new ATOM 0 HA ASP A 86 -11.186 -15.625 -2.992 1.00 0.00 H new ATOM 0 HB2 ASP A 86 -8.368 -15.152 -3.698 1.00 0.00 H new ATOM 0 HB3 ASP A 86 -8.542 -16.025 -2.189 1.00 0.00 H new ATOM 1259 N ASP A 87 -9.059 -14.114 -0.955 1.00 0.00 N ATOM 1260 CA ASP A 87 -8.847 -13.658 0.408 1.00 0.00 C ATOM 1261 C ASP A 87 -7.450 -13.046 0.525 1.00 0.00 C ATOM 1262 O ASP A 87 -6.490 -13.567 -0.042 1.00 0.00 O ATOM 1263 CB ASP A 87 -8.939 -14.820 1.398 1.00 0.00 C ATOM 1264 CG ASP A 87 -10.294 -14.975 2.090 1.00 0.00 C ATOM 1265 OD1 ASP A 87 -10.892 -13.925 2.409 1.00 0.00 O ATOM 1266 OD2 ASP A 87 -10.702 -16.140 2.285 1.00 0.00 O ATOM 0 H ASP A 87 -8.234 -14.069 -1.553 1.00 0.00 H new ATOM 0 HA ASP A 87 -9.618 -12.924 0.642 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -8.710 -15.746 0.870 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -8.171 -14.689 2.161 1.00 0.00 H new ATOM 1271 N ALA A 88 -7.379 -11.948 1.263 1.00 0.00 N ATOM 1272 CA ALA A 88 -6.116 -11.260 1.462 1.00 0.00 C ATOM 1273 C ALA A 88 -5.587 -11.566 2.865 1.00 0.00 C ATOM 1274 O ALA A 88 -6.307 -11.414 3.850 1.00 0.00 O ATOM 1275 CB ALA A 88 -6.308 -9.760 1.227 1.00 0.00 C ATOM 0 H ALA A 88 -8.177 -11.518 1.731 1.00 0.00 H new ATOM 0 HA ALA A 88 -5.373 -11.610 0.746 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -5.360 -9.244 1.377 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -6.655 -9.593 0.207 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -7.046 -9.373 1.930 1.00 0.00 H new ATOM 1281 N VAL A 89 -4.334 -11.994 2.910 1.00 0.00 N ATOM 1282 CA VAL A 89 -3.701 -12.324 4.176 1.00 0.00 C ATOM 1283 C VAL A 89 -3.872 -11.153 5.146 1.00 0.00 C ATOM 1284 O VAL A 89 -3.793 -11.333 6.361 1.00 0.00 O ATOM 1285 CB VAL A 89 -2.236 -12.701 3.946 1.00 0.00 C ATOM 1286 CG1 VAL A 89 -2.107 -14.167 3.529 1.00 0.00 C ATOM 1287 CG2 VAL A 89 -1.588 -11.778 2.913 1.00 0.00 C ATOM 0 H VAL A 89 -3.740 -12.120 2.090 1.00 0.00 H new ATOM 0 HA VAL A 89 -4.179 -13.193 4.628 1.00 0.00 H new ATOM 0 HB VAL A 89 -1.705 -12.573 4.889 1.00 0.00 H new ATOM 0 HG11 VAL A 89 -1.056 -14.409 3.372 1.00 0.00 H new ATOM 0 HG12 VAL A 89 -2.513 -14.806 4.313 1.00 0.00 H new ATOM 0 HG13 VAL A 89 -2.660 -14.332 2.604 1.00 0.00 H new ATOM 0 HG21 VAL A 89 -0.547 -12.068 2.768 1.00 0.00 H new ATOM 0 HG22 VAL A 89 -2.122 -11.859 1.966 1.00 0.00 H new ATOM 0 HG23 VAL A 89 -1.632 -10.748 3.267 1.00 0.00 H new ATOM 1297 N GLY A 90 -4.102 -9.980 4.574 1.00 0.00 N ATOM 1298 CA GLY A 90 -4.284 -8.781 5.374 1.00 0.00 C ATOM 1299 C GLY A 90 -4.343 -7.535 4.488 1.00 0.00 C ATOM 1300 O GLY A 90 -4.286 -7.637 3.263 1.00 0.00 O ATOM 0 H GLY A 90 -4.166 -9.835 3.566 1.00 0.00 H new ATOM 0 HA2 GLY A 90 -5.203 -8.863 5.954 1.00 0.00 H new ATOM 0 HA3 GLY A 90 -3.464 -8.687 6.086 1.00 0.00 H new ATOM 1304 N GLU A 91 -4.455 -6.388 5.141 1.00 0.00 N ATOM 1305 CA GLU A 91 -4.522 -5.124 4.428 1.00 0.00 C ATOM 1306 C GLU A 91 -3.981 -3.991 5.303 1.00 0.00 C ATOM 1307 O GLU A 91 -3.738 -4.184 6.493 1.00 0.00 O ATOM 1308 CB GLU A 91 -5.952 -4.827 3.970 1.00 0.00 C ATOM 1309 CG GLU A 91 -6.794 -4.278 5.124 1.00 0.00 C ATOM 1310 CD GLU A 91 -7.133 -2.803 4.900 1.00 0.00 C ATOM 1311 OE1 GLU A 91 -7.557 -2.483 3.769 1.00 0.00 O ATOM 1312 OE2 GLU A 91 -6.960 -2.028 5.866 1.00 0.00 O ATOM 0 H GLU A 91 -4.501 -6.307 6.157 1.00 0.00 H new ATOM 0 HA GLU A 91 -3.898 -5.199 3.537 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -5.934 -4.106 3.153 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -6.410 -5.737 3.582 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -7.713 -4.856 5.216 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -6.251 -4.392 6.062 1.00 0.00 H new ATOM 1319 N ALA A 92 -3.807 -2.836 4.678 1.00 0.00 N ATOM 1320 CA ALA A 92 -3.298 -1.673 5.385 1.00 0.00 C ATOM 1321 C ALA A 92 -3.852 -0.403 4.734 1.00 0.00 C ATOM 1322 O ALA A 92 -4.200 -0.407 3.554 1.00 0.00 O ATOM 1323 CB ALA A 92 -1.768 -1.706 5.389 1.00 0.00 C ATOM 0 H ALA A 92 -4.009 -2.681 3.690 1.00 0.00 H new ATOM 0 HA ALA A 92 -3.627 -1.682 6.424 1.00 0.00 H new ATOM 0 HB1 ALA A 92 -1.387 -0.833 5.919 1.00 0.00 H new ATOM 0 HB2 ALA A 92 -1.425 -2.612 5.888 1.00 0.00 H new ATOM 0 HB3 ALA A 92 -1.401 -1.696 4.363 1.00 0.00 H new ATOM 1329 N THR A 93 -3.917 0.652 5.532 1.00 0.00 N ATOM 1330 CA THR A 93 -4.423 1.926 5.049 1.00 0.00 C ATOM 1331 C THR A 93 -3.292 2.952 4.964 1.00 0.00 C ATOM 1332 O THR A 93 -2.758 3.379 5.987 1.00 0.00 O ATOM 1333 CB THR A 93 -5.568 2.358 5.967 1.00 0.00 C ATOM 1334 OG1 THR A 93 -6.595 1.402 5.716 1.00 0.00 O ATOM 1335 CG2 THR A 93 -6.189 3.691 5.541 1.00 0.00 C ATOM 0 H THR A 93 -3.628 0.651 6.510 1.00 0.00 H new ATOM 0 HA THR A 93 -4.815 1.837 4.036 1.00 0.00 H new ATOM 0 HB THR A 93 -5.201 2.438 6.990 1.00 0.00 H new ATOM 0 HG1 THR A 93 -7.375 1.607 6.272 1.00 0.00 H new ATOM 0 HG21 THR A 93 -6.996 3.951 6.225 1.00 0.00 H new ATOM 0 HG22 THR A 93 -5.428 4.471 5.564 1.00 0.00 H new ATOM 0 HG23 THR A 93 -6.586 3.601 4.530 1.00 0.00 H new ATOM 1343 N ILE A 94 -2.958 3.317 3.735 1.00 0.00 N ATOM 1344 CA ILE A 94 -1.900 4.285 3.504 1.00 0.00 C ATOM 1345 C ILE A 94 -2.513 5.599 3.017 1.00 0.00 C ATOM 1346 O ILE A 94 -2.853 5.732 1.842 1.00 0.00 O ATOM 1347 CB ILE A 94 -0.846 3.710 2.555 1.00 0.00 C ATOM 1348 CG1 ILE A 94 -0.224 2.437 3.134 1.00 0.00 C ATOM 1349 CG2 ILE A 94 0.212 4.759 2.210 1.00 0.00 C ATOM 1350 CD1 ILE A 94 -0.283 1.290 2.124 1.00 0.00 C ATOM 0 H ILE A 94 -3.402 2.960 2.889 1.00 0.00 H new ATOM 0 HA ILE A 94 -1.375 4.503 4.434 1.00 0.00 H new ATOM 0 HB ILE A 94 -1.340 3.433 1.624 1.00 0.00 H new ATOM 0 HG12 ILE A 94 0.812 2.628 3.412 1.00 0.00 H new ATOM 0 HG13 ILE A 94 -0.751 2.152 4.045 1.00 0.00 H new ATOM 0 HG21 ILE A 94 0.949 4.324 1.534 1.00 0.00 H new ATOM 0 HG22 ILE A 94 -0.265 5.612 1.727 1.00 0.00 H new ATOM 0 HG23 ILE A 94 0.707 5.090 3.123 1.00 0.00 H new ATOM 0 HD11 ILE A 94 0.165 0.397 2.560 1.00 0.00 H new ATOM 0 HD12 ILE A 94 -1.322 1.085 1.866 1.00 0.00 H new ATOM 0 HD13 ILE A 94 0.266 1.569 1.224 1.00 0.00 H new ATOM 1362 N PRO A 95 -2.640 6.562 3.969 1.00 0.00 N ATOM 1363 CA PRO A 95 -3.207 7.861 3.649 1.00 0.00 C ATOM 1364 C PRO A 95 -2.209 8.717 2.866 1.00 0.00 C ATOM 1365 O PRO A 95 -1.033 8.787 3.222 1.00 0.00 O ATOM 1366 CB PRO A 95 -3.585 8.467 4.990 1.00 0.00 C ATOM 1367 CG PRO A 95 -2.797 7.692 6.034 1.00 0.00 C ATOM 1368 CD PRO A 95 -2.248 6.440 5.370 1.00 0.00 C ATOM 0 HA PRO A 95 -4.079 7.790 2.999 1.00 0.00 H new ATOM 0 HB2 PRO A 95 -3.338 9.528 5.023 1.00 0.00 H new ATOM 0 HB3 PRO A 95 -4.657 8.383 5.168 1.00 0.00 H new ATOM 0 HG2 PRO A 95 -1.985 8.302 6.429 1.00 0.00 H new ATOM 0 HG3 PRO A 95 -3.436 7.428 6.876 1.00 0.00 H new ATOM 0 HD2 PRO A 95 -1.165 6.379 5.474 1.00 0.00 H new ATOM 0 HD3 PRO A 95 -2.663 5.538 5.820 1.00 0.00 H new ATOM 1376 N LEU A 96 -2.714 9.347 1.816 1.00 0.00 N ATOM 1377 CA LEU A 96 -1.882 10.196 0.980 1.00 0.00 C ATOM 1378 C LEU A 96 -2.059 11.655 1.406 1.00 0.00 C ATOM 1379 O LEU A 96 -1.679 12.569 0.675 1.00 0.00 O ATOM 1380 CB LEU A 96 -2.178 9.946 -0.500 1.00 0.00 C ATOM 1381 CG LEU A 96 -2.600 8.523 -0.869 1.00 0.00 C ATOM 1382 CD1 LEU A 96 -3.462 8.517 -2.133 1.00 0.00 C ATOM 1383 CD2 LEU A 96 -1.382 7.607 -1.002 1.00 0.00 C ATOM 0 H LEU A 96 -3.690 9.287 1.525 1.00 0.00 H new ATOM 0 HA LEU A 96 -0.829 9.950 1.116 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -2.967 10.630 -0.813 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -1.288 10.201 -1.076 1.00 0.00 H new ATOM 0 HG LEU A 96 -3.213 8.128 -0.059 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -3.748 7.493 -2.373 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -4.358 9.115 -1.965 1.00 0.00 H new ATOM 0 HD13 LEU A 96 -2.895 8.939 -2.962 1.00 0.00 H new ATOM 0 HD21 LEU A 96 -1.710 6.601 -1.265 1.00 0.00 H new ATOM 0 HD22 LEU A 96 -0.723 7.989 -1.782 1.00 0.00 H new ATOM 0 HD23 LEU A 96 -0.844 7.577 -0.054 1.00 0.00 H new ATOM 1395 N GLU A 97 -2.637 11.827 2.586 1.00 0.00 N ATOM 1396 CA GLU A 97 -2.870 13.160 3.117 1.00 0.00 C ATOM 1397 C GLU A 97 -1.555 13.775 3.602 1.00 0.00 C ATOM 1398 O GLU A 97 -1.365 14.987 3.519 1.00 0.00 O ATOM 1399 CB GLU A 97 -3.908 13.129 4.240 1.00 0.00 C ATOM 1400 CG GLU A 97 -4.977 14.202 4.028 1.00 0.00 C ATOM 1401 CD GLU A 97 -5.701 14.521 5.338 1.00 0.00 C ATOM 1402 OE1 GLU A 97 -4.994 14.650 6.361 1.00 0.00 O ATOM 1403 OE2 GLU A 97 -6.945 14.628 5.287 1.00 0.00 O ATOM 0 H GLU A 97 -2.951 11.066 3.189 1.00 0.00 H new ATOM 0 HA GLU A 97 -3.268 13.785 2.317 1.00 0.00 H new ATOM 0 HB2 GLU A 97 -4.377 12.146 4.279 1.00 0.00 H new ATOM 0 HB3 GLU A 97 -3.416 13.286 5.200 1.00 0.00 H new ATOM 0 HG2 GLU A 97 -4.515 15.107 3.634 1.00 0.00 H new ATOM 0 HG3 GLU A 97 -5.697 13.861 3.284 1.00 0.00 H new ATOM 1410 N PRO A 98 -0.659 12.887 4.111 1.00 0.00 N ATOM 1411 CA PRO A 98 0.632 13.330 4.609 1.00 0.00 C ATOM 1412 C PRO A 98 1.576 13.675 3.456 1.00 0.00 C ATOM 1413 O PRO A 98 2.495 14.477 3.619 1.00 0.00 O ATOM 1414 CB PRO A 98 1.138 12.182 5.467 1.00 0.00 C ATOM 1415 CG PRO A 98 0.335 10.962 5.046 1.00 0.00 C ATOM 1416 CD PRO A 98 -0.850 11.445 4.225 1.00 0.00 C ATOM 0 HA PRO A 98 0.564 14.247 5.194 1.00 0.00 H new ATOM 0 HB2 PRO A 98 2.205 12.020 5.313 1.00 0.00 H new ATOM 0 HB3 PRO A 98 0.998 12.395 6.527 1.00 0.00 H new ATOM 0 HG2 PRO A 98 0.953 10.281 4.460 1.00 0.00 H new ATOM 0 HG3 PRO A 98 -0.007 10.409 5.921 1.00 0.00 H new ATOM 0 HD2 PRO A 98 -0.872 10.970 3.244 1.00 0.00 H new ATOM 0 HD3 PRO A 98 -1.794 11.208 4.715 1.00 0.00 H new ATOM 1424 N VAL A 99 1.318 13.053 2.315 1.00 0.00 N ATOM 1425 CA VAL A 99 2.133 13.284 1.135 1.00 0.00 C ATOM 1426 C VAL A 99 1.522 14.421 0.313 1.00 0.00 C ATOM 1427 O VAL A 99 2.227 15.103 -0.429 1.00 0.00 O ATOM 1428 CB VAL A 99 2.283 11.985 0.340 1.00 0.00 C ATOM 1429 CG1 VAL A 99 3.700 11.422 0.472 1.00 0.00 C ATOM 1430 CG2 VAL A 99 1.240 10.953 0.774 1.00 0.00 C ATOM 0 H VAL A 99 0.555 12.389 2.183 1.00 0.00 H new ATOM 0 HA VAL A 99 3.139 13.593 1.420 1.00 0.00 H new ATOM 0 HB VAL A 99 2.110 12.214 -0.712 1.00 0.00 H new ATOM 0 HG11 VAL A 99 3.780 10.499 -0.102 1.00 0.00 H new ATOM 0 HG12 VAL A 99 4.417 12.149 0.092 1.00 0.00 H new ATOM 0 HG13 VAL A 99 3.914 11.216 1.521 1.00 0.00 H new ATOM 0 HG21 VAL A 99 1.369 10.039 0.194 1.00 0.00 H new ATOM 0 HG22 VAL A 99 1.367 10.731 1.834 1.00 0.00 H new ATOM 0 HG23 VAL A 99 0.240 11.353 0.604 1.00 0.00 H new ATOM 1440 N PHE A 100 0.218 14.589 0.473 1.00 0.00 N ATOM 1441 CA PHE A 100 -0.496 15.632 -0.245 1.00 0.00 C ATOM 1442 C PHE A 100 -0.051 17.020 0.219 1.00 0.00 C ATOM 1443 O PHE A 100 -0.024 17.963 -0.570 1.00 0.00 O ATOM 1444 CB PHE A 100 -1.982 15.454 0.070 1.00 0.00 C ATOM 1445 CG PHE A 100 -2.672 14.376 -0.769 1.00 0.00 C ATOM 1446 CD1 PHE A 100 -1.943 13.612 -1.626 1.00 0.00 C ATOM 1447 CD2 PHE A 100 -4.013 14.182 -0.657 1.00 0.00 C ATOM 1448 CE1 PHE A 100 -2.583 12.611 -2.404 1.00 0.00 C ATOM 1449 CE2 PHE A 100 -4.653 13.181 -1.436 1.00 0.00 C ATOM 1450 CZ PHE A 100 -3.924 12.417 -2.293 1.00 0.00 C ATOM 0 H PHE A 100 -0.363 14.021 1.089 1.00 0.00 H new ATOM 0 HA PHE A 100 -0.294 15.554 -1.313 1.00 0.00 H new ATOM 0 HB2 PHE A 100 -2.092 15.204 1.125 1.00 0.00 H new ATOM 0 HB3 PHE A 100 -2.492 16.404 -0.087 1.00 0.00 H new ATOM 0 HD1 PHE A 100 -0.878 13.766 -1.715 1.00 0.00 H new ATOM 0 HD2 PHE A 100 -4.592 14.789 0.024 1.00 0.00 H new ATOM 0 HE1 PHE A 100 -2.004 12.004 -3.084 1.00 0.00 H new ATOM 0 HE2 PHE A 100 -5.718 13.027 -1.348 1.00 0.00 H new ATOM 0 HZ PHE A 100 -4.410 11.656 -2.885 1.00 0.00 H new ATOM 1460 N VAL A 101 0.288 17.101 1.497 1.00 0.00 N ATOM 1461 CA VAL A 101 0.731 18.359 2.076 1.00 0.00 C ATOM 1462 C VAL A 101 2.260 18.417 2.048 1.00 0.00 C ATOM 1463 O VAL A 101 2.838 19.394 1.574 1.00 0.00 O ATOM 1464 CB VAL A 101 0.152 18.520 3.483 1.00 0.00 C ATOM 1465 CG1 VAL A 101 -1.268 17.955 3.559 1.00 0.00 C ATOM 1466 CG2 VAL A 101 1.059 17.866 4.527 1.00 0.00 C ATOM 0 H VAL A 101 0.265 16.316 2.148 1.00 0.00 H new ATOM 0 HA VAL A 101 0.363 19.201 1.490 1.00 0.00 H new ATOM 0 HB VAL A 101 0.101 19.586 3.705 1.00 0.00 H new ATOM 0 HG11 VAL A 101 -1.656 18.082 4.569 1.00 0.00 H new ATOM 0 HG12 VAL A 101 -1.909 18.485 2.855 1.00 0.00 H new ATOM 0 HG13 VAL A 101 -1.252 16.895 3.307 1.00 0.00 H new ATOM 0 HG21 VAL A 101 0.625 17.995 5.518 1.00 0.00 H new ATOM 0 HG22 VAL A 101 1.157 16.802 4.309 1.00 0.00 H new ATOM 0 HG23 VAL A 101 2.043 18.334 4.499 1.00 0.00 H new ATOM 1476 N GLU A 102 2.870 17.360 2.563 1.00 0.00 N ATOM 1477 CA GLU A 102 4.320 17.279 2.603 1.00 0.00 C ATOM 1478 C GLU A 102 4.887 17.189 1.184 1.00 0.00 C ATOM 1479 O GLU A 102 5.867 17.857 0.860 1.00 0.00 O ATOM 1480 CB GLU A 102 4.780 16.093 3.453 1.00 0.00 C ATOM 1481 CG GLU A 102 4.253 16.208 4.885 1.00 0.00 C ATOM 1482 CD GLU A 102 5.378 16.566 5.857 1.00 0.00 C ATOM 1483 OE1 GLU A 102 6.235 15.684 6.083 1.00 0.00 O ATOM 1484 OE2 GLU A 102 5.357 17.714 6.352 1.00 0.00 O ATOM 0 H GLU A 102 2.387 16.552 2.956 1.00 0.00 H new ATOM 0 HA GLU A 102 4.702 18.188 3.069 1.00 0.00 H new ATOM 0 HB2 GLU A 102 4.429 15.163 3.006 1.00 0.00 H new ATOM 0 HB3 GLU A 102 5.869 16.050 3.465 1.00 0.00 H new ATOM 0 HG2 GLU A 102 3.474 16.969 4.929 1.00 0.00 H new ATOM 0 HG3 GLU A 102 3.795 15.265 5.185 1.00 0.00 H new ATOM 1491 N GLY A 103 4.244 16.358 0.377 1.00 0.00 N ATOM 1492 CA GLY A 103 4.672 16.171 -0.999 1.00 0.00 C ATOM 1493 C GLY A 103 5.561 14.934 -1.134 1.00 0.00 C ATOM 1494 O GLY A 103 5.852 14.492 -2.245 1.00 0.00 O ATOM 0 H GLY A 103 3.430 15.807 0.649 1.00 0.00 H new ATOM 0 HA2 GLY A 103 3.799 16.068 -1.644 1.00 0.00 H new ATOM 0 HA3 GLY A 103 5.216 17.053 -1.337 1.00 0.00 H new ATOM 1498 N SER A 104 5.970 14.410 0.012 1.00 0.00 N ATOM 1499 CA SER A 104 6.821 13.233 0.036 1.00 0.00 C ATOM 1500 C SER A 104 6.881 12.659 1.453 1.00 0.00 C ATOM 1501 O SER A 104 7.148 13.385 2.409 1.00 0.00 O ATOM 1502 CB SER A 104 8.229 13.561 -0.464 1.00 0.00 C ATOM 1503 OG SER A 104 8.768 14.714 0.176 1.00 0.00 O ATOM 0 H SER A 104 5.727 14.779 0.931 1.00 0.00 H new ATOM 0 HA SER A 104 6.392 12.487 -0.633 1.00 0.00 H new ATOM 0 HB2 SER A 104 8.884 12.708 -0.287 1.00 0.00 H new ATOM 0 HB3 SER A 104 8.202 13.724 -1.541 1.00 0.00 H new ATOM 0 HG SER A 104 8.577 14.675 1.136 1.00 0.00 H new ATOM 1509 N ILE A 105 6.628 11.362 1.543 1.00 0.00 N ATOM 1510 CA ILE A 105 6.650 10.682 2.827 1.00 0.00 C ATOM 1511 C ILE A 105 7.534 9.437 2.725 1.00 0.00 C ATOM 1512 O ILE A 105 7.507 8.734 1.717 1.00 0.00 O ATOM 1513 CB ILE A 105 5.226 10.389 3.303 1.00 0.00 C ATOM 1514 CG1 ILE A 105 4.388 11.668 3.347 1.00 0.00 C ATOM 1515 CG2 ILE A 105 5.236 9.663 4.649 1.00 0.00 C ATOM 1516 CD1 ILE A 105 4.544 12.379 4.693 1.00 0.00 C ATOM 0 H ILE A 105 6.407 10.763 0.747 1.00 0.00 H new ATOM 0 HA ILE A 105 7.090 11.324 3.590 1.00 0.00 H new ATOM 0 HB ILE A 105 4.756 9.721 2.581 1.00 0.00 H new ATOM 0 HG12 ILE A 105 4.694 12.335 2.541 1.00 0.00 H new ATOM 0 HG13 ILE A 105 3.339 11.426 3.179 1.00 0.00 H new ATOM 0 HG21 ILE A 105 4.211 9.467 4.964 1.00 0.00 H new ATOM 0 HG22 ILE A 105 5.772 8.719 4.549 1.00 0.00 H new ATOM 0 HG23 ILE A 105 5.732 10.285 5.394 1.00 0.00 H new ATOM 0 HD11 ILE A 105 3.938 13.285 4.698 1.00 0.00 H new ATOM 0 HD12 ILE A 105 4.214 11.718 5.494 1.00 0.00 H new ATOM 0 HD13 ILE A 105 5.591 12.642 4.847 1.00 0.00 H new ATOM 1528 N PRO A 106 8.315 9.197 3.812 1.00 0.00 N ATOM 1529 CA PRO A 106 9.205 8.049 3.854 1.00 0.00 C ATOM 1530 C PRO A 106 8.421 6.756 4.089 1.00 0.00 C ATOM 1531 O PRO A 106 7.231 6.795 4.396 1.00 0.00 O ATOM 1532 CB PRO A 106 10.191 8.356 4.969 1.00 0.00 C ATOM 1533 CG PRO A 106 9.541 9.440 5.814 1.00 0.00 C ATOM 1534 CD PRO A 106 8.373 10.008 5.024 1.00 0.00 C ATOM 0 HA PRO A 106 9.728 7.888 2.911 1.00 0.00 H new ATOM 0 HB2 PRO A 106 10.396 7.467 5.565 1.00 0.00 H new ATOM 0 HB3 PRO A 106 11.145 8.695 4.565 1.00 0.00 H new ATOM 0 HG2 PRO A 106 9.196 9.029 6.763 1.00 0.00 H new ATOM 0 HG3 PRO A 106 10.261 10.224 6.049 1.00 0.00 H new ATOM 0 HD2 PRO A 106 7.443 9.942 5.589 1.00 0.00 H new ATOM 0 HD3 PRO A 106 8.529 11.061 4.789 1.00 0.00 H new ATOM 1542 N PRO A 107 9.140 5.612 3.932 1.00 0.00 N ATOM 1543 CA PRO A 107 8.524 4.310 4.124 1.00 0.00 C ATOM 1544 C PRO A 107 8.315 4.015 5.611 1.00 0.00 C ATOM 1545 O PRO A 107 9.276 3.781 6.342 1.00 0.00 O ATOM 1546 CB PRO A 107 9.467 3.326 3.451 1.00 0.00 C ATOM 1547 CG PRO A 107 10.797 4.050 3.315 1.00 0.00 C ATOM 1548 CD PRO A 107 10.551 5.528 3.570 1.00 0.00 C ATOM 0 HA PRO A 107 7.527 4.249 3.688 1.00 0.00 H new ATOM 0 HB2 PRO A 107 9.575 2.419 4.046 1.00 0.00 H new ATOM 0 HB3 PRO A 107 9.085 3.024 2.476 1.00 0.00 H new ATOM 0 HG2 PRO A 107 11.521 3.655 4.027 1.00 0.00 H new ATOM 0 HG3 PRO A 107 11.214 3.899 2.319 1.00 0.00 H new ATOM 0 HD2 PRO A 107 11.188 5.903 4.371 1.00 0.00 H new ATOM 0 HD3 PRO A 107 10.769 6.124 2.684 1.00 0.00 H new ATOM 1556 N THR A 108 7.053 4.038 6.014 1.00 0.00 N ATOM 1557 CA THR A 108 6.706 3.777 7.401 1.00 0.00 C ATOM 1558 C THR A 108 5.904 2.478 7.514 1.00 0.00 C ATOM 1559 O THR A 108 5.098 2.164 6.640 1.00 0.00 O ATOM 1560 CB THR A 108 5.961 5.000 7.940 1.00 0.00 C ATOM 1561 OG1 THR A 108 6.982 5.790 8.542 1.00 0.00 O ATOM 1562 CG2 THR A 108 5.027 4.651 9.100 1.00 0.00 C ATOM 0 H THR A 108 6.259 4.233 5.405 1.00 0.00 H new ATOM 0 HA THR A 108 7.597 3.627 8.011 1.00 0.00 H new ATOM 0 HB THR A 108 5.386 5.459 7.136 1.00 0.00 H new ATOM 0 HG1 THR A 108 6.587 6.605 8.916 1.00 0.00 H new ATOM 0 HG21 THR A 108 4.523 5.554 9.445 1.00 0.00 H new ATOM 0 HG22 THR A 108 4.285 3.927 8.764 1.00 0.00 H new ATOM 0 HG23 THR A 108 5.607 4.224 9.918 1.00 0.00 H new ATOM 1570 N ALA A 109 6.154 1.759 8.598 1.00 0.00 N ATOM 1571 CA ALA A 109 5.466 0.502 8.838 1.00 0.00 C ATOM 1572 C ALA A 109 4.003 0.785 9.187 1.00 0.00 C ATOM 1573 O ALA A 109 3.692 1.153 10.319 1.00 0.00 O ATOM 1574 CB ALA A 109 6.189 -0.275 9.940 1.00 0.00 C ATOM 0 H ALA A 109 6.824 2.023 9.320 1.00 0.00 H new ATOM 0 HA ALA A 109 5.477 -0.118 7.942 1.00 0.00 H new ATOM 0 HB1 ALA A 109 5.672 -1.218 10.119 1.00 0.00 H new ATOM 0 HB2 ALA A 109 7.214 -0.476 9.630 1.00 0.00 H new ATOM 0 HB3 ALA A 109 6.196 0.315 10.856 1.00 0.00 H new ATOM 1580 N TYR A 110 3.145 0.602 8.195 1.00 0.00 N ATOM 1581 CA TYR A 110 1.723 0.833 8.383 1.00 0.00 C ATOM 1582 C TYR A 110 1.035 -0.412 8.948 1.00 0.00 C ATOM 1583 O TYR A 110 1.236 -1.517 8.447 1.00 0.00 O ATOM 1584 CB TYR A 110 1.155 1.128 6.993 1.00 0.00 C ATOM 1585 CG TYR A 110 1.579 2.483 6.423 1.00 0.00 C ATOM 1586 CD1 TYR A 110 1.211 3.648 7.065 1.00 0.00 C ATOM 1587 CD2 TYR A 110 2.330 2.540 5.266 1.00 0.00 C ATOM 1588 CE1 TYR A 110 1.610 4.923 6.528 1.00 0.00 C ATOM 1589 CE2 TYR A 110 2.729 3.815 4.729 1.00 0.00 C ATOM 1590 CZ TYR A 110 2.350 4.944 5.386 1.00 0.00 C ATOM 1591 OH TYR A 110 2.726 6.148 4.879 1.00 0.00 O ATOM 0 H TYR A 110 3.407 0.296 7.258 1.00 0.00 H new ATOM 0 HA TYR A 110 1.557 1.651 9.084 1.00 0.00 H new ATOM 0 HB2 TYR A 110 1.472 0.342 6.308 1.00 0.00 H new ATOM 0 HB3 TYR A 110 0.067 1.090 7.041 1.00 0.00 H new ATOM 0 HD1 TYR A 110 0.624 3.603 7.970 1.00 0.00 H new ATOM 0 HD2 TYR A 110 2.618 1.628 4.764 1.00 0.00 H new ATOM 0 HE1 TYR A 110 1.328 5.842 7.020 1.00 0.00 H new ATOM 0 HE2 TYR A 110 3.316 3.874 3.825 1.00 0.00 H new ATOM 0 HH TYR A 110 3.250 6.010 4.063 1.00 0.00 H new ATOM 1601 N ASN A 111 0.238 -0.190 9.983 1.00 0.00 N ATOM 1602 CA ASN A 111 -0.480 -1.280 10.621 1.00 0.00 C ATOM 1603 C ASN A 111 -1.214 -2.096 9.554 1.00 0.00 C ATOM 1604 O ASN A 111 -1.941 -1.539 8.733 1.00 0.00 O ATOM 1605 CB ASN A 111 -1.521 -0.750 11.609 1.00 0.00 C ATOM 1606 CG ASN A 111 -0.941 0.380 12.462 1.00 0.00 C ATOM 1607 OD1 ASN A 111 0.177 0.827 12.269 1.00 0.00 O ATOM 1608 ND2 ASN A 111 -1.762 0.814 13.414 1.00 0.00 N ATOM 0 H ASN A 111 0.074 0.728 10.395 1.00 0.00 H new ATOM 0 HA ASN A 111 0.245 -1.894 11.155 1.00 0.00 H new ATOM 0 HB2 ASN A 111 -2.393 -0.389 11.065 1.00 0.00 H new ATOM 0 HB3 ASN A 111 -1.861 -1.560 12.254 1.00 0.00 H new ATOM 0 HD21 ASN A 111 -1.468 1.566 14.037 1.00 0.00 H new ATOM 0 HD22 ASN A 111 -2.686 0.395 13.521 1.00 0.00 H new ATOM 1615 N VAL A 112 -0.997 -3.402 9.600 1.00 0.00 N ATOM 1616 CA VAL A 112 -1.628 -4.299 8.648 1.00 0.00 C ATOM 1617 C VAL A 112 -2.642 -5.181 9.379 1.00 0.00 C ATOM 1618 O VAL A 112 -2.264 -6.035 10.180 1.00 0.00 O ATOM 1619 CB VAL A 112 -0.563 -5.106 7.903 1.00 0.00 C ATOM 1620 CG1 VAL A 112 -1.184 -6.308 7.189 1.00 0.00 C ATOM 1621 CG2 VAL A 112 0.206 -4.222 6.919 1.00 0.00 C ATOM 0 H VAL A 112 -0.393 -3.860 10.282 1.00 0.00 H new ATOM 0 HA VAL A 112 -2.174 -3.732 7.894 1.00 0.00 H new ATOM 0 HB VAL A 112 0.146 -5.484 8.640 1.00 0.00 H new ATOM 0 HG11 VAL A 112 -0.405 -6.864 6.668 1.00 0.00 H new ATOM 0 HG12 VAL A 112 -1.665 -6.957 7.921 1.00 0.00 H new ATOM 0 HG13 VAL A 112 -1.925 -5.961 6.469 1.00 0.00 H new ATOM 0 HG21 VAL A 112 0.957 -4.820 6.403 1.00 0.00 H new ATOM 0 HG22 VAL A 112 -0.487 -3.801 6.190 1.00 0.00 H new ATOM 0 HG23 VAL A 112 0.696 -3.414 7.462 1.00 0.00 H new ATOM 1631 N VAL A 113 -3.911 -4.944 9.078 1.00 0.00 N ATOM 1632 CA VAL A 113 -4.982 -5.706 9.697 1.00 0.00 C ATOM 1633 C VAL A 113 -5.611 -6.633 8.654 1.00 0.00 C ATOM 1634 O VAL A 113 -5.370 -6.481 7.458 1.00 0.00 O ATOM 1635 CB VAL A 113 -5.994 -4.757 10.341 1.00 0.00 C ATOM 1636 CG1 VAL A 113 -5.738 -4.620 11.843 1.00 0.00 C ATOM 1637 CG2 VAL A 113 -5.978 -3.390 9.655 1.00 0.00 C ATOM 0 H VAL A 113 -4.221 -4.235 8.414 1.00 0.00 H new ATOM 0 HA VAL A 113 -4.591 -6.335 10.497 1.00 0.00 H new ATOM 0 HB VAL A 113 -6.987 -5.186 10.208 1.00 0.00 H new ATOM 0 HG11 VAL A 113 -6.471 -3.940 12.277 1.00 0.00 H new ATOM 0 HG12 VAL A 113 -5.825 -5.597 12.318 1.00 0.00 H new ATOM 0 HG13 VAL A 113 -4.735 -4.225 12.007 1.00 0.00 H new ATOM 0 HG21 VAL A 113 -6.707 -2.735 10.132 1.00 0.00 H new ATOM 0 HG22 VAL A 113 -4.984 -2.951 9.741 1.00 0.00 H new ATOM 0 HG23 VAL A 113 -6.232 -3.509 8.602 1.00 0.00 H new ATOM 1647 N LYS A 114 -6.405 -7.573 9.147 1.00 0.00 N ATOM 1648 CA LYS A 114 -7.070 -8.524 8.273 1.00 0.00 C ATOM 1649 C LYS A 114 -8.460 -8.836 8.830 1.00 0.00 C ATOM 1650 O LYS A 114 -8.606 -9.689 9.704 1.00 0.00 O ATOM 1651 CB LYS A 114 -6.197 -9.764 8.068 1.00 0.00 C ATOM 1652 CG LYS A 114 -6.774 -10.665 6.974 1.00 0.00 C ATOM 1653 CD LYS A 114 -7.782 -11.658 7.556 1.00 0.00 C ATOM 1654 CE LYS A 114 -7.103 -12.618 8.535 1.00 0.00 C ATOM 1655 NZ LYS A 114 -7.711 -13.964 8.448 1.00 0.00 N ATOM 0 H LYS A 114 -6.602 -7.696 10.140 1.00 0.00 H new ATOM 0 HA LYS A 114 -7.213 -8.095 7.281 1.00 0.00 H new ATOM 0 HB2 LYS A 114 -5.185 -9.461 7.798 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -6.125 -10.321 9.002 1.00 0.00 H new ATOM 0 HG2 LYS A 114 -7.259 -10.054 6.213 1.00 0.00 H new ATOM 0 HG3 LYS A 114 -5.967 -11.207 6.481 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -8.579 -11.116 8.066 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -8.247 -12.224 6.749 1.00 0.00 H new ATOM 0 HE2 LYS A 114 -6.037 -12.679 8.313 1.00 0.00 H new ATOM 0 HE3 LYS A 114 -7.196 -12.236 9.552 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 -7.238 -14.603 9.119 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -8.723 -13.904 8.682 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -7.600 -14.333 7.482 1.00 0.00 H new ATOM 1669 N ASP A 115 -9.447 -8.127 8.302 1.00 0.00 N ATOM 1670 CA ASP A 115 -10.821 -8.317 8.735 1.00 0.00 C ATOM 1671 C ASP A 115 -11.082 -7.462 9.977 1.00 0.00 C ATOM 1672 O ASP A 115 -12.217 -7.062 10.231 1.00 0.00 O ATOM 1673 CB ASP A 115 -11.085 -9.779 9.104 1.00 0.00 C ATOM 1674 CG ASP A 115 -12.551 -10.208 9.034 1.00 0.00 C ATOM 1675 OD1 ASP A 115 -13.313 -9.516 8.324 1.00 0.00 O ATOM 1676 OD2 ASP A 115 -12.878 -11.219 9.693 1.00 0.00 O ATOM 0 H ASP A 115 -9.322 -7.420 7.578 1.00 0.00 H new ATOM 0 HA ASP A 115 -11.477 -8.028 7.914 1.00 0.00 H new ATOM 0 HB2 ASP A 115 -10.503 -10.417 8.439 1.00 0.00 H new ATOM 0 HB3 ASP A 115 -10.718 -9.955 10.115 1.00 0.00 H new ATOM 1681 N GLU A 116 -10.013 -7.208 10.717 1.00 0.00 N ATOM 1682 CA GLU A 116 -10.113 -6.408 11.926 1.00 0.00 C ATOM 1683 C GLU A 116 -8.939 -6.709 12.860 1.00 0.00 C ATOM 1684 O GLU A 116 -8.613 -5.904 13.731 1.00 0.00 O ATOM 1685 CB GLU A 116 -11.450 -6.644 12.631 1.00 0.00 C ATOM 1686 CG GLU A 116 -11.772 -8.138 12.709 1.00 0.00 C ATOM 1687 CD GLU A 116 -12.391 -8.495 14.062 1.00 0.00 C ATOM 1688 OE1 GLU A 116 -13.224 -7.692 14.535 1.00 0.00 O ATOM 1689 OE2 GLU A 116 -12.017 -9.564 14.592 1.00 0.00 O ATOM 0 H GLU A 116 -9.073 -7.542 10.503 1.00 0.00 H new ATOM 0 HA GLU A 116 -10.069 -5.355 11.647 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -11.415 -6.223 13.636 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -12.244 -6.124 12.095 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -12.460 -8.408 11.908 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -10.862 -8.718 12.557 1.00 0.00 H new ATOM 1696 N GLU A 117 -8.337 -7.870 12.646 1.00 0.00 N ATOM 1697 CA GLU A 117 -7.207 -8.287 13.459 1.00 0.00 C ATOM 1698 C GLU A 117 -5.902 -7.748 12.869 1.00 0.00 C ATOM 1699 O GLU A 117 -5.808 -7.523 11.663 1.00 0.00 O ATOM 1700 CB GLU A 117 -7.161 -9.810 13.592 1.00 0.00 C ATOM 1701 CG GLU A 117 -7.453 -10.244 15.030 1.00 0.00 C ATOM 1702 CD GLU A 117 -6.518 -9.539 16.016 1.00 0.00 C ATOM 1703 OE1 GLU A 117 -5.344 -9.963 16.086 1.00 0.00 O ATOM 1704 OE2 GLU A 117 -6.999 -8.593 16.676 1.00 0.00 O ATOM 0 H GLU A 117 -8.610 -8.534 11.922 1.00 0.00 H new ATOM 0 HA GLU A 117 -7.330 -7.871 14.459 1.00 0.00 H new ATOM 0 HB2 GLU A 117 -7.890 -10.260 12.918 1.00 0.00 H new ATOM 0 HB3 GLU A 117 -6.179 -10.175 13.290 1.00 0.00 H new ATOM 0 HG2 GLU A 117 -8.489 -10.016 15.279 1.00 0.00 H new ATOM 0 HG3 GLU A 117 -7.334 -11.324 15.119 1.00 0.00 H new ATOM 1711 N TYR A 118 -4.928 -7.557 13.747 1.00 0.00 N ATOM 1712 CA TYR A 118 -3.633 -7.049 13.328 1.00 0.00 C ATOM 1713 C TYR A 118 -2.688 -8.194 12.957 1.00 0.00 C ATOM 1714 O TYR A 118 -2.378 -9.042 13.791 1.00 0.00 O ATOM 1715 CB TYR A 118 -3.061 -6.304 14.537 1.00 0.00 C ATOM 1716 CG TYR A 118 -1.722 -5.615 14.267 1.00 0.00 C ATOM 1717 CD1 TYR A 118 -1.683 -4.449 13.529 1.00 0.00 C ATOM 1718 CD2 TYR A 118 -0.554 -6.159 14.761 1.00 0.00 C ATOM 1719 CE1 TYR A 118 -0.422 -3.801 13.275 1.00 0.00 C ATOM 1720 CE2 TYR A 118 0.706 -5.510 14.507 1.00 0.00 C ATOM 1721 CZ TYR A 118 0.710 -4.363 13.777 1.00 0.00 C ATOM 1722 OH TYR A 118 1.900 -3.751 13.537 1.00 0.00 O ATOM 0 H TYR A 118 -5.010 -7.745 14.746 1.00 0.00 H new ATOM 0 HA TYR A 118 -3.738 -6.408 12.452 1.00 0.00 H new ATOM 0 HB2 TYR A 118 -3.783 -5.556 14.865 1.00 0.00 H new ATOM 0 HB3 TYR A 118 -2.936 -7.009 15.359 1.00 0.00 H new ATOM 0 HD1 TYR A 118 -2.597 -4.023 13.142 1.00 0.00 H new ATOM 0 HD2 TYR A 118 -0.585 -7.071 15.338 1.00 0.00 H new ATOM 0 HE1 TYR A 118 -0.376 -2.889 12.699 1.00 0.00 H new ATOM 0 HE2 TYR A 118 1.627 -5.925 14.888 1.00 0.00 H new ATOM 0 HH TYR A 118 2.622 -4.264 13.957 1.00 0.00 H new ATOM 1732 N LYS A 119 -2.259 -8.181 11.703 1.00 0.00 N ATOM 1733 CA LYS A 119 -1.356 -9.208 11.211 1.00 0.00 C ATOM 1734 C LYS A 119 0.090 -8.751 11.416 1.00 0.00 C ATOM 1735 O LYS A 119 0.923 -9.515 11.901 1.00 0.00 O ATOM 1736 CB LYS A 119 -1.689 -9.563 9.761 1.00 0.00 C ATOM 1737 CG LYS A 119 -3.173 -9.900 9.605 1.00 0.00 C ATOM 1738 CD LYS A 119 -3.522 -11.194 10.344 1.00 0.00 C ATOM 1739 CE LYS A 119 -4.338 -10.903 11.604 1.00 0.00 C ATOM 1740 NZ LYS A 119 -4.042 -11.901 12.656 1.00 0.00 N ATOM 0 H LYS A 119 -2.520 -7.476 11.014 1.00 0.00 H new ATOM 0 HA LYS A 119 -1.482 -10.130 11.778 1.00 0.00 H new ATOM 0 HB2 LYS A 119 -1.432 -8.727 9.110 1.00 0.00 H new ATOM 0 HB3 LYS A 119 -1.084 -10.412 9.443 1.00 0.00 H new ATOM 0 HG2 LYS A 119 -3.778 -9.081 9.993 1.00 0.00 H new ATOM 0 HG3 LYS A 119 -3.417 -10.004 8.548 1.00 0.00 H new ATOM 0 HD2 LYS A 119 -4.087 -11.852 9.684 1.00 0.00 H new ATOM 0 HD3 LYS A 119 -2.607 -11.721 10.613 1.00 0.00 H new ATOM 0 HE2 LYS A 119 -4.109 -9.902 11.969 1.00 0.00 H new ATOM 0 HE3 LYS A 119 -5.402 -10.920 11.367 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 -4.605 -11.688 13.504 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 -4.283 -12.852 12.310 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 -3.030 -11.865 12.894 1.00 0.00 H new ATOM 1754 N GLY A 120 0.343 -7.507 11.037 1.00 0.00 N ATOM 1755 CA GLY A 120 1.674 -6.939 11.174 1.00 0.00 C ATOM 1756 C GLY A 120 1.700 -5.484 10.702 1.00 0.00 C ATOM 1757 O GLY A 120 0.804 -4.706 11.027 1.00 0.00 O ATOM 0 H GLY A 120 -0.351 -6.876 10.635 1.00 0.00 H new ATOM 0 HA2 GLY A 120 1.991 -6.993 12.216 1.00 0.00 H new ATOM 0 HA3 GLY A 120 2.385 -7.526 10.593 1.00 0.00 H new ATOM 1761 N GLU A 121 2.737 -5.160 9.943 1.00 0.00 N ATOM 1762 CA GLU A 121 2.891 -3.812 9.423 1.00 0.00 C ATOM 1763 C GLU A 121 3.430 -3.854 7.992 1.00 0.00 C ATOM 1764 O GLU A 121 4.060 -4.831 7.590 1.00 0.00 O ATOM 1765 CB GLU A 121 3.800 -2.977 10.327 1.00 0.00 C ATOM 1766 CG GLU A 121 5.136 -3.684 10.566 1.00 0.00 C ATOM 1767 CD GLU A 121 5.862 -3.090 11.775 1.00 0.00 C ATOM 1768 OE1 GLU A 121 5.176 -2.865 12.795 1.00 0.00 O ATOM 1769 OE2 GLU A 121 7.087 -2.875 11.651 1.00 0.00 O ATOM 0 H GLU A 121 3.478 -5.808 9.676 1.00 0.00 H new ATOM 0 HA GLU A 121 1.911 -3.335 9.408 1.00 0.00 H new ATOM 0 HB2 GLU A 121 3.977 -2.003 9.871 1.00 0.00 H new ATOM 0 HB3 GLU A 121 3.304 -2.797 11.281 1.00 0.00 H new ATOM 0 HG2 GLU A 121 4.965 -4.748 10.727 1.00 0.00 H new ATOM 0 HG3 GLU A 121 5.764 -3.593 9.679 1.00 0.00 H new ATOM 1776 N ILE A 122 3.164 -2.781 7.262 1.00 0.00 N ATOM 1777 CA ILE A 122 3.614 -2.682 5.884 1.00 0.00 C ATOM 1778 C ILE A 122 4.363 -1.362 5.689 1.00 0.00 C ATOM 1779 O ILE A 122 3.809 -0.290 5.925 1.00 0.00 O ATOM 1780 CB ILE A 122 2.439 -2.871 4.922 1.00 0.00 C ATOM 1781 CG1 ILE A 122 2.925 -2.951 3.473 1.00 0.00 C ATOM 1782 CG2 ILE A 122 1.391 -1.773 5.114 1.00 0.00 C ATOM 1783 CD1 ILE A 122 1.758 -3.204 2.517 1.00 0.00 C ATOM 0 H ILE A 122 2.642 -1.972 7.599 1.00 0.00 H new ATOM 0 HA ILE A 122 4.316 -3.483 5.654 1.00 0.00 H new ATOM 0 HB ILE A 122 1.957 -3.821 5.154 1.00 0.00 H new ATOM 0 HG12 ILE A 122 3.427 -2.022 3.202 1.00 0.00 H new ATOM 0 HG13 ILE A 122 3.660 -3.750 3.376 1.00 0.00 H new ATOM 0 HG21 ILE A 122 0.567 -1.931 4.418 1.00 0.00 H new ATOM 0 HG22 ILE A 122 1.014 -1.805 6.136 1.00 0.00 H new ATOM 0 HG23 ILE A 122 1.844 -0.800 4.924 1.00 0.00 H new ATOM 0 HD11 ILE A 122 2.131 -3.256 1.494 1.00 0.00 H new ATOM 0 HD12 ILE A 122 1.273 -4.146 2.776 1.00 0.00 H new ATOM 0 HD13 ILE A 122 1.037 -2.390 2.599 1.00 0.00 H new ATOM 1795 N TRP A 123 5.611 -1.484 5.262 1.00 0.00 N ATOM 1796 CA TRP A 123 6.441 -0.314 5.033 1.00 0.00 C ATOM 1797 C TRP A 123 6.169 0.189 3.615 1.00 0.00 C ATOM 1798 O TRP A 123 6.437 -0.512 2.641 1.00 0.00 O ATOM 1799 CB TRP A 123 7.917 -0.632 5.281 1.00 0.00 C ATOM 1800 CG TRP A 123 8.272 -0.829 6.756 1.00 0.00 C ATOM 1801 CD1 TRP A 123 7.878 -1.813 7.576 1.00 0.00 C ATOM 1802 CD2 TRP A 123 9.115 0.025 7.559 1.00 0.00 C ATOM 1803 NE1 TRP A 123 8.403 -1.657 8.843 1.00 0.00 N ATOM 1804 CE2 TRP A 123 9.179 -0.504 8.832 1.00 0.00 C ATOM 1805 CE3 TRP A 123 9.801 1.205 7.220 1.00 0.00 C ATOM 1806 CZ2 TRP A 123 9.917 0.080 9.869 1.00 0.00 C ATOM 1807 CZ3 TRP A 123 10.533 1.776 8.267 1.00 0.00 C ATOM 1808 CH2 TRP A 123 10.608 1.257 9.554 1.00 0.00 C ATOM 0 H TRP A 123 6.068 -2.375 5.069 1.00 0.00 H new ATOM 0 HA TRP A 123 6.191 0.479 5.738 1.00 0.00 H new ATOM 0 HB2 TRP A 123 8.181 -1.535 4.731 1.00 0.00 H new ATOM 0 HB3 TRP A 123 8.525 0.177 4.876 1.00 0.00 H new ATOM 0 HD1 TRP A 123 7.231 -2.626 7.282 1.00 0.00 H new ATOM 0 HE1 TRP A 123 8.250 -2.274 9.640 1.00 0.00 H new ATOM 0 HE3 TRP A 123 9.766 1.636 6.230 1.00 0.00 H new ATOM 0 HZ2 TRP A 123 9.951 -0.353 10.858 1.00 0.00 H new ATOM 0 HZ3 TRP A 123 11.079 2.685 8.060 1.00 0.00 H new ATOM 0 HH2 TRP A 123 11.196 1.759 10.308 1.00 0.00 H new ATOM 1819 N VAL A 124 5.638 1.402 3.543 1.00 0.00 N ATOM 1820 CA VAL A 124 5.326 2.007 2.260 1.00 0.00 C ATOM 1821 C VAL A 124 5.639 3.504 2.317 1.00 0.00 C ATOM 1822 O VAL A 124 5.437 4.144 3.348 1.00 0.00 O ATOM 1823 CB VAL A 124 3.873 1.714 1.883 1.00 0.00 C ATOM 1824 CG1 VAL A 124 3.608 2.056 0.415 1.00 0.00 C ATOM 1825 CG2 VAL A 124 3.512 0.258 2.181 1.00 0.00 C ATOM 0 H VAL A 124 5.416 1.981 4.353 1.00 0.00 H new ATOM 0 HA VAL A 124 5.945 1.575 1.474 1.00 0.00 H new ATOM 0 HB VAL A 124 3.233 2.349 2.496 1.00 0.00 H new ATOM 0 HG11 VAL A 124 2.568 1.838 0.173 1.00 0.00 H new ATOM 0 HG12 VAL A 124 3.806 3.115 0.247 1.00 0.00 H new ATOM 0 HG13 VAL A 124 4.261 1.459 -0.221 1.00 0.00 H new ATOM 0 HG21 VAL A 124 2.474 0.077 1.904 1.00 0.00 H new ATOM 0 HG22 VAL A 124 4.162 -0.403 1.607 1.00 0.00 H new ATOM 0 HG23 VAL A 124 3.643 0.061 3.245 1.00 0.00 H new ATOM 1835 N ALA A 125 6.127 4.017 1.198 1.00 0.00 N ATOM 1836 CA ALA A 125 6.469 5.427 1.108 1.00 0.00 C ATOM 1837 C ALA A 125 5.726 6.053 -0.073 1.00 0.00 C ATOM 1838 O ALA A 125 5.661 5.467 -1.153 1.00 0.00 O ATOM 1839 CB ALA A 125 7.987 5.577 0.987 1.00 0.00 C ATOM 0 H ALA A 125 6.294 3.482 0.346 1.00 0.00 H new ATOM 0 HA ALA A 125 6.160 5.955 2.010 1.00 0.00 H new ATOM 0 HB1 ALA A 125 8.244 6.634 0.919 1.00 0.00 H new ATOM 0 HB2 ALA A 125 8.467 5.142 1.864 1.00 0.00 H new ATOM 0 HB3 ALA A 125 8.333 5.062 0.091 1.00 0.00 H new ATOM 1845 N LEU A 126 5.182 7.237 0.172 1.00 0.00 N ATOM 1846 CA LEU A 126 4.446 7.950 -0.858 1.00 0.00 C ATOM 1847 C LEU A 126 5.252 9.171 -1.303 1.00 0.00 C ATOM 1848 O LEU A 126 6.129 9.639 -0.577 1.00 0.00 O ATOM 1849 CB LEU A 126 3.035 8.288 -0.372 1.00 0.00 C ATOM 1850 CG LEU A 126 2.288 7.165 0.352 1.00 0.00 C ATOM 1851 CD1 LEU A 126 1.371 7.729 1.438 1.00 0.00 C ATOM 1852 CD2 LEU A 126 1.528 6.284 -0.641 1.00 0.00 C ATOM 0 H LEU A 126 5.237 7.720 1.069 1.00 0.00 H new ATOM 0 HA LEU A 126 4.313 7.319 -1.737 1.00 0.00 H new ATOM 0 HB2 LEU A 126 3.098 9.146 0.298 1.00 0.00 H new ATOM 0 HB3 LEU A 126 2.441 8.598 -1.231 1.00 0.00 H new ATOM 0 HG LEU A 126 3.022 6.530 0.849 1.00 0.00 H new ATOM 0 HD11 LEU A 126 0.852 6.911 1.937 1.00 0.00 H new ATOM 0 HD12 LEU A 126 1.966 8.280 2.167 1.00 0.00 H new ATOM 0 HD13 LEU A 126 0.640 8.399 0.985 1.00 0.00 H new ATOM 0 HD21 LEU A 126 1.006 5.494 -0.101 1.00 0.00 H new ATOM 0 HD22 LEU A 126 0.804 6.890 -1.186 1.00 0.00 H new ATOM 0 HD23 LEU A 126 2.231 5.839 -1.345 1.00 0.00 H new ATOM 1864 N SER A 127 4.927 9.654 -2.493 1.00 0.00 N ATOM 1865 CA SER A 127 5.610 10.813 -3.043 1.00 0.00 C ATOM 1866 C SER A 127 4.655 11.609 -3.935 1.00 0.00 C ATOM 1867 O SER A 127 4.775 11.582 -5.158 1.00 0.00 O ATOM 1868 CB SER A 127 6.852 10.396 -3.835 1.00 0.00 C ATOM 1869 OG SER A 127 8.046 10.943 -3.282 1.00 0.00 O ATOM 0 H SER A 127 4.199 9.264 -3.092 1.00 0.00 H new ATOM 0 HA SER A 127 5.934 11.443 -2.215 1.00 0.00 H new ATOM 0 HB2 SER A 127 6.924 9.309 -3.850 1.00 0.00 H new ATOM 0 HB3 SER A 127 6.749 10.723 -4.870 1.00 0.00 H new ATOM 0 HG SER A 127 8.816 10.653 -3.814 1.00 0.00 H new ATOM 1875 N PHE A 128 3.728 12.299 -3.286 1.00 0.00 N ATOM 1876 CA PHE A 128 2.753 13.102 -4.005 1.00 0.00 C ATOM 1877 C PHE A 128 3.439 14.018 -5.020 1.00 0.00 C ATOM 1878 O PHE A 128 4.573 14.444 -4.810 1.00 0.00 O ATOM 1879 CB PHE A 128 2.030 13.962 -2.967 1.00 0.00 C ATOM 1880 CG PHE A 128 0.841 14.746 -3.527 1.00 0.00 C ATOM 1881 CD1 PHE A 128 -0.227 14.083 -4.046 1.00 0.00 C ATOM 1882 CD2 PHE A 128 0.853 16.106 -3.507 1.00 0.00 C ATOM 1883 CE1 PHE A 128 -1.330 14.810 -4.566 1.00 0.00 C ATOM 1884 CE2 PHE A 128 -0.250 16.833 -4.028 1.00 0.00 C ATOM 1885 CZ PHE A 128 -1.318 16.170 -4.546 1.00 0.00 C ATOM 0 H PHE A 128 3.632 12.319 -2.271 1.00 0.00 H new ATOM 0 HA PHE A 128 2.065 12.454 -4.548 1.00 0.00 H new ATOM 0 HB2 PHE A 128 1.680 13.320 -2.158 1.00 0.00 H new ATOM 0 HB3 PHE A 128 2.742 14.663 -2.532 1.00 0.00 H new ATOM 0 HD1 PHE A 128 -0.236 13.003 -4.063 1.00 0.00 H new ATOM 0 HD2 PHE A 128 1.701 16.633 -3.095 1.00 0.00 H new ATOM 0 HE1 PHE A 128 -2.178 14.283 -4.977 1.00 0.00 H new ATOM 0 HE2 PHE A 128 -0.240 17.913 -4.013 1.00 0.00 H new ATOM 0 HZ PHE A 128 -2.157 16.723 -4.942 1.00 0.00 H new ATOM 1895 N LYS A 129 2.721 14.293 -6.100 1.00 0.00 N ATOM 1896 CA LYS A 129 3.246 15.151 -7.149 1.00 0.00 C ATOM 1897 C LYS A 129 2.188 16.187 -7.532 1.00 0.00 C ATOM 1898 O LYS A 129 1.348 15.931 -8.394 1.00 0.00 O ATOM 1899 CB LYS A 129 3.742 14.312 -8.328 1.00 0.00 C ATOM 1900 CG LYS A 129 5.168 13.813 -8.086 1.00 0.00 C ATOM 1901 CD LYS A 129 5.319 12.353 -8.518 1.00 0.00 C ATOM 1902 CE LYS A 129 6.784 12.012 -8.797 1.00 0.00 C ATOM 1903 NZ LYS A 129 6.961 11.603 -10.208 1.00 0.00 N ATOM 0 H LYS A 129 1.781 13.937 -6.271 1.00 0.00 H new ATOM 0 HA LYS A 129 4.116 15.702 -6.792 1.00 0.00 H new ATOM 0 HB2 LYS A 129 3.077 13.462 -8.479 1.00 0.00 H new ATOM 0 HB3 LYS A 129 3.711 14.907 -9.241 1.00 0.00 H new ATOM 0 HG2 LYS A 129 5.873 14.434 -8.638 1.00 0.00 H new ATOM 0 HG3 LYS A 129 5.417 13.911 -7.029 1.00 0.00 H new ATOM 0 HD2 LYS A 129 4.932 11.697 -7.738 1.00 0.00 H new ATOM 0 HD3 LYS A 129 4.723 12.171 -9.412 1.00 0.00 H new ATOM 0 HE2 LYS A 129 7.412 12.876 -8.581 1.00 0.00 H new ATOM 0 HE3 LYS A 129 7.109 11.209 -8.136 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 7.961 11.375 -10.381 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 6.376 10.765 -10.403 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 6.670 12.381 -10.834 1.00 0.00 H new ATOM 1917 N PRO A 130 2.264 17.364 -6.856 1.00 0.00 N ATOM 1918 CA PRO A 130 1.323 18.440 -7.117 1.00 0.00 C ATOM 1919 C PRO A 130 1.642 19.139 -8.440 1.00 0.00 C ATOM 1920 O PRO A 130 2.808 19.361 -8.763 1.00 0.00 O ATOM 1921 CB PRO A 130 1.437 19.362 -5.915 1.00 0.00 C ATOM 1922 CG PRO A 130 2.761 19.021 -5.251 1.00 0.00 C ATOM 1923 CD PRO A 130 3.245 17.701 -5.829 1.00 0.00 C ATOM 0 HA PRO A 130 0.299 18.085 -7.234 1.00 0.00 H new ATOM 0 HB2 PRO A 130 1.412 20.408 -6.221 1.00 0.00 H new ATOM 0 HB3 PRO A 130 0.605 19.211 -5.227 1.00 0.00 H new ATOM 0 HG2 PRO A 130 3.493 19.808 -5.432 1.00 0.00 H new ATOM 0 HG3 PRO A 130 2.638 18.943 -4.171 1.00 0.00 H new ATOM 0 HD2 PRO A 130 4.245 17.797 -6.253 1.00 0.00 H new ATOM 0 HD3 PRO A 130 3.297 16.928 -5.062 1.00 0.00 H new ATOM 1931 N SER A 131 0.586 19.466 -9.169 1.00 0.00 N ATOM 1932 CA SER A 131 0.739 20.136 -10.450 1.00 0.00 C ATOM 1933 C SER A 131 1.223 21.571 -10.235 1.00 0.00 C ATOM 1934 O SER A 131 0.416 22.493 -10.134 1.00 0.00 O ATOM 1935 CB SER A 131 -0.574 20.130 -11.235 1.00 0.00 C ATOM 1936 OG SER A 131 -1.698 20.384 -10.397 1.00 0.00 O ATOM 0 H SER A 131 -0.379 19.280 -8.898 1.00 0.00 H new ATOM 0 HA SER A 131 1.482 19.593 -11.034 1.00 0.00 H new ATOM 0 HB2 SER A 131 -0.530 20.884 -12.021 1.00 0.00 H new ATOM 0 HB3 SER A 131 -0.699 19.165 -11.726 1.00 0.00 H new ATOM 0 HG SER A 131 -1.557 21.220 -9.905 1.00 0.00 H new