USER MOD reduce.3.24.130724 H: found=0, std=0, add=759, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 761 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 138 THR OG1 : rot -86:sc= 0.57 USER MOD Set 1.2: A 140 SER OG : rot -100:sc= -0.771 USER MOD Set 2.1: A 101 SER OG : rot -110:sc= -1.09 USER MOD Set 2.2: A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 3.1: A 56 TYR OH : rot 110:sc= -4.12! USER MOD Set 3.2: A 118 HIS : no HD1:sc= -6.7! C(o=-11!,f=-8.3!) USER MOD Single : A 41 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 42 THR OG1 : rot 180:sc= 0 USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 THR OG1 : rot 180:sc= 0.308 USER MOD Single : A 51 SER OG : rot -21:sc= 0.572 USER MOD Single : A 55 ASN : amide:sc= -0.663 X(o=-0.66,f=-0.41) USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 78 SER OG : rot -36:sc= 0.0117 USER MOD Single : A 82 ASN : amide:sc= -1.27 K(o=-1.3,f=-4.1!) USER MOD Single : A 85 SER OG : rot 3:sc= 0.201 USER MOD Single : A 86 ASN : amide:sc= -0.657 K(o=-0.66,f=-4.1!) USER MOD Single : A 87 ASN : amide:sc= -0.776 K(o=-0.78,f=-0.05) USER MOD Single : A 89 MET CE :methyl 145:sc= -0.466 (180deg=-1.77!) USER MOD Single : A 90 MET CE :methyl 172:sc= -8.59! (180deg=-9.55!) USER MOD Single : A 92 THR OG1 : rot 180:sc= 0 USER MOD Single : A 93 HIS : no HD1:sc= -4.48! C(o=-4.5!,f=-6!) USER MOD Single : A 96 THR OG1 : rot 74:sc= 0.842 USER MOD Single : A 98 TYR OH : rot 180:sc= 0 USER MOD Single : A 102 THR OG1 : rot -37:sc= 0.031! USER MOD Single : A 106 ASN : amide:sc= -2.18 X(o=-2.2,f=-2.4) USER MOD Single : A 110 TYR OH : rot 110:sc= -1.32 USER MOD Single : A 111 TYR OH : rot 180:sc= 0 USER MOD Single : A 114 SER OG : rot 180:sc= 0 USER MOD Single : A 125 GLN : amide:sc= 0.997 K(o=1,f=-0.49) USER MOD Single : A 126 TYR OH : rot 180:sc= 0 USER MOD Single : A 128 ASN : amide:sc= -1.65 K(o=-1.6,f=-0.49) USER MOD Single : A 131 ASN : amide:sc= -5.74! C(o=-5.7!,f=-16!) USER MOD Single : A 132 THR OG1 : rot 180:sc= 0 USER MOD Single : A 137 HIS : no HE2:sc= -1.5 X(o=-1.5,f=-1.9) USER MOD Single : A 146 SER OG : rot 180:sc= -1.2 USER MOD Single : A 148 ASN : amide:sc= -2.81! C(o=-2.8!,f=-1.9!) USER MOD Single : A 150 HIS : no HD1:sc= -11.6! C(o=-12!,f=-13!) USER MOD Single : A 151 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 13 N PHE A 37 6.319 -10.209 7.078 1.00 0.00 N ATOM 14 CA PHE A 37 7.369 -9.401 6.467 1.00 0.00 C ATOM 15 C PHE A 37 8.751 -9.851 6.935 1.00 0.00 C ATOM 16 O PHE A 37 9.714 -9.086 6.878 1.00 0.00 O ATOM 17 CB PHE A 37 7.163 -7.921 6.802 1.00 0.00 C ATOM 18 CG PHE A 37 5.733 -7.472 6.689 1.00 0.00 C ATOM 19 CD1 PHE A 37 4.958 -7.849 5.604 1.00 0.00 C ATOM 20 CD2 PHE A 37 5.166 -6.673 7.668 1.00 0.00 C ATOM 21 CE1 PHE A 37 3.643 -7.438 5.497 1.00 0.00 C ATOM 22 CE2 PHE A 37 3.851 -6.259 7.568 1.00 0.00 C ATOM 23 CZ PHE A 37 3.089 -6.641 6.481 1.00 0.00 C ATOM 0 HA PHE A 37 7.311 -9.536 5.387 1.00 0.00 H new ATOM 0 HB2 PHE A 37 7.515 -7.734 7.817 1.00 0.00 H new ATOM 0 HB3 PHE A 37 7.779 -7.317 6.135 1.00 0.00 H new ATOM 0 HD1 PHE A 37 5.387 -8.472 4.833 1.00 0.00 H new ATOM 0 HD2 PHE A 37 5.758 -6.370 8.519 1.00 0.00 H new ATOM 0 HE1 PHE A 37 3.049 -7.739 4.646 1.00 0.00 H new ATOM 0 HE2 PHE A 37 3.420 -5.638 8.339 1.00 0.00 H new ATOM 0 HZ PHE A 37 2.062 -6.317 6.400 1.00 0.00 H new ATOM 33 N ALA A 38 8.842 -11.095 7.395 1.00 0.00 N ATOM 34 CA ALA A 38 10.108 -11.643 7.869 1.00 0.00 C ATOM 35 C ALA A 38 11.028 -11.982 6.703 1.00 0.00 C ATOM 36 O ALA A 38 12.229 -11.709 6.744 1.00 0.00 O ATOM 37 CB ALA A 38 9.863 -12.876 8.725 1.00 0.00 C ATOM 0 H ALA A 38 8.055 -11.742 7.450 1.00 0.00 H new ATOM 0 HA ALA A 38 10.599 -10.884 8.478 1.00 0.00 H new ATOM 0 HB1 ALA A 38 10.817 -13.274 9.071 1.00 0.00 H new ATOM 0 HB2 ALA A 38 9.249 -12.606 9.584 1.00 0.00 H new ATOM 0 HB3 ALA A 38 9.348 -13.633 8.134 1.00 0.00 H new ATOM 43 N ASP A 39 10.457 -12.578 5.665 1.00 0.00 N ATOM 44 CA ASP A 39 11.221 -12.957 4.481 1.00 0.00 C ATOM 45 C ASP A 39 11.010 -11.963 3.340 1.00 0.00 C ATOM 46 O ASP A 39 11.472 -12.183 2.221 1.00 0.00 O ATOM 47 CB ASP A 39 10.823 -14.361 4.025 1.00 0.00 C ATOM 48 CG ASP A 39 11.429 -15.446 4.893 1.00 0.00 C ATOM 49 OD1 ASP A 39 11.861 -15.130 6.023 1.00 0.00 O ATOM 50 OD2 ASP A 39 11.474 -16.611 4.445 1.00 0.00 O ATOM 0 H ASP A 39 9.465 -12.811 5.618 1.00 0.00 H new ATOM 0 HA ASP A 39 12.278 -12.948 4.749 1.00 0.00 H new ATOM 0 HB2 ASP A 39 9.737 -14.451 4.042 1.00 0.00 H new ATOM 0 HB3 ASP A 39 11.139 -14.507 2.992 1.00 0.00 H new ATOM 55 N ALA A 40 10.309 -10.869 3.627 1.00 0.00 N ATOM 56 CA ALA A 40 10.041 -9.847 2.623 1.00 0.00 C ATOM 57 C ALA A 40 11.316 -9.107 2.236 1.00 0.00 C ATOM 58 O ALA A 40 12.091 -8.693 3.098 1.00 0.00 O ATOM 59 CB ALA A 40 8.999 -8.866 3.139 1.00 0.00 C ATOM 0 H ALA A 40 9.917 -10.669 4.547 1.00 0.00 H new ATOM 0 HA ALA A 40 9.655 -10.341 1.732 1.00 0.00 H new ATOM 0 HB1 ALA A 40 8.807 -8.107 2.381 1.00 0.00 H new ATOM 0 HB2 ALA A 40 8.075 -9.400 3.361 1.00 0.00 H new ATOM 0 HB3 ALA A 40 9.368 -8.387 4.046 1.00 0.00 H new ATOM 65 N GLN A 41 11.525 -8.939 0.934 1.00 0.00 N ATOM 66 CA GLN A 41 12.703 -8.241 0.437 1.00 0.00 C ATOM 67 C GLN A 41 12.631 -6.760 0.785 1.00 0.00 C ATOM 68 O GLN A 41 11.623 -6.287 1.310 1.00 0.00 O ATOM 69 CB GLN A 41 12.828 -8.420 -1.078 1.00 0.00 C ATOM 70 CG GLN A 41 14.249 -8.700 -1.541 1.00 0.00 C ATOM 71 CD GLN A 41 14.577 -8.024 -2.857 1.00 0.00 C ATOM 72 OE1 GLN A 41 13.805 -8.091 -3.813 1.00 0.00 O ATOM 73 NE2 GLN A 41 15.732 -7.368 -2.914 1.00 0.00 N ATOM 0 H GLN A 41 10.895 -9.276 0.206 1.00 0.00 H new ATOM 0 HA GLN A 41 13.584 -8.669 0.915 1.00 0.00 H new ATOM 0 HB2 GLN A 41 12.183 -9.241 -1.393 1.00 0.00 H new ATOM 0 HB3 GLN A 41 12.464 -7.520 -1.573 1.00 0.00 H new ATOM 0 HG2 GLN A 41 14.949 -8.360 -0.778 1.00 0.00 H new ATOM 0 HG3 GLN A 41 14.388 -9.776 -1.645 1.00 0.00 H new ATOM 0 HE21 GLN A 41 16.342 -7.338 -2.097 1.00 0.00 H new ATOM 0 HE22 GLN A 41 16.008 -6.895 -3.774 1.00 0.00 H new ATOM 82 N THR A 42 13.702 -6.031 0.497 1.00 0.00 N ATOM 83 CA THR A 42 13.745 -4.605 0.789 1.00 0.00 C ATOM 84 C THR A 42 14.547 -3.848 -0.264 1.00 0.00 C ATOM 85 O THR A 42 15.477 -4.389 -0.864 1.00 0.00 O ATOM 86 CB THR A 42 14.344 -4.363 2.179 1.00 0.00 C ATOM 87 OG1 THR A 42 14.701 -5.587 2.795 1.00 0.00 O ATOM 88 CG2 THR A 42 13.406 -3.635 3.116 1.00 0.00 C ATOM 0 H THR A 42 14.548 -6.402 0.064 1.00 0.00 H new ATOM 0 HA THR A 42 12.722 -4.230 0.771 1.00 0.00 H new ATOM 0 HB THR A 42 15.221 -3.738 2.008 1.00 0.00 H new ATOM 0 HG1 THR A 42 15.083 -5.409 3.680 1.00 0.00 H new ATOM 0 HG21 THR A 42 13.892 -3.496 4.082 1.00 0.00 H new ATOM 0 HG22 THR A 42 13.153 -2.662 2.694 1.00 0.00 H new ATOM 0 HG23 THR A 42 12.497 -4.221 3.248 1.00 0.00 H new ATOM 96 N ARG A 43 14.177 -2.591 -0.478 1.00 0.00 N ATOM 97 CA ARG A 43 14.852 -1.743 -1.450 1.00 0.00 C ATOM 98 C ARG A 43 14.567 -0.275 -1.155 1.00 0.00 C ATOM 99 O ARG A 43 13.560 0.055 -0.530 1.00 0.00 O ATOM 100 CB ARG A 43 14.397 -2.090 -2.870 1.00 0.00 C ATOM 101 CG ARG A 43 15.013 -1.202 -3.939 1.00 0.00 C ATOM 102 CD ARG A 43 14.447 -1.509 -5.317 1.00 0.00 C ATOM 103 NE ARG A 43 13.053 -1.084 -5.443 1.00 0.00 N ATOM 104 CZ ARG A 43 12.009 -1.911 -5.386 1.00 0.00 C ATOM 105 NH1 ARG A 43 12.186 -3.211 -5.183 1.00 0.00 N ATOM 106 NH2 ARG A 43 10.781 -1.432 -5.526 1.00 0.00 N ATOM 0 H ARG A 43 13.408 -2.135 0.013 1.00 0.00 H new ATOM 0 HA ARG A 43 15.925 -1.917 -1.375 1.00 0.00 H new ATOM 0 HB2 ARG A 43 14.652 -3.129 -3.081 1.00 0.00 H new ATOM 0 HB3 ARG A 43 13.311 -2.011 -2.925 1.00 0.00 H new ATOM 0 HG2 ARG A 43 14.829 -0.156 -3.694 1.00 0.00 H new ATOM 0 HG3 ARG A 43 16.094 -1.341 -3.950 1.00 0.00 H new ATOM 0 HD2 ARG A 43 15.049 -1.009 -6.076 1.00 0.00 H new ATOM 0 HD3 ARG A 43 14.518 -2.580 -5.508 1.00 0.00 H new ATOM 0 HE ARG A 43 12.868 -0.091 -5.584 1.00 0.00 H new ATOM 0 HH11 ARG A 43 13.128 -3.586 -5.069 1.00 0.00 H new ATOM 0 HH12 ARG A 43 11.380 -3.835 -5.141 1.00 0.00 H new ATOM 0 HH21 ARG A 43 10.637 -0.434 -5.677 1.00 0.00 H new ATOM 0 HH22 ARG A 43 9.980 -2.062 -5.483 1.00 0.00 H new ATOM 120 N LYS A 44 15.458 0.606 -1.599 1.00 0.00 N ATOM 121 CA LYS A 44 15.286 2.031 -1.368 1.00 0.00 C ATOM 122 C LYS A 44 14.338 2.648 -2.386 1.00 0.00 C ATOM 123 O LYS A 44 14.387 2.335 -3.575 1.00 0.00 O ATOM 124 CB LYS A 44 16.635 2.745 -1.405 1.00 0.00 C ATOM 125 CG LYS A 44 16.967 3.445 -0.103 1.00 0.00 C ATOM 126 CD LYS A 44 18.184 4.344 -0.244 1.00 0.00 C ATOM 127 CE LYS A 44 18.431 5.151 1.022 1.00 0.00 C ATOM 128 NZ LYS A 44 19.883 5.257 1.336 1.00 0.00 N ATOM 0 H LYS A 44 16.301 0.358 -2.117 1.00 0.00 H new ATOM 0 HA LYS A 44 14.846 2.155 -0.379 1.00 0.00 H new ATOM 0 HB2 LYS A 44 17.418 2.021 -1.632 1.00 0.00 H new ATOM 0 HB3 LYS A 44 16.632 3.476 -2.214 1.00 0.00 H new ATOM 0 HG2 LYS A 44 16.112 4.038 0.220 1.00 0.00 H new ATOM 0 HG3 LYS A 44 17.151 2.702 0.673 1.00 0.00 H new ATOM 0 HD2 LYS A 44 19.062 3.737 -0.467 1.00 0.00 H new ATOM 0 HD3 LYS A 44 18.042 5.021 -1.086 1.00 0.00 H new ATOM 0 HE2 LYS A 44 18.011 6.150 0.904 1.00 0.00 H new ATOM 0 HE3 LYS A 44 17.911 4.683 1.858 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 20.010 5.814 2.205 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 20.279 4.305 1.473 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 20.375 5.726 0.549 1.00 0.00 H new ATOM 142 N LEU A 45 13.472 3.523 -1.896 1.00 0.00 N ATOM 143 CA LEU A 45 12.493 4.197 -2.736 1.00 0.00 C ATOM 144 C LEU A 45 13.086 5.450 -3.374 1.00 0.00 C ATOM 145 O LEU A 45 13.815 6.202 -2.727 1.00 0.00 O ATOM 146 CB LEU A 45 11.263 4.568 -1.900 1.00 0.00 C ATOM 147 CG LEU A 45 9.999 4.910 -2.695 1.00 0.00 C ATOM 148 CD1 LEU A 45 9.803 3.937 -3.847 1.00 0.00 C ATOM 149 CD2 LEU A 45 8.784 4.901 -1.781 1.00 0.00 C ATOM 0 H LEU A 45 13.428 3.785 -0.911 1.00 0.00 H new ATOM 0 HA LEU A 45 12.199 3.516 -3.535 1.00 0.00 H new ATOM 0 HB2 LEU A 45 11.036 3.737 -1.232 1.00 0.00 H new ATOM 0 HB3 LEU A 45 11.517 5.422 -1.272 1.00 0.00 H new ATOM 0 HG LEU A 45 10.117 5.910 -3.112 1.00 0.00 H new ATOM 0 HD11 LEU A 45 8.899 4.201 -4.396 1.00 0.00 H new ATOM 0 HD12 LEU A 45 10.662 3.988 -4.516 1.00 0.00 H new ATOM 0 HD13 LEU A 45 9.707 2.924 -3.456 1.00 0.00 H new ATOM 0 HD21 LEU A 45 7.892 5.146 -2.358 1.00 0.00 H new ATOM 0 HD22 LEU A 45 8.669 3.912 -1.338 1.00 0.00 H new ATOM 0 HD23 LEU A 45 8.918 5.639 -0.990 1.00 0.00 H new ATOM 161 N THR A 46 12.765 5.671 -4.645 1.00 0.00 N ATOM 162 CA THR A 46 13.262 6.836 -5.367 1.00 0.00 C ATOM 163 C THR A 46 12.434 8.072 -5.029 1.00 0.00 C ATOM 164 O THR A 46 11.268 7.960 -4.649 1.00 0.00 O ATOM 165 CB THR A 46 13.224 6.589 -6.877 1.00 0.00 C ATOM 166 OG1 THR A 46 11.905 6.735 -7.373 1.00 0.00 O ATOM 167 CG2 THR A 46 13.716 5.213 -7.278 1.00 0.00 C ATOM 0 H THR A 46 12.163 5.059 -5.196 1.00 0.00 H new ATOM 0 HA THR A 46 14.294 7.007 -5.061 1.00 0.00 H new ATOM 0 HB THR A 46 13.896 7.332 -7.306 1.00 0.00 H new ATOM 0 HG1 THR A 46 11.900 6.575 -8.340 1.00 0.00 H new ATOM 0 HG21 THR A 46 13.661 5.108 -8.362 1.00 0.00 H new ATOM 0 HG22 THR A 46 14.749 5.087 -6.953 1.00 0.00 H new ATOM 0 HG23 THR A 46 13.093 4.452 -6.808 1.00 0.00 H new ATOM 175 N PRO A 47 13.022 9.273 -5.166 1.00 0.00 N ATOM 176 CA PRO A 47 12.319 10.526 -4.875 1.00 0.00 C ATOM 177 C PRO A 47 11.066 10.679 -5.725 1.00 0.00 C ATOM 178 O PRO A 47 10.080 11.278 -5.293 1.00 0.00 O ATOM 179 CB PRO A 47 13.345 11.614 -5.221 1.00 0.00 C ATOM 180 CG PRO A 47 14.363 10.938 -6.075 1.00 0.00 C ATOM 181 CD PRO A 47 14.401 9.507 -5.618 1.00 0.00 C ATOM 0 HA PRO A 47 11.977 10.574 -3.841 1.00 0.00 H new ATOM 0 HB2 PRO A 47 12.876 12.443 -5.750 1.00 0.00 H new ATOM 0 HB3 PRO A 47 13.799 12.027 -4.320 1.00 0.00 H new ATOM 0 HG2 PRO A 47 14.094 11.004 -7.129 1.00 0.00 H new ATOM 0 HG3 PRO A 47 15.340 11.409 -5.965 1.00 0.00 H new ATOM 0 HD2 PRO A 47 14.682 8.832 -6.426 1.00 0.00 H new ATOM 0 HD3 PRO A 47 15.121 9.358 -4.813 1.00 0.00 H new ATOM 189 N GLU A 48 11.105 10.122 -6.931 1.00 0.00 N ATOM 190 CA GLU A 48 9.965 10.186 -7.836 1.00 0.00 C ATOM 191 C GLU A 48 8.846 9.281 -7.335 1.00 0.00 C ATOM 192 O GLU A 48 7.672 9.654 -7.358 1.00 0.00 O ATOM 193 CB GLU A 48 10.383 9.775 -9.250 1.00 0.00 C ATOM 194 CG GLU A 48 10.729 10.951 -10.148 1.00 0.00 C ATOM 195 CD GLU A 48 10.582 10.623 -11.621 1.00 0.00 C ATOM 196 OE1 GLU A 48 11.608 10.609 -12.332 1.00 0.00 O ATOM 197 OE2 GLU A 48 9.439 10.382 -12.063 1.00 0.00 O ATOM 0 H GLU A 48 11.913 9.622 -7.303 1.00 0.00 H new ATOM 0 HA GLU A 48 9.601 11.213 -7.866 1.00 0.00 H new ATOM 0 HB2 GLU A 48 11.245 9.111 -9.186 1.00 0.00 H new ATOM 0 HB3 GLU A 48 9.575 9.205 -9.708 1.00 0.00 H new ATOM 0 HG2 GLU A 48 10.084 11.794 -9.901 1.00 0.00 H new ATOM 0 HG3 GLU A 48 11.754 11.265 -9.950 1.00 0.00 H new ATOM 204 N GLU A 49 9.220 8.090 -6.876 1.00 0.00 N ATOM 205 CA GLU A 49 8.250 7.132 -6.362 1.00 0.00 C ATOM 206 C GLU A 49 7.688 7.598 -5.024 1.00 0.00 C ATOM 207 O GLU A 49 6.497 7.447 -4.752 1.00 0.00 O ATOM 208 CB GLU A 49 8.894 5.754 -6.204 1.00 0.00 C ATOM 209 CG GLU A 49 9.145 5.043 -7.524 1.00 0.00 C ATOM 210 CD GLU A 49 10.163 3.925 -7.398 1.00 0.00 C ATOM 211 OE1 GLU A 49 11.215 4.149 -6.764 1.00 0.00 O ATOM 212 OE2 GLU A 49 9.906 2.826 -7.933 1.00 0.00 O ATOM 0 H GLU A 49 10.187 7.767 -6.850 1.00 0.00 H new ATOM 0 HA GLU A 49 7.431 7.061 -7.078 1.00 0.00 H new ATOM 0 HB2 GLU A 49 9.840 5.863 -5.674 1.00 0.00 H new ATOM 0 HB3 GLU A 49 8.251 5.131 -5.582 1.00 0.00 H new ATOM 0 HG2 GLU A 49 8.206 4.634 -7.897 1.00 0.00 H new ATOM 0 HG3 GLU A 49 9.494 5.766 -8.262 1.00 0.00 H new ATOM 219 N ARG A 50 8.552 8.172 -4.194 1.00 0.00 N ATOM 220 CA ARG A 50 8.138 8.664 -2.887 1.00 0.00 C ATOM 221 C ARG A 50 7.317 9.942 -3.028 1.00 0.00 C ATOM 222 O ARG A 50 6.460 10.236 -2.196 1.00 0.00 O ATOM 223 CB ARG A 50 9.358 8.913 -1.996 1.00 0.00 C ATOM 224 CG ARG A 50 9.273 8.217 -0.646 1.00 0.00 C ATOM 225 CD ARG A 50 10.486 8.513 0.220 1.00 0.00 C ATOM 226 NE ARG A 50 11.740 8.162 -0.448 1.00 0.00 N ATOM 227 CZ ARG A 50 12.450 9.009 -1.193 1.00 0.00 C ATOM 228 NH1 ARG A 50 12.029 10.253 -1.386 1.00 0.00 N ATOM 229 NH2 ARG A 50 13.584 8.607 -1.750 1.00 0.00 N ATOM 0 H ARG A 50 9.541 8.307 -4.403 1.00 0.00 H new ATOM 0 HA ARG A 50 7.514 7.903 -2.418 1.00 0.00 H new ATOM 0 HB2 ARG A 50 10.254 8.573 -2.516 1.00 0.00 H new ATOM 0 HB3 ARG A 50 9.470 9.986 -1.837 1.00 0.00 H new ATOM 0 HG2 ARG A 50 8.370 8.538 -0.128 1.00 0.00 H new ATOM 0 HG3 ARG A 50 9.188 7.141 -0.797 1.00 0.00 H new ATOM 0 HD2 ARG A 50 10.497 9.572 0.477 1.00 0.00 H new ATOM 0 HD3 ARG A 50 10.407 7.959 1.155 1.00 0.00 H new ATOM 0 HE ARG A 50 12.092 7.211 -0.337 1.00 0.00 H new ATOM 0 HH11 ARG A 50 11.156 10.567 -0.963 1.00 0.00 H new ATOM 0 HH12 ARG A 50 12.579 10.895 -1.958 1.00 0.00 H new ATOM 0 HH21 ARG A 50 13.911 7.651 -1.608 1.00 0.00 H new ATOM 0 HH22 ARG A 50 14.129 9.253 -2.321 1.00 0.00 H new ATOM 243 N SER A 51 7.583 10.696 -4.090 1.00 0.00 N ATOM 244 CA SER A 51 6.863 11.939 -4.341 1.00 0.00 C ATOM 245 C SER A 51 5.446 11.655 -4.822 1.00 0.00 C ATOM 246 O SER A 51 4.488 12.277 -4.364 1.00 0.00 O ATOM 247 CB SER A 51 7.606 12.787 -5.375 1.00 0.00 C ATOM 248 OG SER A 51 7.673 12.125 -6.626 1.00 0.00 O ATOM 0 H SER A 51 8.290 10.468 -4.789 1.00 0.00 H new ATOM 0 HA SER A 51 6.807 12.493 -3.404 1.00 0.00 H new ATOM 0 HB2 SER A 51 7.101 13.746 -5.494 1.00 0.00 H new ATOM 0 HB3 SER A 51 8.614 13.000 -5.019 1.00 0.00 H new ATOM 0 HG SER A 51 7.534 11.164 -6.495 1.00 0.00 H new ATOM 254 N ALA A 52 5.316 10.705 -5.739 1.00 0.00 N ATOM 255 CA ALA A 52 4.009 10.335 -6.270 1.00 0.00 C ATOM 256 C ALA A 52 3.163 9.688 -5.190 1.00 0.00 C ATOM 257 O ALA A 52 1.999 10.037 -5.008 1.00 0.00 O ATOM 258 CB ALA A 52 4.158 9.402 -7.457 1.00 0.00 C ATOM 0 H ALA A 52 6.097 10.178 -6.130 1.00 0.00 H new ATOM 0 HA ALA A 52 3.507 11.241 -6.608 1.00 0.00 H new ATOM 0 HB1 ALA A 52 3.172 9.138 -7.838 1.00 0.00 H new ATOM 0 HB2 ALA A 52 4.729 9.899 -8.241 1.00 0.00 H new ATOM 0 HB3 ALA A 52 4.681 8.498 -7.146 1.00 0.00 H new ATOM 264 N VAL A 53 3.763 8.754 -4.461 1.00 0.00 N ATOM 265 CA VAL A 53 3.070 8.075 -3.380 1.00 0.00 C ATOM 266 C VAL A 53 2.588 9.097 -2.366 1.00 0.00 C ATOM 267 O VAL A 53 1.393 9.219 -2.110 1.00 0.00 O ATOM 268 CB VAL A 53 3.980 7.045 -2.680 1.00 0.00 C ATOM 269 CG1 VAL A 53 3.278 6.425 -1.480 1.00 0.00 C ATOM 270 CG2 VAL A 53 4.415 5.968 -3.660 1.00 0.00 C ATOM 0 H VAL A 53 4.727 8.452 -4.601 1.00 0.00 H new ATOM 0 HA VAL A 53 2.222 7.540 -3.807 1.00 0.00 H new ATOM 0 HB VAL A 53 4.868 7.565 -2.320 1.00 0.00 H new ATOM 0 HG11 VAL A 53 3.941 5.702 -1.004 1.00 0.00 H new ATOM 0 HG12 VAL A 53 3.020 7.207 -0.765 1.00 0.00 H new ATOM 0 HG13 VAL A 53 2.369 5.921 -1.810 1.00 0.00 H new ATOM 0 HG21 VAL A 53 5.056 5.249 -3.150 1.00 0.00 H new ATOM 0 HG22 VAL A 53 3.536 5.456 -4.052 1.00 0.00 H new ATOM 0 HG23 VAL A 53 4.965 6.425 -4.483 1.00 0.00 H new ATOM 280 N GLU A 54 3.532 9.852 -1.816 1.00 0.00 N ATOM 281 CA GLU A 54 3.206 10.891 -0.848 1.00 0.00 C ATOM 282 C GLU A 54 2.132 11.813 -1.419 1.00 0.00 C ATOM 283 O GLU A 54 1.293 12.340 -0.690 1.00 0.00 O ATOM 284 CB GLU A 54 4.467 11.684 -0.468 1.00 0.00 C ATOM 285 CG GLU A 54 4.827 12.802 -1.437 1.00 0.00 C ATOM 286 CD GLU A 54 5.910 13.713 -0.894 1.00 0.00 C ATOM 287 OE1 GLU A 54 6.120 13.718 0.336 1.00 0.00 O ATOM 288 OE2 GLU A 54 6.549 14.421 -1.701 1.00 0.00 O ATOM 0 H GLU A 54 4.527 9.764 -2.024 1.00 0.00 H new ATOM 0 HA GLU A 54 2.817 10.426 0.057 1.00 0.00 H new ATOM 0 HB2 GLU A 54 4.326 12.112 0.524 1.00 0.00 H new ATOM 0 HB3 GLU A 54 5.308 10.994 -0.401 1.00 0.00 H new ATOM 0 HG2 GLU A 54 5.160 12.368 -2.380 1.00 0.00 H new ATOM 0 HG3 GLU A 54 3.936 13.391 -1.654 1.00 0.00 H new ATOM 295 N ASN A 55 2.164 11.980 -2.738 1.00 0.00 N ATOM 296 CA ASN A 55 1.194 12.813 -3.436 1.00 0.00 C ATOM 297 C ASN A 55 -0.164 12.113 -3.470 1.00 0.00 C ATOM 298 O ASN A 55 -1.213 12.755 -3.401 1.00 0.00 O ATOM 299 CB ASN A 55 1.702 13.107 -4.861 1.00 0.00 C ATOM 300 CG ASN A 55 0.632 12.976 -5.930 1.00 0.00 C ATOM 301 OD1 ASN A 55 -0.350 13.718 -5.941 1.00 0.00 O ATOM 302 ND2 ASN A 55 0.824 12.024 -6.836 1.00 0.00 N ATOM 0 H ASN A 55 2.857 11.545 -3.347 1.00 0.00 H new ATOM 0 HA ASN A 55 1.073 13.759 -2.909 1.00 0.00 H new ATOM 0 HB2 ASN A 55 2.110 14.117 -4.890 1.00 0.00 H new ATOM 0 HB3 ASN A 55 2.520 12.425 -5.093 1.00 0.00 H new ATOM 0 HD21 ASN A 55 0.142 11.884 -7.581 1.00 0.00 H new ATOM 0 HD22 ASN A 55 1.654 11.433 -6.787 1.00 0.00 H new ATOM 309 N TYR A 56 -0.125 10.789 -3.575 1.00 0.00 N ATOM 310 CA TYR A 56 -1.328 9.980 -3.622 1.00 0.00 C ATOM 311 C TYR A 56 -1.978 9.897 -2.241 1.00 0.00 C ATOM 312 O TYR A 56 -3.182 10.116 -2.097 1.00 0.00 O ATOM 313 CB TYR A 56 -0.974 8.584 -4.142 1.00 0.00 C ATOM 314 CG TYR A 56 -2.038 7.550 -3.888 1.00 0.00 C ATOM 315 CD1 TYR A 56 -1.785 6.448 -3.086 1.00 0.00 C ATOM 316 CD2 TYR A 56 -3.301 7.687 -4.443 1.00 0.00 C ATOM 317 CE1 TYR A 56 -2.763 5.510 -2.842 1.00 0.00 C ATOM 318 CE2 TYR A 56 -4.284 6.752 -4.206 1.00 0.00 C ATOM 319 CZ TYR A 56 -4.012 5.666 -3.405 1.00 0.00 C ATOM 320 OH TYR A 56 -4.992 4.737 -3.161 1.00 0.00 O ATOM 0 H TYR A 56 0.741 10.252 -3.629 1.00 0.00 H new ATOM 0 HA TYR A 56 -2.048 10.442 -4.297 1.00 0.00 H new ATOM 0 HB2 TYR A 56 -0.787 8.643 -5.214 1.00 0.00 H new ATOM 0 HB3 TYR A 56 -0.045 8.258 -3.674 1.00 0.00 H new ATOM 0 HD1 TYR A 56 -0.807 6.323 -2.646 1.00 0.00 H new ATOM 0 HD2 TYR A 56 -3.517 8.539 -5.070 1.00 0.00 H new ATOM 0 HE1 TYR A 56 -2.553 4.657 -2.213 1.00 0.00 H new ATOM 0 HE2 TYR A 56 -5.263 6.870 -4.646 1.00 0.00 H new ATOM 0 HH TYR A 56 -5.682 5.132 -2.588 1.00 0.00 H new ATOM 330 N LEU A 57 -1.174 9.585 -1.230 1.00 0.00 N ATOM 331 CA LEU A 57 -1.668 9.479 0.139 1.00 0.00 C ATOM 332 C LEU A 57 -2.183 10.830 0.625 1.00 0.00 C ATOM 333 O LEU A 57 -3.186 10.908 1.334 1.00 0.00 O ATOM 334 CB LEU A 57 -0.557 8.986 1.070 1.00 0.00 C ATOM 335 CG LEU A 57 0.359 7.912 0.480 1.00 0.00 C ATOM 336 CD1 LEU A 57 1.269 7.335 1.553 1.00 0.00 C ATOM 337 CD2 LEU A 57 -0.464 6.814 -0.174 1.00 0.00 C ATOM 0 H LEU A 57 -0.176 9.401 -1.333 1.00 0.00 H new ATOM 0 HA LEU A 57 -2.488 8.761 0.152 1.00 0.00 H new ATOM 0 HB2 LEU A 57 0.053 9.840 1.365 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -1.014 8.592 1.978 1.00 0.00 H new ATOM 0 HG LEU A 57 0.985 8.374 -0.284 1.00 0.00 H new ATOM 0 HD11 LEU A 57 1.912 6.573 1.113 1.00 0.00 H new ATOM 0 HD12 LEU A 57 1.884 8.130 1.975 1.00 0.00 H new ATOM 0 HD13 LEU A 57 0.664 6.888 2.341 1.00 0.00 H new ATOM 0 HD21 LEU A 57 0.202 6.058 -0.589 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -1.115 6.355 0.570 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -1.070 7.241 -0.973 1.00 0.00 H new ATOM 349 N GLU A 58 -1.484 11.893 0.236 1.00 0.00 N ATOM 350 CA GLU A 58 -1.865 13.245 0.628 1.00 0.00 C ATOM 351 C GLU A 58 -3.200 13.627 0.007 1.00 0.00 C ATOM 352 O GLU A 58 -4.106 14.099 0.694 1.00 0.00 O ATOM 353 CB GLU A 58 -0.788 14.248 0.209 1.00 0.00 C ATOM 354 CG GLU A 58 0.281 14.470 1.267 1.00 0.00 C ATOM 355 CD GLU A 58 1.656 14.699 0.669 1.00 0.00 C ATOM 356 OE1 GLU A 58 1.730 15.096 -0.513 1.00 0.00 O ATOM 357 OE2 GLU A 58 2.657 14.482 1.382 1.00 0.00 O ATOM 0 H GLU A 58 -0.651 11.843 -0.350 1.00 0.00 H new ATOM 0 HA GLU A 58 -1.965 13.268 1.713 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -0.313 13.897 -0.707 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -1.262 15.202 -0.023 1.00 0.00 H new ATOM 0 HG2 GLU A 58 0.008 15.329 1.879 1.00 0.00 H new ATOM 0 HG3 GLU A 58 0.317 13.605 1.929 1.00 0.00 H new ATOM 364 N SER A 59 -3.320 13.404 -1.295 1.00 0.00 N ATOM 365 CA SER A 59 -4.554 13.709 -2.009 1.00 0.00 C ATOM 366 C SER A 59 -5.676 12.794 -1.532 1.00 0.00 C ATOM 367 O SER A 59 -6.855 13.139 -1.608 1.00 0.00 O ATOM 368 CB SER A 59 -4.351 13.551 -3.516 1.00 0.00 C ATOM 369 OG SER A 59 -4.023 14.790 -4.121 1.00 0.00 O ATOM 0 H SER A 59 -2.580 13.014 -1.878 1.00 0.00 H new ATOM 0 HA SER A 59 -4.829 14.743 -1.802 1.00 0.00 H new ATOM 0 HB2 SER A 59 -3.556 12.829 -3.705 1.00 0.00 H new ATOM 0 HB3 SER A 59 -5.259 13.151 -3.968 1.00 0.00 H new ATOM 0 HG SER A 59 -3.897 14.660 -5.084 1.00 0.00 H new ATOM 623 N SER A 78 -5.914 7.509 6.691 1.00 0.00 N ATOM 624 CA SER A 78 -4.715 7.881 5.949 1.00 0.00 C ATOM 625 C SER A 78 -3.461 7.621 6.777 1.00 0.00 C ATOM 626 O SER A 78 -3.457 7.816 7.993 1.00 0.00 O ATOM 627 CB SER A 78 -4.778 9.355 5.544 1.00 0.00 C ATOM 628 OG SER A 78 -4.731 10.199 6.681 1.00 0.00 O ATOM 0 HA SER A 78 -4.668 7.267 5.050 1.00 0.00 H new ATOM 0 HB2 SER A 78 -3.946 9.589 4.879 1.00 0.00 H new ATOM 0 HB3 SER A 78 -5.695 9.543 4.985 1.00 0.00 H new ATOM 0 HG SER A 78 -5.218 9.779 7.420 1.00 0.00 H new ATOM 634 N LEU A 79 -2.400 7.177 6.111 1.00 0.00 N ATOM 635 CA LEU A 79 -1.138 6.887 6.789 1.00 0.00 C ATOM 636 C LEU A 79 -0.117 7.997 6.540 1.00 0.00 C ATOM 637 O LEU A 79 0.004 8.504 5.426 1.00 0.00 O ATOM 638 CB LEU A 79 -0.576 5.532 6.331 1.00 0.00 C ATOM 639 CG LEU A 79 -1.241 4.927 5.092 1.00 0.00 C ATOM 640 CD1 LEU A 79 -0.781 5.648 3.836 1.00 0.00 C ATOM 641 CD2 LEU A 79 -0.940 3.439 5.003 1.00 0.00 C ATOM 0 H LEU A 79 -2.387 7.010 5.105 1.00 0.00 H new ATOM 0 HA LEU A 79 -1.335 6.837 7.860 1.00 0.00 H new ATOM 0 HB2 LEU A 79 0.489 5.649 6.129 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -0.668 4.823 7.154 1.00 0.00 H new ATOM 0 HG LEU A 79 -2.320 5.053 5.179 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -1.264 5.205 2.965 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -1.050 6.702 3.903 1.00 0.00 H new ATOM 0 HD13 LEU A 79 0.301 5.555 3.738 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -1.420 3.023 4.117 1.00 0.00 H new ATOM 0 HD22 LEU A 79 0.138 3.289 4.936 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -1.322 2.937 5.892 1.00 0.00 H new ATOM 653 N ALA A 80 0.613 8.371 7.590 1.00 0.00 N ATOM 654 CA ALA A 80 1.622 9.423 7.492 1.00 0.00 C ATOM 655 C ALA A 80 2.992 8.842 7.164 1.00 0.00 C ATOM 656 O ALA A 80 3.414 7.853 7.759 1.00 0.00 O ATOM 657 CB ALA A 80 1.680 10.220 8.787 1.00 0.00 C ATOM 0 H ALA A 80 0.524 7.960 8.519 1.00 0.00 H new ATOM 0 HA ALA A 80 1.337 10.091 6.679 1.00 0.00 H new ATOM 0 HB1 ALA A 80 2.436 11.001 8.700 1.00 0.00 H new ATOM 0 HB2 ALA A 80 0.708 10.675 8.978 1.00 0.00 H new ATOM 0 HB3 ALA A 80 1.937 9.556 9.612 1.00 0.00 H new ATOM 663 N LEU A 81 3.681 9.459 6.210 1.00 0.00 N ATOM 664 CA LEU A 81 4.999 8.992 5.794 1.00 0.00 C ATOM 665 C LEU A 81 6.028 9.134 6.912 1.00 0.00 C ATOM 666 O LEU A 81 6.090 10.158 7.592 1.00 0.00 O ATOM 667 CB LEU A 81 5.467 9.764 4.557 1.00 0.00 C ATOM 668 CG LEU A 81 5.143 9.101 3.217 1.00 0.00 C ATOM 669 CD1 LEU A 81 3.820 9.615 2.672 1.00 0.00 C ATOM 670 CD2 LEU A 81 6.264 9.345 2.218 1.00 0.00 C ATOM 0 H LEU A 81 3.349 10.284 5.710 1.00 0.00 H new ATOM 0 HA LEU A 81 4.911 7.933 5.552 1.00 0.00 H new ATOM 0 HB2 LEU A 81 5.014 10.755 4.573 1.00 0.00 H new ATOM 0 HB3 LEU A 81 6.546 9.906 4.623 1.00 0.00 H new ATOM 0 HG LEU A 81 5.052 8.027 3.377 1.00 0.00 H new ATOM 0 HD11 LEU A 81 3.607 9.132 1.718 1.00 0.00 H new ATOM 0 HD12 LEU A 81 3.022 9.389 3.380 1.00 0.00 H new ATOM 0 HD13 LEU A 81 3.881 10.694 2.527 1.00 0.00 H new ATOM 0 HD21 LEU A 81 6.017 8.867 1.270 1.00 0.00 H new ATOM 0 HD22 LEU A 81 6.386 10.417 2.062 1.00 0.00 H new ATOM 0 HD23 LEU A 81 7.193 8.927 2.605 1.00 0.00 H new ATOM 682 N ASN A 82 6.837 8.092 7.086 1.00 0.00 N ATOM 683 CA ASN A 82 7.877 8.078 8.109 1.00 0.00 C ATOM 684 C ASN A 82 9.230 7.753 7.489 1.00 0.00 C ATOM 685 O ASN A 82 9.341 7.572 6.277 1.00 0.00 O ATOM 686 CB ASN A 82 7.549 7.053 9.196 1.00 0.00 C ATOM 687 CG ASN A 82 6.698 7.635 10.306 1.00 0.00 C ATOM 688 OD1 ASN A 82 6.130 8.718 10.167 1.00 0.00 O ATOM 689 ND2 ASN A 82 6.607 6.914 11.418 1.00 0.00 N ATOM 0 H ASN A 82 6.791 7.240 6.526 1.00 0.00 H new ATOM 0 HA ASN A 82 7.921 9.069 8.560 1.00 0.00 H new ATOM 0 HB2 ASN A 82 7.027 6.208 8.748 1.00 0.00 H new ATOM 0 HB3 ASN A 82 8.477 6.667 9.618 1.00 0.00 H new ATOM 0 HD21 ASN A 82 6.049 7.253 12.201 1.00 0.00 H new ATOM 0 HD22 ASN A 82 7.095 6.021 11.488 1.00 0.00 H new ATOM 696 N ALA A 83 10.258 7.678 8.326 1.00 0.00 N ATOM 697 CA ALA A 83 11.602 7.374 7.852 1.00 0.00 C ATOM 698 C ALA A 83 11.643 6.027 7.136 1.00 0.00 C ATOM 699 O ALA A 83 12.518 5.786 6.304 1.00 0.00 O ATOM 700 CB ALA A 83 12.592 7.390 9.005 1.00 0.00 C ATOM 0 H ALA A 83 10.187 7.823 9.333 1.00 0.00 H new ATOM 0 HA ALA A 83 11.886 8.146 7.137 1.00 0.00 H new ATOM 0 HB1 ALA A 83 13.590 7.161 8.631 1.00 0.00 H new ATOM 0 HB2 ALA A 83 12.596 8.377 9.468 1.00 0.00 H new ATOM 0 HB3 ALA A 83 12.301 6.644 9.744 1.00 0.00 H new ATOM 706 N GLU A 84 10.689 5.153 7.452 1.00 0.00 N ATOM 707 CA GLU A 84 10.625 3.844 6.824 1.00 0.00 C ATOM 708 C GLU A 84 9.975 3.949 5.449 1.00 0.00 C ATOM 709 O GLU A 84 10.157 3.079 4.601 1.00 0.00 O ATOM 710 CB GLU A 84 9.846 2.869 7.707 1.00 0.00 C ATOM 711 CG GLU A 84 10.484 1.493 7.803 1.00 0.00 C ATOM 712 CD GLU A 84 10.277 0.664 6.552 1.00 0.00 C ATOM 713 OE1 GLU A 84 9.390 1.017 5.746 1.00 0.00 O ATOM 714 OE2 GLU A 84 11.001 -0.338 6.376 1.00 0.00 O ATOM 0 H GLU A 84 9.954 5.331 8.137 1.00 0.00 H new ATOM 0 HA GLU A 84 11.640 3.466 6.701 1.00 0.00 H new ATOM 0 HB2 GLU A 84 9.757 3.290 8.709 1.00 0.00 H new ATOM 0 HB3 GLU A 84 8.834 2.765 7.314 1.00 0.00 H new ATOM 0 HG2 GLU A 84 11.552 1.605 7.987 1.00 0.00 H new ATOM 0 HG3 GLU A 84 10.067 0.962 8.659 1.00 0.00 H new ATOM 721 N SER A 85 9.225 5.034 5.236 1.00 0.00 N ATOM 722 CA SER A 85 8.549 5.275 3.965 1.00 0.00 C ATOM 723 C SER A 85 9.537 5.271 2.801 1.00 0.00 C ATOM 724 O SER A 85 9.139 5.158 1.643 1.00 0.00 O ATOM 725 CB SER A 85 7.799 6.608 4.003 1.00 0.00 C ATOM 726 OG SER A 85 6.780 6.591 4.988 1.00 0.00 O ATOM 0 H SER A 85 9.072 5.762 5.934 1.00 0.00 H new ATOM 0 HA SER A 85 7.835 4.465 3.812 1.00 0.00 H new ATOM 0 HB2 SER A 85 8.499 7.417 4.213 1.00 0.00 H new ATOM 0 HB3 SER A 85 7.361 6.811 3.026 1.00 0.00 H new ATOM 0 HG SER A 85 6.804 5.738 5.469 1.00 0.00 H new ATOM 732 N ASN A 86 10.825 5.390 3.111 1.00 0.00 N ATOM 733 CA ASN A 86 11.852 5.388 2.082 1.00 0.00 C ATOM 734 C ASN A 86 12.255 3.960 1.747 1.00 0.00 C ATOM 735 O ASN A 86 12.558 3.642 0.600 1.00 0.00 O ATOM 736 CB ASN A 86 13.075 6.176 2.545 1.00 0.00 C ATOM 737 CG ASN A 86 12.732 7.595 2.948 1.00 0.00 C ATOM 738 OD1 ASN A 86 11.695 7.848 3.561 1.00 0.00 O ATOM 739 ND2 ASN A 86 13.607 8.530 2.601 1.00 0.00 N ATOM 0 H ASN A 86 11.178 5.488 4.063 1.00 0.00 H new ATOM 0 HA ASN A 86 11.446 5.864 1.189 1.00 0.00 H new ATOM 0 HB2 ASN A 86 13.535 5.663 3.389 1.00 0.00 H new ATOM 0 HB3 ASN A 86 13.814 6.198 1.744 1.00 0.00 H new ATOM 0 HD21 ASN A 86 13.433 9.506 2.842 1.00 0.00 H new ATOM 0 HD22 ASN A 86 14.453 8.273 2.093 1.00 0.00 H new ATOM 746 N ASN A 87 12.253 3.103 2.760 1.00 0.00 N ATOM 747 CA ASN A 87 12.619 1.706 2.577 1.00 0.00 C ATOM 748 C ASN A 87 11.400 0.877 2.188 1.00 0.00 C ATOM 749 O ASN A 87 10.541 0.595 3.023 1.00 0.00 O ATOM 750 CB ASN A 87 13.224 1.151 3.868 1.00 0.00 C ATOM 751 CG ASN A 87 14.133 2.146 4.565 1.00 0.00 C ATOM 752 OD1 ASN A 87 15.143 2.580 4.011 1.00 0.00 O ATOM 753 ND2 ASN A 87 13.774 2.510 5.792 1.00 0.00 N ATOM 0 H ASN A 87 12.002 3.352 3.717 1.00 0.00 H new ATOM 0 HA ASN A 87 13.355 1.646 1.775 1.00 0.00 H new ATOM 0 HB2 ASN A 87 12.421 0.863 4.546 1.00 0.00 H new ATOM 0 HB3 ASN A 87 13.789 0.247 3.640 1.00 0.00 H new ATOM 0 HD21 ASN A 87 14.344 3.175 6.314 1.00 0.00 H new ATOM 0 HD22 ASN A 87 12.928 2.124 6.211 1.00 0.00 H new ATOM 760 N VAL A 88 11.334 0.483 0.919 1.00 0.00 N ATOM 761 CA VAL A 88 10.218 -0.316 0.424 1.00 0.00 C ATOM 762 C VAL A 88 10.406 -1.795 0.749 1.00 0.00 C ATOM 763 O VAL A 88 11.489 -2.350 0.578 1.00 0.00 O ATOM 764 CB VAL A 88 10.045 -0.156 -1.100 1.00 0.00 C ATOM 765 CG1 VAL A 88 8.811 -0.906 -1.584 1.00 0.00 C ATOM 766 CG2 VAL A 88 9.964 1.316 -1.479 1.00 0.00 C ATOM 0 H VAL A 88 12.039 0.704 0.216 1.00 0.00 H new ATOM 0 HA VAL A 88 9.323 0.051 0.927 1.00 0.00 H new ATOM 0 HB VAL A 88 10.918 -0.587 -1.590 1.00 0.00 H new ATOM 0 HG11 VAL A 88 8.708 -0.780 -2.662 1.00 0.00 H new ATOM 0 HG12 VAL A 88 8.915 -1.966 -1.351 1.00 0.00 H new ATOM 0 HG13 VAL A 88 7.926 -0.510 -1.086 1.00 0.00 H new ATOM 0 HG21 VAL A 88 9.842 1.408 -2.558 1.00 0.00 H new ATOM 0 HG22 VAL A 88 9.112 1.775 -0.977 1.00 0.00 H new ATOM 0 HG23 VAL A 88 10.880 1.821 -1.173 1.00 0.00 H new ATOM 776 N MET A 89 9.330 -2.423 1.213 1.00 0.00 N ATOM 777 CA MET A 89 9.354 -3.839 1.560 1.00 0.00 C ATOM 778 C MET A 89 8.598 -4.653 0.514 1.00 0.00 C ATOM 779 O MET A 89 7.443 -4.359 0.203 1.00 0.00 O ATOM 780 CB MET A 89 8.740 -4.055 2.948 1.00 0.00 C ATOM 781 CG MET A 89 9.773 -4.287 4.040 1.00 0.00 C ATOM 782 SD MET A 89 10.497 -2.752 4.648 1.00 0.00 S ATOM 783 CE MET A 89 10.962 -3.232 6.309 1.00 0.00 C ATOM 0 H MET A 89 8.427 -1.971 1.358 1.00 0.00 H new ATOM 0 HA MET A 89 10.390 -4.176 1.581 1.00 0.00 H new ATOM 0 HB2 MET A 89 8.137 -3.186 3.209 1.00 0.00 H new ATOM 0 HB3 MET A 89 8.066 -4.911 2.909 1.00 0.00 H new ATOM 0 HG2 MET A 89 9.306 -4.818 4.870 1.00 0.00 H new ATOM 0 HG3 MET A 89 10.564 -4.930 3.655 1.00 0.00 H new ATOM 0 HE1 MET A 89 11.887 -2.727 6.588 1.00 0.00 H new ATOM 0 HE2 MET A 89 10.171 -2.950 7.004 1.00 0.00 H new ATOM 0 HE3 MET A 89 11.112 -4.311 6.348 1.00 0.00 H new ATOM 793 N MET A 90 9.258 -5.667 -0.034 1.00 0.00 N ATOM 794 CA MET A 90 8.651 -6.513 -1.056 1.00 0.00 C ATOM 795 C MET A 90 8.282 -7.879 -0.489 1.00 0.00 C ATOM 796 O MET A 90 9.088 -8.519 0.186 1.00 0.00 O ATOM 797 CB MET A 90 9.610 -6.680 -2.235 1.00 0.00 C ATOM 798 CG MET A 90 9.903 -5.380 -2.969 1.00 0.00 C ATOM 799 SD MET A 90 11.567 -4.762 -2.653 1.00 0.00 S ATOM 800 CE MET A 90 11.210 -3.104 -2.079 1.00 0.00 C ATOM 0 H MET A 90 10.214 -5.924 0.212 1.00 0.00 H new ATOM 0 HA MET A 90 7.737 -6.028 -1.400 1.00 0.00 H new ATOM 0 HB2 MET A 90 10.547 -7.103 -1.873 1.00 0.00 H new ATOM 0 HB3 MET A 90 9.187 -7.397 -2.938 1.00 0.00 H new ATOM 0 HG2 MET A 90 9.775 -5.536 -4.040 1.00 0.00 H new ATOM 0 HG3 MET A 90 9.176 -4.626 -2.667 1.00 0.00 H new ATOM 0 HE1 MET A 90 12.125 -2.642 -1.709 1.00 0.00 H new ATOM 0 HE2 MET A 90 10.812 -2.512 -2.903 1.00 0.00 H new ATOM 0 HE3 MET A 90 10.475 -3.148 -1.275 1.00 0.00 H new ATOM 810 N LEU A 91 7.057 -8.322 -0.763 1.00 0.00 N ATOM 811 CA LEU A 91 6.593 -9.615 -0.269 1.00 0.00 C ATOM 812 C LEU A 91 5.443 -10.159 -1.098 1.00 0.00 C ATOM 813 O LEU A 91 4.564 -9.414 -1.526 1.00 0.00 O ATOM 814 CB LEU A 91 6.119 -9.491 1.181 1.00 0.00 C ATOM 815 CG LEU A 91 4.954 -8.518 1.389 1.00 0.00 C ATOM 816 CD1 LEU A 91 3.824 -9.189 2.154 1.00 0.00 C ATOM 817 CD2 LEU A 91 5.420 -7.267 2.114 1.00 0.00 C ATOM 0 H LEU A 91 6.373 -7.809 -1.320 1.00 0.00 H new ATOM 0 HA LEU A 91 7.437 -10.301 -0.340 1.00 0.00 H new ATOM 0 HB2 LEU A 91 5.820 -10.477 1.538 1.00 0.00 H new ATOM 0 HB3 LEU A 91 6.958 -9.170 1.798 1.00 0.00 H new ATOM 0 HG LEU A 91 4.578 -8.225 0.409 1.00 0.00 H new ATOM 0 HD11 LEU A 91 3.007 -8.481 2.291 1.00 0.00 H new ATOM 0 HD12 LEU A 91 3.466 -10.052 1.592 1.00 0.00 H new ATOM 0 HD13 LEU A 91 4.188 -9.516 3.128 1.00 0.00 H new ATOM 0 HD21 LEU A 91 4.577 -6.590 2.251 1.00 0.00 H new ATOM 0 HD22 LEU A 91 5.827 -7.541 3.087 1.00 0.00 H new ATOM 0 HD23 LEU A 91 6.191 -6.771 1.525 1.00 0.00 H new ATOM 829 N THR A 92 5.419 -11.475 -1.269 1.00 0.00 N ATOM 830 CA THR A 92 4.331 -12.118 -1.981 1.00 0.00 C ATOM 831 C THR A 92 3.262 -12.457 -0.955 1.00 0.00 C ATOM 832 O THR A 92 3.495 -13.264 -0.055 1.00 0.00 O ATOM 833 CB THR A 92 4.813 -13.383 -2.698 1.00 0.00 C ATOM 834 OG1 THR A 92 3.777 -13.936 -3.488 1.00 0.00 O ATOM 835 CG2 THR A 92 5.297 -14.462 -1.754 1.00 0.00 C ATOM 0 H THR A 92 6.138 -12.112 -0.925 1.00 0.00 H new ATOM 0 HA THR A 92 3.934 -11.453 -2.748 1.00 0.00 H new ATOM 0 HB THR A 92 5.653 -13.062 -3.315 1.00 0.00 H new ATOM 0 HG1 THR A 92 4.104 -14.742 -3.939 1.00 0.00 H new ATOM 0 HG21 THR A 92 5.623 -15.329 -2.329 1.00 0.00 H new ATOM 0 HG22 THR A 92 6.132 -14.082 -1.165 1.00 0.00 H new ATOM 0 HG23 THR A 92 4.485 -14.753 -1.088 1.00 0.00 H new ATOM 843 N HIS A 93 2.113 -11.803 -1.046 1.00 0.00 N ATOM 844 CA HIS A 93 1.063 -12.020 -0.064 1.00 0.00 C ATOM 845 C HIS A 93 -0.306 -11.594 -0.585 1.00 0.00 C ATOM 846 O HIS A 93 -0.411 -10.745 -1.469 1.00 0.00 O ATOM 847 CB HIS A 93 1.415 -11.226 1.196 1.00 0.00 C ATOM 848 CG HIS A 93 1.236 -11.981 2.474 1.00 0.00 C ATOM 849 ND1 HIS A 93 0.009 -12.411 2.934 1.00 0.00 N ATOM 850 CD2 HIS A 93 2.142 -12.368 3.400 1.00 0.00 C ATOM 851 CE1 HIS A 93 0.167 -13.030 4.090 1.00 0.00 C ATOM 852 NE2 HIS A 93 1.453 -13.020 4.394 1.00 0.00 N ATOM 0 H HIS A 93 1.887 -11.129 -1.777 1.00 0.00 H new ATOM 0 HA HIS A 93 1.001 -13.086 0.154 1.00 0.00 H new ATOM 0 HB2 HIS A 93 2.452 -10.897 1.125 1.00 0.00 H new ATOM 0 HB3 HIS A 93 0.797 -10.329 1.229 1.00 0.00 H new ATOM 0 HD2 HIS A 93 3.208 -12.197 3.365 1.00 0.00 H new ATOM 0 HE1 HIS A 93 -0.620 -13.469 4.685 1.00 0.00 H new ATOM 0 HE2 HIS A 93 1.867 -13.430 5.231 1.00 0.00 H new ATOM 861 N ALA A 94 -1.351 -12.186 -0.017 1.00 0.00 N ATOM 862 CA ALA A 94 -2.720 -11.869 -0.404 1.00 0.00 C ATOM 863 C ALA A 94 -3.200 -10.607 0.302 1.00 0.00 C ATOM 864 O ALA A 94 -3.118 -10.501 1.526 1.00 0.00 O ATOM 865 CB ALA A 94 -3.642 -13.034 -0.083 1.00 0.00 C ATOM 0 H ALA A 94 -1.275 -12.891 0.716 1.00 0.00 H new ATOM 0 HA ALA A 94 -2.740 -11.691 -1.479 1.00 0.00 H new ATOM 0 HB1 ALA A 94 -4.661 -12.783 -0.377 1.00 0.00 H new ATOM 0 HB2 ALA A 94 -3.314 -13.919 -0.629 1.00 0.00 H new ATOM 0 HB3 ALA A 94 -3.613 -13.237 0.988 1.00 0.00 H new ATOM 871 N ILE A 95 -3.701 -9.654 -0.473 1.00 0.00 N ATOM 872 CA ILE A 95 -4.192 -8.401 0.084 1.00 0.00 C ATOM 873 C ILE A 95 -5.684 -8.482 0.381 1.00 0.00 C ATOM 874 O ILE A 95 -6.494 -8.702 -0.519 1.00 0.00 O ATOM 875 CB ILE A 95 -3.935 -7.219 -0.868 1.00 0.00 C ATOM 876 CG1 ILE A 95 -2.526 -7.308 -1.456 1.00 0.00 C ATOM 877 CG2 ILE A 95 -4.131 -5.898 -0.140 1.00 0.00 C ATOM 878 CD1 ILE A 95 -1.430 -7.154 -0.425 1.00 0.00 C ATOM 0 H ILE A 95 -3.778 -9.725 -1.488 1.00 0.00 H new ATOM 0 HA ILE A 95 -3.645 -8.233 1.012 1.00 0.00 H new ATOM 0 HB ILE A 95 -4.653 -7.268 -1.686 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -2.410 -8.269 -1.957 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -2.409 -6.536 -2.217 1.00 0.00 H new ATOM 0 HG21 ILE A 95 -3.945 -5.073 -0.827 1.00 0.00 H new ATOM 0 HG22 ILE A 95 -5.153 -5.836 0.233 1.00 0.00 H new ATOM 0 HG23 ILE A 95 -3.435 -5.837 0.697 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -0.458 -7.228 -0.913 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -1.520 -6.182 0.059 1.00 0.00 H new ATOM 0 HD13 ILE A 95 -1.521 -7.942 0.323 1.00 0.00 H new ATOM 890 N THR A 96 -6.041 -8.297 1.646 1.00 0.00 N ATOM 891 CA THR A 96 -7.438 -8.345 2.055 1.00 0.00 C ATOM 892 C THR A 96 -8.078 -6.968 1.931 1.00 0.00 C ATOM 893 O THR A 96 -7.397 -5.947 2.024 1.00 0.00 O ATOM 894 CB THR A 96 -7.560 -8.857 3.493 1.00 0.00 C ATOM 895 OG1 THR A 96 -6.323 -9.377 3.950 1.00 0.00 O ATOM 896 CG2 THR A 96 -8.601 -9.943 3.653 1.00 0.00 C ATOM 0 H THR A 96 -5.384 -8.113 2.404 1.00 0.00 H new ATOM 0 HA THR A 96 -7.964 -9.035 1.395 1.00 0.00 H new ATOM 0 HB THR A 96 -7.865 -7.992 4.082 1.00 0.00 H new ATOM 0 HG1 THR A 96 -5.706 -8.638 4.134 1.00 0.00 H new ATOM 0 HG21 THR A 96 -8.637 -10.262 4.695 1.00 0.00 H new ATOM 0 HG22 THR A 96 -9.577 -9.558 3.357 1.00 0.00 H new ATOM 0 HG23 THR A 96 -8.340 -10.793 3.022 1.00 0.00 H new ATOM 904 N ARG A 97 -9.386 -6.946 1.715 1.00 0.00 N ATOM 905 CA ARG A 97 -10.115 -5.692 1.573 1.00 0.00 C ATOM 906 C ARG A 97 -11.175 -5.553 2.657 1.00 0.00 C ATOM 907 O ARG A 97 -12.151 -6.303 2.684 1.00 0.00 O ATOM 908 CB ARG A 97 -10.769 -5.617 0.193 1.00 0.00 C ATOM 909 CG ARG A 97 -10.807 -4.215 -0.392 1.00 0.00 C ATOM 910 CD ARG A 97 -11.578 -4.177 -1.702 1.00 0.00 C ATOM 911 NE ARG A 97 -13.012 -4.012 -1.480 1.00 0.00 N ATOM 912 CZ ARG A 97 -13.850 -5.017 -1.246 1.00 0.00 C ATOM 913 NH1 ARG A 97 -13.423 -6.273 -1.292 1.00 0.00 N ATOM 914 NH2 ARG A 97 -15.125 -4.763 -0.975 1.00 0.00 N ATOM 0 H ARG A 97 -9.965 -7.782 1.634 1.00 0.00 H new ATOM 0 HA ARG A 97 -9.405 -4.872 1.679 1.00 0.00 H new ATOM 0 HB2 ARG A 97 -10.229 -6.272 -0.491 1.00 0.00 H new ATOM 0 HB3 ARG A 97 -11.787 -5.999 0.262 1.00 0.00 H new ATOM 0 HG2 ARG A 97 -11.269 -3.534 0.323 1.00 0.00 H new ATOM 0 HG3 ARG A 97 -9.789 -3.861 -0.557 1.00 0.00 H new ATOM 0 HD2 ARG A 97 -11.208 -3.357 -2.318 1.00 0.00 H new ATOM 0 HD3 ARG A 97 -11.399 -5.098 -2.256 1.00 0.00 H new ATOM 0 HE ARG A 97 -13.394 -3.067 -1.506 1.00 0.00 H new ATOM 0 HH11 ARG A 97 -12.446 -6.472 -1.508 1.00 0.00 H new ATOM 0 HH12 ARG A 97 -14.072 -7.039 -1.111 1.00 0.00 H new ATOM 0 HH21 ARG A 97 -15.458 -3.799 -0.947 1.00 0.00 H new ATOM 0 HH22 ARG A 97 -15.771 -5.532 -0.795 1.00 0.00 H new ATOM 928 N TYR A 98 -10.979 -4.590 3.550 1.00 0.00 N ATOM 929 CA TYR A 98 -11.922 -4.356 4.635 1.00 0.00 C ATOM 930 C TYR A 98 -12.546 -2.969 4.533 1.00 0.00 C ATOM 931 O TYR A 98 -11.952 -1.978 4.964 1.00 0.00 O ATOM 932 CB TYR A 98 -11.223 -4.510 5.988 1.00 0.00 C ATOM 933 CG TYR A 98 -10.941 -5.947 6.365 1.00 0.00 C ATOM 934 CD1 TYR A 98 -11.829 -6.664 7.158 1.00 0.00 C ATOM 935 CD2 TYR A 98 -9.787 -6.588 5.931 1.00 0.00 C ATOM 936 CE1 TYR A 98 -11.576 -7.976 7.507 1.00 0.00 C ATOM 937 CE2 TYR A 98 -9.527 -7.900 6.275 1.00 0.00 C ATOM 938 CZ TYR A 98 -10.424 -8.590 7.063 1.00 0.00 C ATOM 939 OH TYR A 98 -10.168 -9.897 7.408 1.00 0.00 O ATOM 0 H TYR A 98 -10.177 -3.960 3.544 1.00 0.00 H new ATOM 0 HA TYR A 98 -12.716 -5.098 4.553 1.00 0.00 H new ATOM 0 HB2 TYR A 98 -10.283 -3.958 5.967 1.00 0.00 H new ATOM 0 HB3 TYR A 98 -11.842 -4.055 6.761 1.00 0.00 H new ATOM 0 HD1 TYR A 98 -12.733 -6.187 7.507 1.00 0.00 H new ATOM 0 HD2 TYR A 98 -9.081 -6.051 5.314 1.00 0.00 H new ATOM 0 HE1 TYR A 98 -12.277 -8.518 8.124 1.00 0.00 H new ATOM 0 HE2 TYR A 98 -8.625 -8.383 5.929 1.00 0.00 H new ATOM 0 HH TYR A 98 -9.316 -10.179 7.013 1.00 0.00 H new ATOM 949 N GLY A 99 -13.748 -2.903 3.970 1.00 0.00 N ATOM 950 CA GLY A 99 -14.432 -1.634 3.839 1.00 0.00 C ATOM 951 C GLY A 99 -15.042 -1.179 5.147 1.00 0.00 C ATOM 952 O GLY A 99 -15.858 -1.885 5.740 1.00 0.00 O ATOM 0 H GLY A 99 -14.259 -3.706 3.603 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -13.730 -0.879 3.485 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -15.214 -1.720 3.085 1.00 0.00 H new ATOM 956 N ILE A 100 -14.635 0.000 5.607 1.00 0.00 N ATOM 957 CA ILE A 100 -15.137 0.543 6.864 1.00 0.00 C ATOM 958 C ILE A 100 -15.691 1.953 6.682 1.00 0.00 C ATOM 959 O ILE A 100 -16.711 2.312 7.270 1.00 0.00 O ATOM 960 CB ILE A 100 -14.034 0.577 7.946 1.00 0.00 C ATOM 961 CG1 ILE A 100 -12.986 -0.509 7.685 1.00 0.00 C ATOM 962 CG2 ILE A 100 -14.641 0.404 9.330 1.00 0.00 C ATOM 963 CD1 ILE A 100 -13.549 -1.913 7.725 1.00 0.00 C ATOM 0 H ILE A 100 -13.960 0.597 5.129 1.00 0.00 H new ATOM 0 HA ILE A 100 -15.939 -0.120 7.189 1.00 0.00 H new ATOM 0 HB ILE A 100 -13.541 1.548 7.901 1.00 0.00 H new ATOM 0 HG12 ILE A 100 -12.530 -0.336 6.710 1.00 0.00 H new ATOM 0 HG13 ILE A 100 -12.192 -0.423 8.427 1.00 0.00 H new ATOM 0 HG21 ILE A 100 -13.850 0.430 10.080 1.00 0.00 H new ATOM 0 HG22 ILE A 100 -15.349 1.211 9.520 1.00 0.00 H new ATOM 0 HG23 ILE A 100 -15.159 -0.553 9.383 1.00 0.00 H new ATOM 0 HD11 ILE A 100 -12.751 -2.630 7.532 1.00 0.00 H new ATOM 0 HD12 ILE A 100 -13.979 -2.105 8.708 1.00 0.00 H new ATOM 0 HD13 ILE A 100 -14.322 -2.017 6.964 1.00 0.00 H new ATOM 975 N SER A 101 -15.005 2.749 5.871 1.00 0.00 N ATOM 976 CA SER A 101 -15.418 4.124 5.615 1.00 0.00 C ATOM 977 C SER A 101 -16.815 4.185 5.004 1.00 0.00 C ATOM 978 O SER A 101 -17.573 5.119 5.263 1.00 0.00 O ATOM 979 CB SER A 101 -14.417 4.810 4.685 1.00 0.00 C ATOM 980 OG SER A 101 -14.204 6.157 5.069 1.00 0.00 O ATOM 0 H SER A 101 -14.158 2.465 5.378 1.00 0.00 H new ATOM 0 HA SER A 101 -15.444 4.646 6.572 1.00 0.00 H new ATOM 0 HB2 SER A 101 -13.470 4.270 4.702 1.00 0.00 H new ATOM 0 HB3 SER A 101 -14.785 4.775 3.660 1.00 0.00 H new ATOM 0 HG SER A 101 -14.601 6.754 4.401 1.00 0.00 H new ATOM 986 N THR A 102 -17.146 3.192 4.186 1.00 0.00 N ATOM 987 CA THR A 102 -18.451 3.149 3.535 1.00 0.00 C ATOM 988 C THR A 102 -18.768 1.747 3.023 1.00 0.00 C ATOM 989 O THR A 102 -17.899 0.875 2.995 1.00 0.00 O ATOM 990 CB THR A 102 -18.490 4.148 2.377 1.00 0.00 C ATOM 991 OG1 THR A 102 -17.833 5.351 2.732 1.00 0.00 O ATOM 992 CG2 THR A 102 -19.894 4.506 1.939 1.00 0.00 C ATOM 0 H THR A 102 -16.533 2.410 3.958 1.00 0.00 H new ATOM 0 HA THR A 102 -19.206 3.419 4.273 1.00 0.00 H new ATOM 0 HB THR A 102 -17.985 3.649 1.550 1.00 0.00 H new ATOM 0 HG1 THR A 102 -18.015 5.558 3.673 1.00 0.00 H new ATOM 0 HG21 THR A 102 -19.848 5.218 1.115 1.00 0.00 H new ATOM 0 HG22 THR A 102 -20.414 3.606 1.612 1.00 0.00 H new ATOM 0 HG23 THR A 102 -20.433 4.953 2.774 1.00 0.00 H new ATOM 1000 N ASP A 103 -20.018 1.539 2.619 1.00 0.00 N ATOM 1001 CA ASP A 103 -20.453 0.245 2.106 1.00 0.00 C ATOM 1002 C ASP A 103 -20.504 0.241 0.578 1.00 0.00 C ATOM 1003 O ASP A 103 -21.110 -0.643 -0.027 1.00 0.00 O ATOM 1004 CB ASP A 103 -21.829 -0.112 2.672 1.00 0.00 C ATOM 1005 CG ASP A 103 -21.905 0.082 4.174 1.00 0.00 C ATOM 1006 OD1 ASP A 103 -22.352 1.163 4.611 1.00 0.00 O ATOM 1007 OD2 ASP A 103 -21.515 -0.847 4.913 1.00 0.00 O ATOM 0 H ASP A 103 -20.748 2.251 2.637 1.00 0.00 H new ATOM 0 HA ASP A 103 -19.726 -0.502 2.424 1.00 0.00 H new ATOM 0 HB2 ASP A 103 -22.588 0.504 2.190 1.00 0.00 H new ATOM 0 HB3 ASP A 103 -22.060 -1.149 2.430 1.00 0.00 H new ATOM 1012 N ASP A 104 -19.861 1.229 -0.040 1.00 0.00 N ATOM 1013 CA ASP A 104 -19.830 1.330 -1.496 1.00 0.00 C ATOM 1014 C ASP A 104 -18.390 1.407 -1.993 1.00 0.00 C ATOM 1015 O ASP A 104 -17.577 2.130 -1.419 1.00 0.00 O ATOM 1016 CB ASP A 104 -20.605 2.563 -1.961 1.00 0.00 C ATOM 1017 CG ASP A 104 -22.008 2.615 -1.392 1.00 0.00 C ATOM 1018 OD1 ASP A 104 -22.943 2.143 -2.072 1.00 0.00 O ATOM 1019 OD2 ASP A 104 -22.173 3.127 -0.264 1.00 0.00 O ATOM 0 H ASP A 104 -19.355 1.970 0.445 1.00 0.00 H new ATOM 0 HA ASP A 104 -20.300 0.439 -1.912 1.00 0.00 H new ATOM 0 HB2 ASP A 104 -20.063 3.461 -1.666 1.00 0.00 H new ATOM 0 HB3 ASP A 104 -20.658 2.566 -3.050 1.00 0.00 H new ATOM 1024 N PRO A 105 -18.052 0.662 -3.067 1.00 0.00 N ATOM 1025 CA PRO A 105 -16.702 0.643 -3.642 1.00 0.00 C ATOM 1026 C PRO A 105 -15.985 1.984 -3.542 1.00 0.00 C ATOM 1027 O PRO A 105 -16.044 2.804 -4.458 1.00 0.00 O ATOM 1028 CB PRO A 105 -16.986 0.275 -5.090 1.00 0.00 C ATOM 1029 CG PRO A 105 -18.121 -0.684 -4.991 1.00 0.00 C ATOM 1030 CD PRO A 105 -18.961 -0.225 -3.820 1.00 0.00 C ATOM 0 HA PRO A 105 -16.033 -0.042 -3.121 1.00 0.00 H new ATOM 0 HB2 PRO A 105 -17.252 1.151 -5.682 1.00 0.00 H new ATOM 0 HB3 PRO A 105 -16.117 -0.180 -5.566 1.00 0.00 H new ATOM 0 HG2 PRO A 105 -18.706 -0.691 -5.911 1.00 0.00 H new ATOM 0 HG3 PRO A 105 -17.759 -1.700 -4.836 1.00 0.00 H new ATOM 0 HD2 PRO A 105 -19.855 0.304 -4.151 1.00 0.00 H new ATOM 0 HD3 PRO A 105 -19.295 -1.066 -3.212 1.00 0.00 H new ATOM 1038 N ASN A 106 -15.310 2.198 -2.416 1.00 0.00 N ATOM 1039 CA ASN A 106 -14.584 3.437 -2.188 1.00 0.00 C ATOM 1040 C ASN A 106 -13.443 3.245 -1.190 1.00 0.00 C ATOM 1041 O ASN A 106 -13.137 2.121 -0.792 1.00 0.00 O ATOM 1042 CB ASN A 106 -15.540 4.526 -1.693 1.00 0.00 C ATOM 1043 CG ASN A 106 -16.599 4.875 -2.719 1.00 0.00 C ATOM 1044 OD1 ASN A 106 -16.307 5.482 -3.749 1.00 0.00 O ATOM 1045 ND2 ASN A 106 -17.840 4.492 -2.442 1.00 0.00 N ATOM 0 H ASN A 106 -15.253 1.528 -1.649 1.00 0.00 H new ATOM 0 HA ASN A 106 -14.147 3.746 -3.138 1.00 0.00 H new ATOM 0 HB2 ASN A 106 -16.024 4.191 -0.775 1.00 0.00 H new ATOM 0 HB3 ASN A 106 -14.970 5.421 -1.445 1.00 0.00 H new ATOM 0 HD21 ASN A 106 -18.595 4.699 -3.095 1.00 0.00 H new ATOM 0 HD22 ASN A 106 -18.038 3.991 -1.576 1.00 0.00 H new ATOM 1052 N LYS A 107 -12.815 4.355 -0.801 1.00 0.00 N ATOM 1053 CA LYS A 107 -11.698 4.336 0.143 1.00 0.00 C ATOM 1054 C LYS A 107 -11.959 3.368 1.298 1.00 0.00 C ATOM 1055 O LYS A 107 -12.874 3.565 2.096 1.00 0.00 O ATOM 1056 CB LYS A 107 -11.436 5.766 0.658 1.00 0.00 C ATOM 1057 CG LYS A 107 -11.139 5.877 2.151 1.00 0.00 C ATOM 1058 CD LYS A 107 -12.371 6.306 2.932 1.00 0.00 C ATOM 1059 CE LYS A 107 -12.814 7.709 2.552 1.00 0.00 C ATOM 1060 NZ LYS A 107 -12.433 8.712 3.584 1.00 0.00 N ATOM 0 H LYS A 107 -13.065 5.288 -1.130 1.00 0.00 H new ATOM 0 HA LYS A 107 -10.808 3.978 -0.374 1.00 0.00 H new ATOM 0 HB2 LYS A 107 -10.596 6.185 0.105 1.00 0.00 H new ATOM 0 HB3 LYS A 107 -12.306 6.382 0.431 1.00 0.00 H new ATOM 0 HG2 LYS A 107 -10.785 4.916 2.525 1.00 0.00 H new ATOM 0 HG3 LYS A 107 -10.336 6.597 2.311 1.00 0.00 H new ATOM 0 HD2 LYS A 107 -13.184 5.604 2.745 1.00 0.00 H new ATOM 0 HD3 LYS A 107 -12.157 6.268 4.000 1.00 0.00 H new ATOM 0 HE2 LYS A 107 -12.367 7.984 1.597 1.00 0.00 H new ATOM 0 HE3 LYS A 107 -13.895 7.723 2.414 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 -12.754 9.655 3.286 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 -12.880 8.465 4.490 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 -11.399 8.718 3.698 1.00 0.00 H new ATOM 1074 N TRP A 108 -11.147 2.318 1.368 1.00 0.00 N ATOM 1075 CA TRP A 108 -11.282 1.308 2.407 1.00 0.00 C ATOM 1076 C TRP A 108 -9.923 0.866 2.937 1.00 0.00 C ATOM 1077 O TRP A 108 -8.880 1.311 2.460 1.00 0.00 O ATOM 1078 CB TRP A 108 -12.048 0.109 1.870 1.00 0.00 C ATOM 1079 CG TRP A 108 -13.493 0.405 1.647 1.00 0.00 C ATOM 1080 CD1 TRP A 108 -14.271 1.268 2.359 1.00 0.00 C ATOM 1081 CD2 TRP A 108 -14.334 -0.163 0.649 1.00 0.00 C ATOM 1082 NE1 TRP A 108 -15.546 1.267 1.858 1.00 0.00 N ATOM 1083 CE2 TRP A 108 -15.611 0.393 0.812 1.00 0.00 C ATOM 1084 CE3 TRP A 108 -14.128 -1.090 -0.363 1.00 0.00 C ATOM 1085 CZ2 TRP A 108 -16.681 0.052 -0.004 1.00 0.00 C ATOM 1086 CZ3 TRP A 108 -15.189 -1.429 -1.179 1.00 0.00 C ATOM 1087 CH2 TRP A 108 -16.454 -0.860 -0.994 1.00 0.00 C ATOM 0 H TRP A 108 -10.385 2.146 0.712 1.00 0.00 H new ATOM 0 HA TRP A 108 -11.835 1.751 3.235 1.00 0.00 H new ATOM 0 HB2 TRP A 108 -11.598 -0.214 0.931 1.00 0.00 H new ATOM 0 HB3 TRP A 108 -11.955 -0.721 2.571 1.00 0.00 H new ATOM 0 HD1 TRP A 108 -13.933 1.864 3.194 1.00 0.00 H new ATOM 0 HE1 TRP A 108 -16.321 1.829 2.210 1.00 0.00 H new ATOM 0 HE3 TRP A 108 -13.156 -1.538 -0.510 1.00 0.00 H new ATOM 0 HZ2 TRP A 108 -17.657 0.492 0.139 1.00 0.00 H new ATOM 0 HZ3 TRP A 108 -15.040 -2.145 -1.973 1.00 0.00 H new ATOM 0 HH2 TRP A 108 -17.265 -1.148 -1.646 1.00 0.00 H new ATOM 1098 N ARG A 109 -9.950 -0.010 3.937 1.00 0.00 N ATOM 1099 CA ARG A 109 -8.728 -0.514 4.550 1.00 0.00 C ATOM 1100 C ARG A 109 -8.362 -1.883 3.994 1.00 0.00 C ATOM 1101 O ARG A 109 -9.223 -2.745 3.832 1.00 0.00 O ATOM 1102 CB ARG A 109 -8.912 -0.631 6.064 1.00 0.00 C ATOM 1103 CG ARG A 109 -8.575 0.634 6.827 1.00 0.00 C ATOM 1104 CD ARG A 109 -9.722 1.634 6.785 1.00 0.00 C ATOM 1105 NE ARG A 109 -10.048 2.149 8.112 1.00 0.00 N ATOM 1106 CZ ARG A 109 -11.101 2.921 8.368 1.00 0.00 C ATOM 1107 NH1 ARG A 109 -11.932 3.269 7.392 1.00 0.00 N ATOM 1108 NH2 ARG A 109 -11.325 3.346 9.604 1.00 0.00 N ATOM 0 H ARG A 109 -10.808 -0.386 4.340 1.00 0.00 H new ATOM 0 HA ARG A 109 -7.926 0.189 4.323 1.00 0.00 H new ATOM 0 HB2 ARG A 109 -9.946 -0.904 6.274 1.00 0.00 H new ATOM 0 HB3 ARG A 109 -8.286 -1.443 6.434 1.00 0.00 H new ATOM 0 HG2 ARG A 109 -8.346 0.385 7.863 1.00 0.00 H new ATOM 0 HG3 ARG A 109 -7.679 1.088 6.403 1.00 0.00 H new ATOM 0 HD2 ARG A 109 -9.456 2.463 6.130 1.00 0.00 H new ATOM 0 HD3 ARG A 109 -10.603 1.157 6.355 1.00 0.00 H new ATOM 0 HE ARG A 109 -9.433 1.903 8.887 1.00 0.00 H new ATOM 0 HH11 ARG A 109 -11.765 2.944 6.440 1.00 0.00 H new ATOM 0 HH12 ARG A 109 -12.737 3.861 7.595 1.00 0.00 H new ATOM 0 HH21 ARG A 109 -10.690 3.081 10.357 1.00 0.00 H new ATOM 0 HH22 ARG A 109 -12.132 3.938 9.801 1.00 0.00 H new ATOM 1122 N TYR A 110 -7.077 -2.088 3.727 1.00 0.00 N ATOM 1123 CA TYR A 110 -6.607 -3.366 3.219 1.00 0.00 C ATOM 1124 C TYR A 110 -5.828 -4.079 4.308 1.00 0.00 C ATOM 1125 O TYR A 110 -5.466 -3.465 5.312 1.00 0.00 O ATOM 1126 CB TYR A 110 -5.749 -3.175 1.971 1.00 0.00 C ATOM 1127 CG TYR A 110 -6.564 -2.899 0.729 1.00 0.00 C ATOM 1128 CD1 TYR A 110 -7.122 -1.645 0.510 1.00 0.00 C ATOM 1129 CD2 TYR A 110 -6.777 -3.889 -0.226 1.00 0.00 C ATOM 1130 CE1 TYR A 110 -7.866 -1.383 -0.624 1.00 0.00 C ATOM 1131 CE2 TYR A 110 -7.521 -3.632 -1.363 1.00 0.00 C ATOM 1132 CZ TYR A 110 -8.062 -2.380 -1.556 1.00 0.00 C ATOM 1133 OH TYR A 110 -8.801 -2.120 -2.687 1.00 0.00 O ATOM 0 H TYR A 110 -6.347 -1.387 3.854 1.00 0.00 H new ATOM 0 HA TYR A 110 -7.465 -3.975 2.934 1.00 0.00 H new ATOM 0 HB2 TYR A 110 -5.057 -2.349 2.136 1.00 0.00 H new ATOM 0 HB3 TYR A 110 -5.146 -4.069 1.812 1.00 0.00 H new ATOM 0 HD1 TYR A 110 -6.971 -0.862 1.239 1.00 0.00 H new ATOM 0 HD2 TYR A 110 -6.355 -4.872 -0.077 1.00 0.00 H new ATOM 0 HE1 TYR A 110 -8.292 -0.403 -0.780 1.00 0.00 H new ATOM 0 HE2 TYR A 110 -7.677 -4.409 -2.096 1.00 0.00 H new ATOM 0 HH TYR A 110 -8.210 -2.108 -3.469 1.00 0.00 H new ATOM 1143 N TYR A 111 -5.593 -5.371 4.142 1.00 0.00 N ATOM 1144 CA TYR A 111 -4.880 -6.123 5.164 1.00 0.00 C ATOM 1145 C TYR A 111 -3.897 -7.126 4.580 1.00 0.00 C ATOM 1146 O TYR A 111 -4.249 -7.957 3.743 1.00 0.00 O ATOM 1147 CB TYR A 111 -5.878 -6.842 6.068 1.00 0.00 C ATOM 1148 CG TYR A 111 -6.466 -5.948 7.137 1.00 0.00 C ATOM 1149 CD1 TYR A 111 -6.128 -6.120 8.473 1.00 0.00 C ATOM 1150 CD2 TYR A 111 -7.352 -4.925 6.808 1.00 0.00 C ATOM 1151 CE1 TYR A 111 -6.655 -5.299 9.452 1.00 0.00 C ATOM 1152 CE2 TYR A 111 -7.883 -4.101 7.782 1.00 0.00 C ATOM 1153 CZ TYR A 111 -7.531 -4.291 9.102 1.00 0.00 C ATOM 1154 OH TYR A 111 -8.057 -3.473 10.075 1.00 0.00 O ATOM 0 H TYR A 111 -5.879 -5.913 3.326 1.00 0.00 H new ATOM 0 HA TYR A 111 -4.298 -5.405 5.742 1.00 0.00 H new ATOM 0 HB2 TYR A 111 -6.685 -7.247 5.457 1.00 0.00 H new ATOM 0 HB3 TYR A 111 -5.383 -7.689 6.544 1.00 0.00 H new ATOM 0 HD1 TYR A 111 -5.443 -6.907 8.751 1.00 0.00 H new ATOM 0 HD2 TYR A 111 -7.628 -4.773 5.775 1.00 0.00 H new ATOM 0 HE1 TYR A 111 -6.383 -5.445 10.487 1.00 0.00 H new ATOM 0 HE2 TYR A 111 -8.570 -3.313 7.511 1.00 0.00 H new ATOM 0 HH TYR A 111 -8.654 -2.815 9.662 1.00 0.00 H new ATOM 1164 N LEU A 112 -2.664 -7.052 5.064 1.00 0.00 N ATOM 1165 CA LEU A 112 -1.608 -7.956 4.644 1.00 0.00 C ATOM 1166 C LEU A 112 -1.365 -8.981 5.744 1.00 0.00 C ATOM 1167 O LEU A 112 -0.765 -8.666 6.772 1.00 0.00 O ATOM 1168 CB LEU A 112 -0.326 -7.172 4.356 1.00 0.00 C ATOM 1169 CG LEU A 112 0.663 -7.862 3.419 1.00 0.00 C ATOM 1170 CD1 LEU A 112 0.933 -9.287 3.878 1.00 0.00 C ATOM 1171 CD2 LEU A 112 0.139 -7.847 1.992 1.00 0.00 C ATOM 0 H LEU A 112 -2.371 -6.364 5.758 1.00 0.00 H new ATOM 0 HA LEU A 112 -1.908 -8.469 3.730 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -0.598 -6.208 3.925 1.00 0.00 H new ATOM 0 HB3 LEU A 112 0.176 -6.968 5.302 1.00 0.00 H new ATOM 0 HG LEU A 112 1.604 -7.313 3.446 1.00 0.00 H new ATOM 0 HD11 LEU A 112 1.640 -9.761 3.197 1.00 0.00 H new ATOM 0 HD12 LEU A 112 1.353 -9.272 4.884 1.00 0.00 H new ATOM 0 HD13 LEU A 112 0.000 -9.851 3.882 1.00 0.00 H new ATOM 0 HD21 LEU A 112 0.855 -8.342 1.336 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -0.815 -8.372 1.949 1.00 0.00 H new ATOM 0 HD23 LEU A 112 0.001 -6.816 1.666 1.00 0.00 H new ATOM 1183 N ASP A 113 -1.857 -10.198 5.542 1.00 0.00 N ATOM 1184 CA ASP A 113 -1.709 -11.243 6.545 1.00 0.00 C ATOM 1185 C ASP A 113 -2.514 -10.866 7.797 1.00 0.00 C ATOM 1186 O ASP A 113 -3.715 -10.610 7.704 1.00 0.00 O ATOM 1187 CB ASP A 113 -0.224 -11.458 6.868 1.00 0.00 C ATOM 1188 CG ASP A 113 0.032 -12.781 7.564 1.00 0.00 C ATOM 1189 OD1 ASP A 113 0.946 -13.512 7.130 1.00 0.00 O ATOM 1190 OD2 ASP A 113 -0.682 -13.085 8.543 1.00 0.00 O ATOM 0 H ASP A 113 -2.357 -10.483 4.700 1.00 0.00 H new ATOM 0 HA ASP A 113 -2.100 -12.185 6.160 1.00 0.00 H new ATOM 0 HB2 ASP A 113 0.355 -11.418 5.945 1.00 0.00 H new ATOM 0 HB3 ASP A 113 0.129 -10.644 7.501 1.00 0.00 H new ATOM 1195 N SER A 114 -1.866 -10.815 8.960 1.00 0.00 N ATOM 1196 CA SER A 114 -2.548 -10.449 10.194 1.00 0.00 C ATOM 1197 C SER A 114 -2.336 -8.971 10.516 1.00 0.00 C ATOM 1198 O SER A 114 -2.531 -8.542 11.653 1.00 0.00 O ATOM 1199 CB SER A 114 -2.046 -11.313 11.353 1.00 0.00 C ATOM 1200 OG SER A 114 -2.661 -12.589 11.343 1.00 0.00 O ATOM 0 H SER A 114 -0.873 -11.022 9.070 1.00 0.00 H new ATOM 0 HA SER A 114 -3.615 -10.622 10.056 1.00 0.00 H new ATOM 0 HB2 SER A 114 -0.964 -11.427 11.283 1.00 0.00 H new ATOM 0 HB3 SER A 114 -2.254 -10.813 12.299 1.00 0.00 H new ATOM 0 HG SER A 114 -2.322 -13.122 12.092 1.00 0.00 H new ATOM 1206 N VAL A 115 -1.924 -8.197 9.513 1.00 0.00 N ATOM 1207 CA VAL A 115 -1.678 -6.772 9.701 1.00 0.00 C ATOM 1208 C VAL A 115 -2.510 -5.929 8.740 1.00 0.00 C ATOM 1209 O VAL A 115 -2.902 -6.392 7.670 1.00 0.00 O ATOM 1210 CB VAL A 115 -0.187 -6.432 9.499 1.00 0.00 C ATOM 1211 CG1 VAL A 115 0.083 -4.975 9.842 1.00 0.00 C ATOM 1212 CG2 VAL A 115 0.689 -7.355 10.331 1.00 0.00 C ATOM 0 H VAL A 115 -1.755 -8.534 8.565 1.00 0.00 H new ATOM 0 HA VAL A 115 -1.968 -6.537 10.725 1.00 0.00 H new ATOM 0 HB VAL A 115 0.061 -6.584 8.448 1.00 0.00 H new ATOM 0 HG11 VAL A 115 1.140 -4.756 9.693 1.00 0.00 H new ATOM 0 HG12 VAL A 115 -0.515 -4.332 9.196 1.00 0.00 H new ATOM 0 HG13 VAL A 115 -0.182 -4.791 10.883 1.00 0.00 H new ATOM 0 HG21 VAL A 115 1.737 -7.100 10.175 1.00 0.00 H new ATOM 0 HG22 VAL A 115 0.440 -7.239 11.386 1.00 0.00 H new ATOM 0 HG23 VAL A 115 0.518 -8.388 10.029 1.00 0.00 H new ATOM 1222 N GLU A 116 -2.770 -4.685 9.131 1.00 0.00 N ATOM 1223 CA GLU A 116 -3.550 -3.769 8.306 1.00 0.00 C ATOM 1224 C GLU A 116 -2.633 -2.929 7.423 1.00 0.00 C ATOM 1225 O GLU A 116 -1.631 -2.387 7.891 1.00 0.00 O ATOM 1226 CB GLU A 116 -4.404 -2.856 9.189 1.00 0.00 C ATOM 1227 CG GLU A 116 -3.588 -1.918 10.064 1.00 0.00 C ATOM 1228 CD GLU A 116 -4.455 -0.959 10.855 1.00 0.00 C ATOM 1229 OE1 GLU A 116 -5.639 -1.280 11.086 1.00 0.00 O ATOM 1230 OE2 GLU A 116 -3.949 0.115 11.244 1.00 0.00 O ATOM 0 H GLU A 116 -2.451 -4.288 10.015 1.00 0.00 H new ATOM 0 HA GLU A 116 -4.206 -4.359 7.666 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -5.064 -2.265 8.554 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -5.040 -3.471 9.825 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -2.981 -2.505 10.752 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -2.900 -1.349 9.438 1.00 0.00 H new ATOM 1237 N VAL A 117 -2.977 -2.828 6.143 1.00 0.00 N ATOM 1238 CA VAL A 117 -2.176 -2.056 5.200 1.00 0.00 C ATOM 1239 C VAL A 117 -3.052 -1.213 4.275 1.00 0.00 C ATOM 1240 O VAL A 117 -4.281 -1.348 4.258 1.00 0.00 O ATOM 1241 CB VAL A 117 -1.275 -2.975 4.350 1.00 0.00 C ATOM 1242 CG1 VAL A 117 -0.367 -3.808 5.242 1.00 0.00 C ATOM 1243 CG2 VAL A 117 -2.117 -3.872 3.451 1.00 0.00 C ATOM 0 H VAL A 117 -3.802 -3.269 5.736 1.00 0.00 H new ATOM 0 HA VAL A 117 -1.550 -1.389 5.793 1.00 0.00 H new ATOM 0 HB VAL A 117 -0.649 -2.348 3.715 1.00 0.00 H new ATOM 0 HG11 VAL A 117 0.261 -4.450 4.624 1.00 0.00 H new ATOM 0 HG12 VAL A 117 0.264 -3.148 5.837 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -0.974 -4.424 5.905 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -1.462 -4.512 2.860 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -2.772 -4.491 4.065 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -2.720 -3.256 2.784 1.00 0.00 H new ATOM 1253 N HIS A 118 -2.403 -0.337 3.515 1.00 0.00 N ATOM 1254 CA HIS A 118 -3.105 0.544 2.588 1.00 0.00 C ATOM 1255 C HIS A 118 -2.913 0.101 1.144 1.00 0.00 C ATOM 1256 O HIS A 118 -1.787 0.004 0.658 1.00 0.00 O ATOM 1257 CB HIS A 118 -2.598 1.975 2.745 1.00 0.00 C ATOM 1258 CG HIS A 118 -3.346 2.984 1.922 1.00 0.00 C ATOM 1259 ND1 HIS A 118 -4.193 3.921 2.471 1.00 0.00 N ATOM 1260 CD2 HIS A 118 -3.359 3.212 0.583 1.00 0.00 C ATOM 1261 CE1 HIS A 118 -4.691 4.678 1.510 1.00 0.00 C ATOM 1262 NE2 HIS A 118 -4.202 4.267 0.357 1.00 0.00 N ATOM 0 H HIS A 118 -1.390 -0.218 3.523 1.00 0.00 H new ATOM 0 HA HIS A 118 -4.168 0.496 2.826 1.00 0.00 H new ATOM 0 HB2 HIS A 118 -2.663 2.259 3.795 1.00 0.00 H new ATOM 0 HB3 HIS A 118 -1.544 2.008 2.470 1.00 0.00 H new ATOM 0 HD2 HIS A 118 -2.807 2.663 -0.165 1.00 0.00 H new ATOM 0 HE1 HIS A 118 -5.383 5.496 1.646 1.00 0.00 H new ATOM 0 HE2 HIS A 118 -4.417 4.669 -0.555 1.00 0.00 H new ATOM 1271 N LEU A 119 -4.021 -0.140 0.456 1.00 0.00 N ATOM 1272 CA LEU A 119 -3.976 -0.543 -0.940 1.00 0.00 C ATOM 1273 C LEU A 119 -4.880 0.351 -1.776 1.00 0.00 C ATOM 1274 O LEU A 119 -6.075 0.459 -1.507 1.00 0.00 O ATOM 1275 CB LEU A 119 -4.396 -1.996 -1.115 1.00 0.00 C ATOM 1276 CG LEU A 119 -3.761 -2.673 -2.324 1.00 0.00 C ATOM 1277 CD1 LEU A 119 -2.748 -3.725 -1.893 1.00 0.00 C ATOM 1278 CD2 LEU A 119 -4.821 -3.280 -3.225 1.00 0.00 C ATOM 0 H LEU A 119 -4.961 -0.063 0.843 1.00 0.00 H new ATOM 0 HA LEU A 119 -2.945 -0.441 -1.279 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -4.131 -2.553 -0.216 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -5.481 -2.043 -1.211 1.00 0.00 H new ATOM 0 HG LEU A 119 -3.230 -1.910 -2.894 1.00 0.00 H new ATOM 0 HD11 LEU A 119 -2.311 -4.192 -2.775 1.00 0.00 H new ATOM 0 HD12 LEU A 119 -1.961 -3.253 -1.305 1.00 0.00 H new ATOM 0 HD13 LEU A 119 -3.246 -4.484 -1.290 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -4.342 -3.757 -4.080 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -5.391 -4.023 -2.667 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -5.493 -2.496 -3.576 1.00 0.00 H new ATOM 1290 N PRO A 120 -4.326 1.014 -2.801 1.00 0.00 N ATOM 1291 CA PRO A 120 -5.104 1.899 -3.659 1.00 0.00 C ATOM 1292 C PRO A 120 -6.299 1.184 -4.291 1.00 0.00 C ATOM 1293 O PRO A 120 -6.194 0.035 -4.719 1.00 0.00 O ATOM 1294 CB PRO A 120 -4.107 2.361 -4.728 1.00 0.00 C ATOM 1295 CG PRO A 120 -2.952 1.426 -4.628 1.00 0.00 C ATOM 1296 CD PRO A 120 -2.913 0.961 -3.203 1.00 0.00 C ATOM 0 HA PRO A 120 -5.536 2.729 -3.099 1.00 0.00 H new ATOM 0 HB2 PRO A 120 -4.554 2.327 -5.722 1.00 0.00 H new ATOM 0 HB3 PRO A 120 -3.794 3.391 -4.554 1.00 0.00 H new ATOM 0 HG2 PRO A 120 -3.073 0.584 -5.309 1.00 0.00 H new ATOM 0 HG3 PRO A 120 -2.022 1.925 -4.900 1.00 0.00 H new ATOM 0 HD2 PRO A 120 -2.506 -0.047 -3.118 1.00 0.00 H new ATOM 0 HD3 PRO A 120 -2.292 1.608 -2.584 1.00 0.00 H new ATOM 1304 N PRO A 121 -7.460 1.861 -4.337 1.00 0.00 N ATOM 1305 CA PRO A 121 -8.705 1.307 -4.895 1.00 0.00 C ATOM 1306 C PRO A 121 -8.573 0.756 -6.317 1.00 0.00 C ATOM 1307 O PRO A 121 -9.484 0.090 -6.807 1.00 0.00 O ATOM 1308 CB PRO A 121 -9.670 2.504 -4.888 1.00 0.00 C ATOM 1309 CG PRO A 121 -8.813 3.704 -4.664 1.00 0.00 C ATOM 1310 CD PRO A 121 -7.670 3.223 -3.828 1.00 0.00 C ATOM 0 HA PRO A 121 -9.033 0.450 -4.307 1.00 0.00 H new ATOM 0 HB2 PRO A 121 -10.210 2.578 -5.832 1.00 0.00 H new ATOM 0 HB3 PRO A 121 -10.416 2.402 -4.100 1.00 0.00 H new ATOM 0 HG2 PRO A 121 -8.462 4.118 -5.609 1.00 0.00 H new ATOM 0 HG3 PRO A 121 -9.367 4.493 -4.156 1.00 0.00 H new ATOM 0 HD2 PRO A 121 -6.784 3.845 -3.954 1.00 0.00 H new ATOM 0 HD3 PRO A 121 -7.914 3.227 -2.766 1.00 0.00 H new ATOM 1318 N PHE A 122 -7.461 1.037 -6.989 1.00 0.00 N ATOM 1319 CA PHE A 122 -7.281 0.554 -8.358 1.00 0.00 C ATOM 1320 C PHE A 122 -6.679 -0.848 -8.401 1.00 0.00 C ATOM 1321 O PHE A 122 -6.613 -1.461 -9.467 1.00 0.00 O ATOM 1322 CB PHE A 122 -6.430 1.515 -9.208 1.00 0.00 C ATOM 1323 CG PHE A 122 -5.665 2.556 -8.435 1.00 0.00 C ATOM 1324 CD1 PHE A 122 -6.328 3.534 -7.706 1.00 0.00 C ATOM 1325 CD2 PHE A 122 -4.281 2.563 -8.454 1.00 0.00 C ATOM 1326 CE1 PHE A 122 -5.620 4.495 -7.010 1.00 0.00 C ATOM 1327 CE2 PHE A 122 -3.570 3.521 -7.758 1.00 0.00 C ATOM 1328 CZ PHE A 122 -4.239 4.488 -7.036 1.00 0.00 C ATOM 0 H PHE A 122 -6.684 1.585 -6.620 1.00 0.00 H new ATOM 0 HA PHE A 122 -8.281 0.510 -8.789 1.00 0.00 H new ATOM 0 HB2 PHE A 122 -5.722 0.927 -9.791 1.00 0.00 H new ATOM 0 HB3 PHE A 122 -7.084 2.022 -9.918 1.00 0.00 H new ATOM 0 HD1 PHE A 122 -7.408 3.544 -7.683 1.00 0.00 H new ATOM 0 HD2 PHE A 122 -3.751 1.811 -9.019 1.00 0.00 H new ATOM 0 HE1 PHE A 122 -6.146 5.251 -6.446 1.00 0.00 H new ATOM 0 HE2 PHE A 122 -2.490 3.513 -7.779 1.00 0.00 H new ATOM 0 HZ PHE A 122 -3.684 5.238 -6.492 1.00 0.00 H new ATOM 1338 N TRP A 123 -6.242 -1.362 -7.257 1.00 0.00 N ATOM 1339 CA TRP A 123 -5.659 -2.693 -7.211 1.00 0.00 C ATOM 1340 C TRP A 123 -6.634 -3.715 -6.630 1.00 0.00 C ATOM 1341 O TRP A 123 -6.348 -4.910 -6.613 1.00 0.00 O ATOM 1342 CB TRP A 123 -4.383 -2.666 -6.387 1.00 0.00 C ATOM 1343 CG TRP A 123 -3.325 -1.778 -6.952 1.00 0.00 C ATOM 1344 CD1 TRP A 123 -3.261 -1.238 -8.205 1.00 0.00 C ATOM 1345 CD2 TRP A 123 -2.179 -1.319 -6.257 1.00 0.00 C ATOM 1346 NE1 TRP A 123 -2.130 -0.457 -8.319 1.00 0.00 N ATOM 1347 CE2 TRP A 123 -1.453 -0.493 -7.127 1.00 0.00 C ATOM 1348 CE3 TRP A 123 -1.706 -1.530 -4.972 1.00 0.00 C ATOM 1349 CZ2 TRP A 123 -0.269 0.125 -6.737 1.00 0.00 C ATOM 1350 CZ3 TRP A 123 -0.539 -0.921 -4.587 1.00 0.00 C ATOM 1351 CH2 TRP A 123 0.166 -0.102 -5.463 1.00 0.00 C ATOM 0 H TRP A 123 -6.280 -0.881 -6.358 1.00 0.00 H new ATOM 0 HA TRP A 123 -5.430 -2.996 -8.233 1.00 0.00 H new ATOM 0 HB2 TRP A 123 -4.621 -2.336 -5.376 1.00 0.00 H new ATOM 0 HB3 TRP A 123 -3.990 -3.680 -6.308 1.00 0.00 H new ATOM 0 HD1 TRP A 123 -3.987 -1.398 -8.989 1.00 0.00 H new ATOM 0 HE1 TRP A 123 -1.845 0.061 -9.150 1.00 0.00 H new ATOM 0 HE3 TRP A 123 -2.247 -2.164 -4.285 1.00 0.00 H new ATOM 0 HZ2 TRP A 123 0.284 0.759 -7.415 1.00 0.00 H new ATOM 0 HZ3 TRP A 123 -0.161 -1.080 -3.588 1.00 0.00 H new ATOM 0 HH2 TRP A 123 1.080 0.366 -5.127 1.00 0.00 H new ATOM 1362 N GLU A 124 -7.791 -3.248 -6.159 1.00 0.00 N ATOM 1363 CA GLU A 124 -8.796 -4.144 -5.591 1.00 0.00 C ATOM 1364 C GLU A 124 -9.073 -5.304 -6.542 1.00 0.00 C ATOM 1365 O GLU A 124 -9.382 -6.415 -6.115 1.00 0.00 O ATOM 1366 CB GLU A 124 -10.094 -3.385 -5.305 1.00 0.00 C ATOM 1367 CG GLU A 124 -10.535 -2.477 -6.441 1.00 0.00 C ATOM 1368 CD GLU A 124 -11.726 -3.029 -7.201 1.00 0.00 C ATOM 1369 OE1 GLU A 124 -12.545 -3.741 -6.584 1.00 0.00 O ATOM 1370 OE2 GLU A 124 -11.838 -2.750 -8.413 1.00 0.00 O ATOM 0 H GLU A 124 -8.053 -2.262 -6.160 1.00 0.00 H new ATOM 0 HA GLU A 124 -8.407 -4.540 -4.653 1.00 0.00 H new ATOM 0 HB2 GLU A 124 -10.887 -4.104 -5.098 1.00 0.00 H new ATOM 0 HB3 GLU A 124 -9.963 -2.787 -4.403 1.00 0.00 H new ATOM 0 HG2 GLU A 124 -10.788 -1.496 -6.039 1.00 0.00 H new ATOM 0 HG3 GLU A 124 -9.703 -2.334 -7.131 1.00 0.00 H new ATOM 1377 N GLN A 125 -8.945 -5.030 -7.836 1.00 0.00 N ATOM 1378 CA GLN A 125 -9.166 -6.040 -8.862 1.00 0.00 C ATOM 1379 C GLN A 125 -7.859 -6.744 -9.209 1.00 0.00 C ATOM 1380 O GLN A 125 -7.857 -7.896 -9.645 1.00 0.00 O ATOM 1381 CB GLN A 125 -9.758 -5.395 -10.116 1.00 0.00 C ATOM 1382 CG GLN A 125 -8.888 -4.291 -10.700 1.00 0.00 C ATOM 1383 CD GLN A 125 -9.665 -3.018 -10.973 1.00 0.00 C ATOM 1384 OE1 GLN A 125 -10.847 -3.059 -11.319 1.00 0.00 O ATOM 1385 NE2 GLN A 125 -9.004 -1.877 -10.818 1.00 0.00 N ATOM 0 H GLN A 125 -8.688 -4.112 -8.199 1.00 0.00 H new ATOM 0 HA GLN A 125 -9.868 -6.778 -8.474 1.00 0.00 H new ATOM 0 HB2 GLN A 125 -9.911 -6.164 -10.873 1.00 0.00 H new ATOM 0 HB3 GLN A 125 -10.739 -4.985 -9.875 1.00 0.00 H new ATOM 0 HG2 GLN A 125 -8.072 -4.073 -10.010 1.00 0.00 H new ATOM 0 HG3 GLN A 125 -8.436 -4.642 -11.628 1.00 0.00 H new ATOM 0 HE21 GLN A 125 -8.026 -1.889 -10.530 1.00 0.00 H new ATOM 0 HE22 GLN A 125 -9.475 -0.988 -10.987 1.00 0.00 H new ATOM 1394 N TYR A 126 -6.747 -6.042 -9.010 1.00 0.00 N ATOM 1395 CA TYR A 126 -5.428 -6.590 -9.298 1.00 0.00 C ATOM 1396 C TYR A 126 -4.966 -7.538 -8.193 1.00 0.00 C ATOM 1397 O TYR A 126 -4.033 -8.319 -8.387 1.00 0.00 O ATOM 1398 CB TYR A 126 -4.410 -5.460 -9.466 1.00 0.00 C ATOM 1399 CG TYR A 126 -4.824 -4.392 -10.460 1.00 0.00 C ATOM 1400 CD1 TYR A 126 -5.910 -4.573 -11.311 1.00 0.00 C ATOM 1401 CD2 TYR A 126 -4.123 -3.197 -10.542 1.00 0.00 C ATOM 1402 CE1 TYR A 126 -6.281 -3.594 -12.213 1.00 0.00 C ATOM 1403 CE2 TYR A 126 -4.489 -2.213 -11.441 1.00 0.00 C ATOM 1404 CZ TYR A 126 -5.567 -2.416 -12.274 1.00 0.00 C ATOM 1405 OH TYR A 126 -5.934 -1.439 -13.171 1.00 0.00 O ATOM 0 H TYR A 126 -6.735 -5.088 -8.649 1.00 0.00 H new ATOM 0 HA TYR A 126 -5.500 -7.156 -10.227 1.00 0.00 H new ATOM 0 HB2 TYR A 126 -4.241 -4.992 -8.496 1.00 0.00 H new ATOM 0 HB3 TYR A 126 -3.459 -5.887 -9.784 1.00 0.00 H new ATOM 0 HD1 TYR A 126 -6.472 -5.494 -11.266 1.00 0.00 H new ATOM 0 HD2 TYR A 126 -3.276 -3.033 -9.892 1.00 0.00 H new ATOM 0 HE1 TYR A 126 -7.126 -3.751 -12.867 1.00 0.00 H new ATOM 0 HE2 TYR A 126 -3.932 -1.289 -11.490 1.00 0.00 H new ATOM 0 HH TYR A 126 -5.329 -0.673 -13.085 1.00 0.00 H new ATOM 1415 N ILE A 127 -5.611 -7.462 -7.031 1.00 0.00 N ATOM 1416 CA ILE A 127 -5.246 -8.311 -5.903 1.00 0.00 C ATOM 1417 C ILE A 127 -5.766 -9.737 -6.082 1.00 0.00 C ATOM 1418 O ILE A 127 -6.970 -9.985 -6.035 1.00 0.00 O ATOM 1419 CB ILE A 127 -5.771 -7.741 -4.568 1.00 0.00 C ATOM 1420 CG1 ILE A 127 -7.286 -7.543 -4.613 1.00 0.00 C ATOM 1421 CG2 ILE A 127 -5.082 -6.426 -4.241 1.00 0.00 C ATOM 1422 CD1 ILE A 127 -7.975 -7.942 -3.328 1.00 0.00 C ATOM 0 H ILE A 127 -6.385 -6.824 -6.848 1.00 0.00 H new ATOM 0 HA ILE A 127 -4.157 -8.333 -5.873 1.00 0.00 H new ATOM 0 HB ILE A 127 -5.543 -8.463 -3.784 1.00 0.00 H new ATOM 0 HG12 ILE A 127 -7.503 -6.496 -4.825 1.00 0.00 H new ATOM 0 HG13 ILE A 127 -7.698 -8.127 -5.436 1.00 0.00 H new ATOM 0 HG21 ILE A 127 -5.465 -6.040 -3.297 1.00 0.00 H new ATOM 0 HG22 ILE A 127 -4.008 -6.589 -4.157 1.00 0.00 H new ATOM 0 HG23 ILE A 127 -5.279 -5.705 -5.035 1.00 0.00 H new ATOM 0 HD11 ILE A 127 -9.048 -7.778 -3.424 1.00 0.00 H new ATOM 0 HD12 ILE A 127 -7.786 -8.996 -3.126 1.00 0.00 H new ATOM 0 HD13 ILE A 127 -7.588 -7.340 -2.506 1.00 0.00 H new ATOM 1434 N ASN A 128 -4.843 -10.672 -6.283 1.00 0.00 N ATOM 1435 CA ASN A 128 -5.197 -12.078 -6.465 1.00 0.00 C ATOM 1436 C ASN A 128 -4.900 -12.878 -5.198 1.00 0.00 C ATOM 1437 O ASN A 128 -4.475 -12.315 -4.188 1.00 0.00 O ATOM 1438 CB ASN A 128 -4.425 -12.672 -7.647 1.00 0.00 C ATOM 1439 CG ASN A 128 -4.320 -11.711 -8.818 1.00 0.00 C ATOM 1440 OD1 ASN A 128 -5.088 -11.798 -9.777 1.00 0.00 O ATOM 1441 ND2 ASN A 128 -3.367 -10.787 -8.746 1.00 0.00 N ATOM 0 H ASN A 128 -3.842 -10.482 -6.324 1.00 0.00 H new ATOM 0 HA ASN A 128 -6.266 -12.136 -6.672 1.00 0.00 H new ATOM 0 HB2 ASN A 128 -3.423 -12.950 -7.319 1.00 0.00 H new ATOM 0 HB3 ASN A 128 -4.918 -13.587 -7.976 1.00 0.00 H new ATOM 0 HD21 ASN A 128 -3.250 -10.114 -9.504 1.00 0.00 H new ATOM 0 HD22 ASN A 128 -2.752 -10.751 -7.933 1.00 0.00 H new ATOM 1448 N ASP A 129 -5.115 -14.195 -5.253 1.00 0.00 N ATOM 1449 CA ASP A 129 -4.854 -15.063 -4.102 1.00 0.00 C ATOM 1450 C ASP A 129 -3.474 -14.766 -3.525 1.00 0.00 C ATOM 1451 O ASP A 129 -3.336 -14.421 -2.354 1.00 0.00 O ATOM 1452 CB ASP A 129 -4.947 -16.534 -4.510 1.00 0.00 C ATOM 1453 CG ASP A 129 -5.185 -17.450 -3.325 1.00 0.00 C ATOM 1454 OD1 ASP A 129 -5.709 -18.564 -3.532 1.00 0.00 O ATOM 1455 OD2 ASP A 129 -4.846 -17.052 -2.191 1.00 0.00 O ATOM 0 H ASP A 129 -5.467 -14.681 -6.077 1.00 0.00 H new ATOM 0 HA ASP A 129 -5.607 -14.865 -3.339 1.00 0.00 H new ATOM 0 HB2 ASP A 129 -5.756 -16.658 -5.230 1.00 0.00 H new ATOM 0 HB3 ASP A 129 -4.026 -16.827 -5.013 1.00 0.00 H new ATOM 1460 N GLU A 130 -2.464 -14.868 -4.377 1.00 0.00 N ATOM 1461 CA GLU A 130 -1.092 -14.574 -3.990 1.00 0.00 C ATOM 1462 C GLU A 130 -0.548 -13.516 -4.935 1.00 0.00 C ATOM 1463 O GLU A 130 -0.628 -13.672 -6.154 1.00 0.00 O ATOM 1464 CB GLU A 130 -0.228 -15.836 -4.048 1.00 0.00 C ATOM 1465 CG GLU A 130 0.835 -15.898 -2.964 1.00 0.00 C ATOM 1466 CD GLU A 130 0.376 -16.667 -1.741 1.00 0.00 C ATOM 1467 OE1 GLU A 130 -0.848 -16.732 -1.505 1.00 0.00 O ATOM 1468 OE2 GLU A 130 1.242 -17.205 -1.019 1.00 0.00 O ATOM 0 H GLU A 130 -2.571 -15.155 -5.350 1.00 0.00 H new ATOM 0 HA GLU A 130 -1.070 -14.208 -2.964 1.00 0.00 H new ATOM 0 HB2 GLU A 130 -0.872 -16.711 -3.963 1.00 0.00 H new ATOM 0 HB3 GLU A 130 0.256 -15.890 -5.023 1.00 0.00 H new ATOM 0 HG2 GLU A 130 1.733 -16.366 -3.367 1.00 0.00 H new ATOM 0 HG3 GLU A 130 1.108 -14.885 -2.670 1.00 0.00 H new ATOM 1475 N ASN A 131 -0.034 -12.419 -4.391 1.00 0.00 N ATOM 1476 CA ASN A 131 0.462 -11.345 -5.240 1.00 0.00 C ATOM 1477 C ASN A 131 1.748 -10.734 -4.729 1.00 0.00 C ATOM 1478 O ASN A 131 2.027 -10.721 -3.530 1.00 0.00 O ATOM 1479 CB ASN A 131 -0.589 -10.240 -5.366 1.00 0.00 C ATOM 1480 CG ASN A 131 -1.997 -10.740 -5.124 1.00 0.00 C ATOM 1481 OD1 ASN A 131 -2.433 -11.720 -5.727 1.00 0.00 O ATOM 1482 ND2 ASN A 131 -2.720 -10.068 -4.234 1.00 0.00 N ATOM 0 H ASN A 131 0.049 -12.252 -3.388 1.00 0.00 H new ATOM 0 HA ASN A 131 0.667 -11.795 -6.211 1.00 0.00 H new ATOM 0 HB2 ASN A 131 -0.363 -9.447 -4.654 1.00 0.00 H new ATOM 0 HB3 ASN A 131 -0.530 -9.801 -6.362 1.00 0.00 H new ATOM 0 HD21 ASN A 131 -3.676 -10.360 -4.028 1.00 0.00 H new ATOM 0 HD22 ASN A 131 -2.319 -9.261 -3.757 1.00 0.00 H new ATOM 1489 N THR A 132 2.500 -10.180 -5.666 1.00 0.00 N ATOM 1490 CA THR A 132 3.742 -9.499 -5.357 1.00 0.00 C ATOM 1491 C THR A 132 3.408 -8.084 -4.915 1.00 0.00 C ATOM 1492 O THR A 132 2.944 -7.268 -5.718 1.00 0.00 O ATOM 1493 CB THR A 132 4.665 -9.472 -6.577 1.00 0.00 C ATOM 1494 OG1 THR A 132 4.516 -10.654 -7.344 1.00 0.00 O ATOM 1495 CG2 THR A 132 6.130 -9.341 -6.216 1.00 0.00 C ATOM 0 H THR A 132 2.266 -10.191 -6.659 1.00 0.00 H new ATOM 0 HA THR A 132 4.265 -10.029 -4.561 1.00 0.00 H new ATOM 0 HB THR A 132 4.367 -8.591 -7.146 1.00 0.00 H new ATOM 0 HG1 THR A 132 5.113 -10.618 -8.120 1.00 0.00 H new ATOM 0 HG21 THR A 132 6.729 -9.328 -7.126 1.00 0.00 H new ATOM 0 HG22 THR A 132 6.287 -8.414 -5.665 1.00 0.00 H new ATOM 0 HG23 THR A 132 6.429 -10.187 -5.597 1.00 0.00 H new ATOM 1503 N VAL A 133 3.595 -7.814 -3.630 1.00 0.00 N ATOM 1504 CA VAL A 133 3.266 -6.507 -3.077 1.00 0.00 C ATOM 1505 C VAL A 133 4.476 -5.805 -2.482 1.00 0.00 C ATOM 1506 O VAL A 133 5.202 -6.366 -1.661 1.00 0.00 O ATOM 1507 CB VAL A 133 2.165 -6.610 -1.992 1.00 0.00 C ATOM 1508 CG1 VAL A 133 0.846 -6.063 -2.512 1.00 0.00 C ATOM 1509 CG2 VAL A 133 1.998 -8.045 -1.506 1.00 0.00 C ATOM 0 H VAL A 133 3.971 -8.479 -2.954 1.00 0.00 H new ATOM 0 HA VAL A 133 2.899 -5.916 -3.916 1.00 0.00 H new ATOM 0 HB VAL A 133 2.479 -6.005 -1.141 1.00 0.00 H new ATOM 0 HG11 VAL A 133 0.086 -6.145 -1.735 1.00 0.00 H new ATOM 0 HG12 VAL A 133 0.970 -5.016 -2.789 1.00 0.00 H new ATOM 0 HG13 VAL A 133 0.534 -6.635 -3.386 1.00 0.00 H new ATOM 0 HG21 VAL A 133 1.218 -8.083 -0.745 1.00 0.00 H new ATOM 0 HG22 VAL A 133 1.719 -8.683 -2.344 1.00 0.00 H new ATOM 0 HG23 VAL A 133 2.938 -8.397 -1.080 1.00 0.00 H new ATOM 1519 N GLU A 134 4.656 -4.552 -2.881 1.00 0.00 N ATOM 1520 CA GLU A 134 5.741 -3.729 -2.375 1.00 0.00 C ATOM 1521 C GLU A 134 5.148 -2.555 -1.612 1.00 0.00 C ATOM 1522 O GLU A 134 4.452 -1.718 -2.189 1.00 0.00 O ATOM 1523 CB GLU A 134 6.627 -3.225 -3.509 1.00 0.00 C ATOM 1524 CG GLU A 134 7.322 -4.337 -4.280 1.00 0.00 C ATOM 1525 CD GLU A 134 6.571 -4.732 -5.536 1.00 0.00 C ATOM 1526 OE1 GLU A 134 6.783 -4.085 -6.584 1.00 0.00 O ATOM 1527 OE2 GLU A 134 5.772 -5.689 -5.474 1.00 0.00 O ATOM 0 H GLU A 134 4.057 -4.083 -3.560 1.00 0.00 H new ATOM 0 HA GLU A 134 6.364 -4.330 -1.713 1.00 0.00 H new ATOM 0 HB2 GLU A 134 6.020 -2.640 -4.200 1.00 0.00 H new ATOM 0 HB3 GLU A 134 7.381 -2.553 -3.099 1.00 0.00 H new ATOM 0 HG2 GLU A 134 8.328 -4.014 -4.549 1.00 0.00 H new ATOM 0 HG3 GLU A 134 7.429 -5.209 -3.635 1.00 0.00 H new ATOM 1534 N LEU A 135 5.398 -2.515 -0.314 1.00 0.00 N ATOM 1535 CA LEU A 135 4.850 -1.457 0.526 1.00 0.00 C ATOM 1536 C LEU A 135 5.901 -0.835 1.432 1.00 0.00 C ATOM 1537 O LEU A 135 6.866 -1.486 1.828 1.00 0.00 O ATOM 1538 CB LEU A 135 3.710 -2.011 1.382 1.00 0.00 C ATOM 1539 CG LEU A 135 3.999 -3.356 2.055 1.00 0.00 C ATOM 1540 CD1 LEU A 135 4.915 -3.171 3.257 1.00 0.00 C ATOM 1541 CD2 LEU A 135 2.699 -4.031 2.470 1.00 0.00 C ATOM 0 H LEU A 135 5.973 -3.197 0.181 1.00 0.00 H new ATOM 0 HA LEU A 135 4.480 -0.677 -0.140 1.00 0.00 H new ATOM 0 HB2 LEU A 135 3.468 -1.281 2.154 1.00 0.00 H new ATOM 0 HB3 LEU A 135 2.825 -2.118 0.755 1.00 0.00 H new ATOM 0 HG LEU A 135 4.508 -3.998 1.336 1.00 0.00 H new ATOM 0 HD11 LEU A 135 5.107 -4.139 3.720 1.00 0.00 H new ATOM 0 HD12 LEU A 135 5.858 -2.731 2.932 1.00 0.00 H new ATOM 0 HD13 LEU A 135 4.437 -2.511 3.981 1.00 0.00 H new ATOM 0 HD21 LEU A 135 2.921 -4.986 2.947 1.00 0.00 H new ATOM 0 HD22 LEU A 135 2.164 -3.391 3.172 1.00 0.00 H new ATOM 0 HD23 LEU A 135 2.080 -4.201 1.589 1.00 0.00 H new ATOM 1553 N ILE A 136 5.674 0.424 1.785 1.00 0.00 N ATOM 1554 CA ILE A 136 6.567 1.147 2.679 1.00 0.00 C ATOM 1555 C ILE A 136 5.837 1.415 3.990 1.00 0.00 C ATOM 1556 O ILE A 136 4.681 1.822 3.982 1.00 0.00 O ATOM 1557 CB ILE A 136 7.076 2.483 2.077 1.00 0.00 C ATOM 1558 CG1 ILE A 136 6.601 2.686 0.632 1.00 0.00 C ATOM 1559 CG2 ILE A 136 8.590 2.516 2.124 1.00 0.00 C ATOM 1560 CD1 ILE A 136 6.232 4.121 0.321 1.00 0.00 C ATOM 0 H ILE A 136 4.873 0.968 1.463 1.00 0.00 H new ATOM 0 HA ILE A 136 7.447 0.525 2.843 1.00 0.00 H new ATOM 0 HB ILE A 136 6.661 3.294 2.676 1.00 0.00 H new ATOM 0 HG12 ILE A 136 7.387 2.364 -0.051 1.00 0.00 H new ATOM 0 HG13 ILE A 136 5.737 2.047 0.447 1.00 0.00 H new ATOM 0 HG21 ILE A 136 8.947 3.455 1.701 1.00 0.00 H new ATOM 0 HG22 ILE A 136 8.924 2.434 3.158 1.00 0.00 H new ATOM 0 HG23 ILE A 136 8.990 1.683 1.547 1.00 0.00 H new ATOM 0 HD11 ILE A 136 5.905 4.196 -0.716 1.00 0.00 H new ATOM 0 HD12 ILE A 136 5.425 4.440 0.980 1.00 0.00 H new ATOM 0 HD13 ILE A 136 7.101 4.761 0.475 1.00 0.00 H new ATOM 1572 N HIS A 137 6.493 1.154 5.112 1.00 0.00 N ATOM 1573 CA HIS A 137 5.859 1.332 6.413 1.00 0.00 C ATOM 1574 C HIS A 137 5.770 2.795 6.821 1.00 0.00 C ATOM 1575 O HIS A 137 6.782 3.470 7.008 1.00 0.00 O ATOM 1576 CB HIS A 137 6.602 0.509 7.464 1.00 0.00 C ATOM 1577 CG HIS A 137 6.801 -0.915 7.038 1.00 0.00 C ATOM 1578 ND1 HIS A 137 6.094 -1.974 7.571 1.00 0.00 N ATOM 1579 CD2 HIS A 137 7.613 -1.448 6.095 1.00 0.00 C ATOM 1580 CE1 HIS A 137 6.465 -3.095 6.970 1.00 0.00 C ATOM 1581 NE2 HIS A 137 7.385 -2.800 6.073 1.00 0.00 N ATOM 0 H HIS A 137 7.456 0.821 5.150 1.00 0.00 H new ATOM 0 HA HIS A 137 4.832 0.974 6.337 1.00 0.00 H new ATOM 0 HB2 HIS A 137 7.572 0.966 7.660 1.00 0.00 H new ATOM 0 HB3 HIS A 137 6.044 0.531 8.400 1.00 0.00 H new ATOM 0 HD1 HIS A 137 5.396 -1.904 8.311 1.00 0.00 H new ATOM 0 HD2 HIS A 137 8.312 -0.908 5.474 1.00 0.00 H new ATOM 0 HE1 HIS A 137 6.080 -4.082 7.179 1.00 0.00 H new ATOM 1590 N THR A 138 4.535 3.275 6.960 1.00 0.00 N ATOM 1591 CA THR A 138 4.282 4.657 7.351 1.00 0.00 C ATOM 1592 C THR A 138 4.273 4.783 8.872 1.00 0.00 C ATOM 1593 O THR A 138 4.752 3.894 9.578 1.00 0.00 O ATOM 1594 CB THR A 138 2.938 5.139 6.782 1.00 0.00 C ATOM 1595 OG1 THR A 138 1.876 4.813 7.660 1.00 0.00 O ATOM 1596 CG2 THR A 138 2.596 4.559 5.427 1.00 0.00 C ATOM 0 H THR A 138 3.692 2.722 6.806 1.00 0.00 H new ATOM 0 HA THR A 138 5.080 5.280 6.947 1.00 0.00 H new ATOM 0 HB THR A 138 3.056 6.217 6.672 1.00 0.00 H new ATOM 0 HG1 THR A 138 1.563 3.904 7.471 1.00 0.00 H new ATOM 0 HG21 THR A 138 1.633 4.949 5.097 1.00 0.00 H new ATOM 0 HG22 THR A 138 3.366 4.837 4.707 1.00 0.00 H new ATOM 0 HG23 THR A 138 2.542 3.473 5.499 1.00 0.00 H new ATOM 1604 N ASP A 139 3.708 5.877 9.373 1.00 0.00 N ATOM 1605 CA ASP A 139 3.620 6.096 10.812 1.00 0.00 C ATOM 1606 C ASP A 139 2.504 5.242 11.414 1.00 0.00 C ATOM 1607 O ASP A 139 2.351 5.167 12.632 1.00 0.00 O ATOM 1608 CB ASP A 139 3.366 7.574 11.112 1.00 0.00 C ATOM 1609 CG ASP A 139 3.689 7.936 12.548 1.00 0.00 C ATOM 1610 OD1 ASP A 139 2.961 8.768 13.129 1.00 0.00 O ATOM 1611 OD2 ASP A 139 4.671 7.387 13.092 1.00 0.00 O ATOM 0 H ASP A 139 3.306 6.623 8.806 1.00 0.00 H new ATOM 0 HA ASP A 139 4.569 5.804 11.262 1.00 0.00 H new ATOM 0 HB2 ASP A 139 3.968 8.187 10.441 1.00 0.00 H new ATOM 0 HB3 ASP A 139 2.322 7.809 10.907 1.00 0.00 H new ATOM 1616 N SER A 140 1.729 4.599 10.542 1.00 0.00 N ATOM 1617 CA SER A 140 0.627 3.749 10.966 1.00 0.00 C ATOM 1618 C SER A 140 0.775 2.353 10.373 1.00 0.00 C ATOM 1619 O SER A 140 1.135 1.402 11.068 1.00 0.00 O ATOM 1620 CB SER A 140 -0.706 4.363 10.531 1.00 0.00 C ATOM 1621 OG SER A 140 -0.524 5.272 9.455 1.00 0.00 O ATOM 0 H SER A 140 1.849 4.654 9.531 1.00 0.00 H new ATOM 0 HA SER A 140 0.645 3.671 12.053 1.00 0.00 H new ATOM 0 HB2 SER A 140 -1.393 3.572 10.231 1.00 0.00 H new ATOM 0 HB3 SER A 140 -1.164 4.880 11.374 1.00 0.00 H new ATOM 0 HG SER A 140 -0.523 6.190 9.799 1.00 0.00 H new ATOM 1627 N LEU A 141 0.502 2.245 9.080 1.00 0.00 N ATOM 1628 CA LEU A 141 0.609 0.979 8.369 1.00 0.00 C ATOM 1629 C LEU A 141 1.389 1.162 7.071 1.00 0.00 C ATOM 1630 O LEU A 141 1.650 2.288 6.647 1.00 0.00 O ATOM 1631 CB LEU A 141 -0.783 0.417 8.070 1.00 0.00 C ATOM 1632 CG LEU A 141 -1.830 1.457 7.666 1.00 0.00 C ATOM 1633 CD1 LEU A 141 -2.745 0.903 6.586 1.00 0.00 C ATOM 1634 CD2 LEU A 141 -2.638 1.896 8.878 1.00 0.00 C ATOM 0 H LEU A 141 0.202 3.027 8.498 1.00 0.00 H new ATOM 0 HA LEU A 141 1.145 0.272 9.003 1.00 0.00 H new ATOM 0 HB2 LEU A 141 -0.697 -0.319 7.270 1.00 0.00 H new ATOM 0 HB3 LEU A 141 -1.141 -0.113 8.953 1.00 0.00 H new ATOM 0 HG LEU A 141 -1.313 2.328 7.263 1.00 0.00 H new ATOM 0 HD11 LEU A 141 -3.483 1.657 6.312 1.00 0.00 H new ATOM 0 HD12 LEU A 141 -2.154 0.638 5.709 1.00 0.00 H new ATOM 0 HD13 LEU A 141 -3.255 0.016 6.961 1.00 0.00 H new ATOM 0 HD21 LEU A 141 -3.378 2.636 8.573 1.00 0.00 H new ATOM 0 HD22 LEU A 141 -3.144 1.033 9.310 1.00 0.00 H new ATOM 0 HD23 LEU A 141 -1.971 2.334 9.620 1.00 0.00 H new ATOM 1646 N PRO A 142 1.798 0.056 6.431 1.00 0.00 N ATOM 1647 CA PRO A 142 2.566 0.100 5.191 1.00 0.00 C ATOM 1648 C PRO A 142 1.713 0.427 3.969 1.00 0.00 C ATOM 1649 O PRO A 142 0.692 -0.213 3.713 1.00 0.00 O ATOM 1650 CB PRO A 142 3.148 -1.317 5.065 1.00 0.00 C ATOM 1651 CG PRO A 142 2.818 -2.001 6.350 1.00 0.00 C ATOM 1652 CD PRO A 142 1.584 -1.323 6.871 1.00 0.00 C ATOM 0 HA PRO A 142 3.320 0.887 5.226 1.00 0.00 H new ATOM 0 HB2 PRO A 142 2.713 -1.845 4.217 1.00 0.00 H new ATOM 0 HB3 PRO A 142 4.225 -1.285 4.903 1.00 0.00 H new ATOM 0 HG2 PRO A 142 2.642 -3.065 6.192 1.00 0.00 H new ATOM 0 HG3 PRO A 142 3.640 -1.916 7.060 1.00 0.00 H new ATOM 0 HD2 PRO A 142 0.673 -1.750 6.451 1.00 0.00 H new ATOM 0 HD3 PRO A 142 1.501 -1.399 7.955 1.00 0.00 H new ATOM 1660 N LEU A 143 2.165 1.416 3.211 1.00 0.00 N ATOM 1661 CA LEU A 143 1.486 1.834 1.992 1.00 0.00 C ATOM 1662 C LEU A 143 2.001 1.019 0.818 1.00 0.00 C ATOM 1663 O LEU A 143 3.191 1.050 0.505 1.00 0.00 O ATOM 1664 CB LEU A 143 1.727 3.322 1.732 1.00 0.00 C ATOM 1665 CG LEU A 143 0.813 3.966 0.684 1.00 0.00 C ATOM 1666 CD1 LEU A 143 1.079 3.417 -0.709 1.00 0.00 C ATOM 1667 CD2 LEU A 143 -0.638 3.761 1.047 1.00 0.00 C ATOM 0 H LEU A 143 3.009 1.949 3.422 1.00 0.00 H new ATOM 0 HA LEU A 143 0.415 1.668 2.110 1.00 0.00 H new ATOM 0 HB2 LEU A 143 1.609 3.861 2.672 1.00 0.00 H new ATOM 0 HB3 LEU A 143 2.762 3.455 1.417 1.00 0.00 H new ATOM 0 HG LEU A 143 1.034 5.033 0.674 1.00 0.00 H new ATOM 0 HD11 LEU A 143 0.411 3.898 -1.423 1.00 0.00 H new ATOM 0 HD12 LEU A 143 2.114 3.617 -0.988 1.00 0.00 H new ATOM 0 HD13 LEU A 143 0.903 2.341 -0.716 1.00 0.00 H new ATOM 0 HD21 LEU A 143 -1.271 4.225 0.291 1.00 0.00 H new ATOM 0 HD22 LEU A 143 -0.854 2.694 1.095 1.00 0.00 H new ATOM 0 HD23 LEU A 143 -0.838 4.216 2.017 1.00 0.00 H new ATOM 1679 N VAL A 144 1.109 0.289 0.171 1.00 0.00 N ATOM 1680 CA VAL A 144 1.494 -0.532 -0.968 1.00 0.00 C ATOM 1681 C VAL A 144 1.748 0.342 -2.193 1.00 0.00 C ATOM 1682 O VAL A 144 0.815 0.783 -2.861 1.00 0.00 O ATOM 1683 CB VAL A 144 0.427 -1.598 -1.287 1.00 0.00 C ATOM 1684 CG1 VAL A 144 0.988 -2.644 -2.238 1.00 0.00 C ATOM 1685 CG2 VAL A 144 -0.079 -2.254 -0.007 1.00 0.00 C ATOM 0 H VAL A 144 0.119 0.247 0.411 1.00 0.00 H new ATOM 0 HA VAL A 144 2.415 -1.051 -0.703 1.00 0.00 H new ATOM 0 HB VAL A 144 -0.415 -1.105 -1.773 1.00 0.00 H new ATOM 0 HG11 VAL A 144 0.222 -3.389 -2.453 1.00 0.00 H new ATOM 0 HG12 VAL A 144 1.297 -2.163 -3.166 1.00 0.00 H new ATOM 0 HG13 VAL A 144 1.848 -3.130 -1.778 1.00 0.00 H new ATOM 0 HG21 VAL A 144 -0.831 -3.003 -0.255 1.00 0.00 H new ATOM 0 HG22 VAL A 144 0.753 -2.732 0.510 1.00 0.00 H new ATOM 0 HG23 VAL A 144 -0.521 -1.496 0.640 1.00 0.00 H new ATOM 1695 N ILE A 145 3.026 0.609 -2.461 1.00 0.00 N ATOM 1696 CA ILE A 145 3.420 1.455 -3.583 1.00 0.00 C ATOM 1697 C ILE A 145 3.372 0.717 -4.917 1.00 0.00 C ATOM 1698 O ILE A 145 3.237 1.343 -5.970 1.00 0.00 O ATOM 1699 CB ILE A 145 4.835 2.032 -3.383 1.00 0.00 C ATOM 1700 CG1 ILE A 145 5.862 0.904 -3.248 1.00 0.00 C ATOM 1701 CG2 ILE A 145 4.869 2.936 -2.160 1.00 0.00 C ATOM 1702 CD1 ILE A 145 7.120 1.136 -4.056 1.00 0.00 C ATOM 0 H ILE A 145 3.807 0.249 -1.913 1.00 0.00 H new ATOM 0 HA ILE A 145 2.693 2.267 -3.611 1.00 0.00 H new ATOM 0 HB ILE A 145 5.094 2.626 -4.259 1.00 0.00 H new ATOM 0 HG12 ILE A 145 6.130 0.790 -2.198 1.00 0.00 H new ATOM 0 HG13 ILE A 145 5.404 -0.034 -3.563 1.00 0.00 H new ATOM 0 HG21 ILE A 145 5.875 3.336 -2.031 1.00 0.00 H new ATOM 0 HG22 ILE A 145 4.166 3.758 -2.295 1.00 0.00 H new ATOM 0 HG23 ILE A 145 4.591 2.363 -1.276 1.00 0.00 H new ATOM 0 HD11 ILE A 145 7.803 0.299 -3.914 1.00 0.00 H new ATOM 0 HD12 ILE A 145 6.864 1.220 -5.112 1.00 0.00 H new ATOM 0 HD13 ILE A 145 7.600 2.057 -3.725 1.00 0.00 H new ATOM 1714 N SER A 146 3.481 -0.607 -4.882 1.00 0.00 N ATOM 1715 CA SER A 146 3.446 -1.389 -6.116 1.00 0.00 C ATOM 1716 C SER A 146 2.751 -2.733 -5.921 1.00 0.00 C ATOM 1717 O SER A 146 2.626 -3.229 -4.799 1.00 0.00 O ATOM 1718 CB SER A 146 4.865 -1.607 -6.649 1.00 0.00 C ATOM 1719 OG SER A 146 5.835 -1.081 -5.759 1.00 0.00 O ATOM 0 H SER A 146 3.593 -1.155 -4.029 1.00 0.00 H new ATOM 0 HA SER A 146 2.869 -0.819 -6.844 1.00 0.00 H new ATOM 0 HB2 SER A 146 5.042 -2.673 -6.795 1.00 0.00 H new ATOM 0 HB3 SER A 146 4.967 -1.131 -7.624 1.00 0.00 H new ATOM 0 HG SER A 146 6.731 -1.236 -6.124 1.00 0.00 H new ATOM 1725 N LEU A 147 2.305 -3.315 -7.032 1.00 0.00 N ATOM 1726 CA LEU A 147 1.623 -4.602 -7.017 1.00 0.00 C ATOM 1727 C LEU A 147 1.979 -5.391 -8.272 1.00 0.00 C ATOM 1728 O LEU A 147 2.388 -4.811 -9.277 1.00 0.00 O ATOM 1729 CB LEU A 147 0.107 -4.397 -6.935 1.00 0.00 C ATOM 1730 CG LEU A 147 -0.620 -5.324 -5.959 1.00 0.00 C ATOM 1731 CD1 LEU A 147 -0.910 -4.604 -4.652 1.00 0.00 C ATOM 1732 CD2 LEU A 147 -1.909 -5.841 -6.573 1.00 0.00 C ATOM 0 H LEU A 147 2.407 -2.908 -7.962 1.00 0.00 H new ATOM 0 HA LEU A 147 1.946 -5.164 -6.141 1.00 0.00 H new ATOM 0 HB2 LEU A 147 -0.090 -3.364 -6.646 1.00 0.00 H new ATOM 0 HB3 LEU A 147 -0.317 -4.536 -7.929 1.00 0.00 H new ATOM 0 HG LEU A 147 0.029 -6.174 -5.749 1.00 0.00 H new ATOM 0 HD11 LEU A 147 -1.427 -5.280 -3.971 1.00 0.00 H new ATOM 0 HD12 LEU A 147 0.027 -4.280 -4.199 1.00 0.00 H new ATOM 0 HD13 LEU A 147 -1.538 -3.735 -4.847 1.00 0.00 H new ATOM 0 HD21 LEU A 147 -2.412 -6.499 -5.864 1.00 0.00 H new ATOM 0 HD22 LEU A 147 -2.560 -5.001 -6.813 1.00 0.00 H new ATOM 0 HD23 LEU A 147 -1.682 -6.395 -7.483 1.00 0.00 H new ATOM 1744 N ASN A 148 1.844 -6.712 -8.212 1.00 0.00 N ATOM 1745 CA ASN A 148 2.177 -7.559 -9.357 1.00 0.00 C ATOM 1746 C ASN A 148 1.582 -7.024 -10.666 1.00 0.00 C ATOM 1747 O ASN A 148 0.408 -7.232 -10.964 1.00 0.00 O ATOM 1748 CB ASN A 148 1.713 -9.001 -9.107 1.00 0.00 C ATOM 1749 CG ASN A 148 0.230 -9.216 -9.368 1.00 0.00 C ATOM 1750 OD1 ASN A 148 -0.155 -9.761 -10.402 1.00 0.00 O ATOM 1751 ND2 ASN A 148 -0.609 -8.790 -8.431 1.00 0.00 N ATOM 0 H ASN A 148 1.510 -7.218 -7.392 1.00 0.00 H new ATOM 0 HA ASN A 148 3.261 -7.546 -9.466 1.00 0.00 H new ATOM 0 HB2 ASN A 148 2.287 -9.674 -9.744 1.00 0.00 H new ATOM 0 HB3 ASN A 148 1.935 -9.272 -8.075 1.00 0.00 H new ATOM 0 HD21 ASN A 148 -1.614 -8.910 -8.554 1.00 0.00 H new ATOM 0 HD22 ASN A 148 -0.248 -8.343 -7.588 1.00 0.00 H new ATOM 1758 N GLY A 149 2.417 -6.356 -11.456 1.00 0.00 N ATOM 1759 CA GLY A 149 1.972 -5.829 -12.738 1.00 0.00 C ATOM 1760 C GLY A 149 1.205 -4.523 -12.633 1.00 0.00 C ATOM 1761 O GLY A 149 0.416 -4.192 -13.519 1.00 0.00 O ATOM 0 H GLY A 149 3.395 -6.169 -11.233 1.00 0.00 H new ATOM 0 HA2 GLY A 149 2.841 -5.678 -13.379 1.00 0.00 H new ATOM 0 HA3 GLY A 149 1.341 -6.572 -13.226 1.00 0.00 H new ATOM 1765 N HIS A 150 1.435 -3.773 -11.562 1.00 0.00 N ATOM 1766 CA HIS A 150 0.757 -2.491 -11.368 1.00 0.00 C ATOM 1767 C HIS A 150 1.553 -1.600 -10.431 1.00 0.00 C ATOM 1768 O HIS A 150 2.321 -2.086 -9.599 1.00 0.00 O ATOM 1769 CB HIS A 150 -0.654 -2.688 -10.810 1.00 0.00 C ATOM 1770 CG HIS A 150 -1.338 -3.914 -11.321 1.00 0.00 C ATOM 1771 ND1 HIS A 150 -2.154 -3.921 -12.433 1.00 0.00 N ATOM 1772 CD2 HIS A 150 -1.316 -5.183 -10.863 1.00 0.00 C ATOM 1773 CE1 HIS A 150 -2.606 -5.146 -12.635 1.00 0.00 C ATOM 1774 NE2 HIS A 150 -2.111 -5.931 -11.696 1.00 0.00 N ATOM 0 H HIS A 150 2.082 -4.026 -10.816 1.00 0.00 H new ATOM 0 HA HIS A 150 0.682 -2.011 -12.344 1.00 0.00 H new ATOM 0 HB2 HIS A 150 -0.601 -2.739 -9.723 1.00 0.00 H new ATOM 0 HB3 HIS A 150 -1.258 -1.816 -11.059 1.00 0.00 H new ATOM 0 HD2 HIS A 150 -0.774 -5.543 -10.001 1.00 0.00 H new ATOM 0 HE1 HIS A 150 -3.267 -5.453 -13.432 1.00 0.00 H new ATOM 0 HE2 HIS A 150 -2.290 -6.931 -11.604 1.00 0.00 H new ATOM 1783 N THR A 151 1.370 -0.294 -10.568 1.00 0.00 N ATOM 1784 CA THR A 151 2.078 0.661 -9.732 1.00 0.00 C ATOM 1785 C THR A 151 1.184 1.833 -9.350 1.00 0.00 C ATOM 1786 O THR A 151 0.239 2.170 -10.063 1.00 0.00 O ATOM 1787 CB THR A 151 3.326 1.160 -10.450 1.00 0.00 C ATOM 1788 OG1 THR A 151 2.979 2.010 -11.528 1.00 0.00 O ATOM 1789 CG2 THR A 151 4.181 0.039 -11.001 1.00 0.00 C ATOM 0 H THR A 151 0.738 0.126 -11.249 1.00 0.00 H new ATOM 0 HA THR A 151 2.373 0.153 -8.814 1.00 0.00 H new ATOM 0 HB THR A 151 3.901 1.699 -9.697 1.00 0.00 H new ATOM 0 HG1 THR A 151 3.794 2.321 -11.975 1.00 0.00 H new ATOM 0 HG21 THR A 151 5.054 0.459 -11.500 1.00 0.00 H new ATOM 0 HG22 THR A 151 4.505 -0.606 -10.185 1.00 0.00 H new ATOM 0 HG23 THR A 151 3.600 -0.544 -11.715 1.00 0.00 H new ATOM 1797 N LEU A 152 1.487 2.443 -8.210 1.00 0.00 N ATOM 1798 CA LEU A 152 0.715 3.573 -7.710 1.00 0.00 C ATOM 1799 C LEU A 152 0.799 4.763 -8.654 1.00 0.00 C ATOM 1800 O LEU A 152 -0.170 5.504 -8.823 1.00 0.00 O ATOM 1801 CB LEU A 152 1.218 3.963 -6.321 1.00 0.00 C ATOM 1802 CG LEU A 152 0.310 3.551 -5.165 1.00 0.00 C ATOM 1803 CD1 LEU A 152 0.936 3.933 -3.833 1.00 0.00 C ATOM 1804 CD2 LEU A 152 -1.057 4.191 -5.316 1.00 0.00 C ATOM 0 H LEU A 152 2.267 2.171 -7.612 1.00 0.00 H new ATOM 0 HA LEU A 152 -0.331 3.273 -7.648 1.00 0.00 H new ATOM 0 HB2 LEU A 152 2.200 3.516 -6.168 1.00 0.00 H new ATOM 0 HB3 LEU A 152 1.352 5.044 -6.290 1.00 0.00 H new ATOM 0 HG LEU A 152 0.189 2.468 -5.187 1.00 0.00 H new ATOM 0 HD11 LEU A 152 0.275 3.632 -3.021 1.00 0.00 H new ATOM 0 HD12 LEU A 152 1.897 3.430 -3.725 1.00 0.00 H new ATOM 0 HD13 LEU A 152 1.086 5.012 -3.798 1.00 0.00 H new ATOM 0 HD21 LEU A 152 -1.694 3.889 -4.485 1.00 0.00 H new ATOM 0 HD22 LEU A 152 -0.953 5.276 -5.317 1.00 0.00 H new ATOM 0 HD23 LEU A 152 -1.508 3.869 -6.255 1.00 0.00 H new